Jump To Section:

Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References XML

Record Information

Version

5.0

Status

Detected but not Quantified

Creation Date

2021-09-10 23:15:41 UTC

Update Date

2021-09-26 22:55:08 UTC

HMDB ID

HMDB0246226

Secondary Accession Numbers

None

Metabolite Identification

Common Name

[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde

Description

[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Based on a literature review very few articles have been published on [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde. This compound has been identified in human blood as reported by (PMID: 31557052 ). [(s)-1-carboxy-2-phenyl-ethyl]-carbamoyl-arg-val-arg-aldehyde is not a naturally occurring metabolite and is only found in those individuals exposed to this compound or its derivatives. Technically [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde is part of the human exposome. The exposome can be defined as the collection of all the exposures of an individual in a lifetime and how those exposures relate to health. An individual's exposure begins before birth and includes insults from environmental and occupational sources.

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI


  Mrv1652309112101152D          

 43 43  0  0  0  0            999 V2000
   10.5098   -8.0128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8561   -8.5161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0934   -8.2015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9650   -9.3338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3113   -9.8371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4203  -10.6549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5486   -9.5226    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8949  -10.0258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1322   -9.7113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4785  -10.2145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -9.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0620  -10.4032    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2993  -10.0887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6456  -10.5920    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1904   -9.2709    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0038  -10.8436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3501  -11.3468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7277   -9.6484    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.3815   -9.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2725   -8.3274    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1442   -9.4597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2531  -10.2774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0158  -10.5920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1248  -11.4097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4710  -11.9130    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.5800  -12.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9262  -13.2340    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3427  -13.0453    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.7979   -8.9564    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.5606   -9.2709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6695  -10.0887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2143   -8.7677    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.9770   -9.0822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6307   -8.5790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3934   -8.8935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0472   -8.3903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8099   -8.7048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9188   -9.5226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2651  -10.0258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5024   -9.7113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0860   -9.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8487  -10.2145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4322  -10.4032    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
  8 16  1  0  0  0  0
 16 17  2  0  0  0  0
  4 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 21 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 37  1  0  0  0  0
 37 38  2  0  0  0  0
 38 39  1  0  0  0  0
 39 40  2  0  0  0  0
 35 40  1  0  0  0  0
 33 41  1  0  0  0  0
 41 42  2  0  0  0  0
 41 43  1  0  0  0  0
M  END

HMDB0246226
     RDKit          3D
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde
 87 87  0  0  0  0  0  0  0  0999 V2000
   -2.8093   -2.0989    3.2015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9653   -2.7718    1.8403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5536   -4.2325    1.9339 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1337   -2.1330    0.8042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7306   -2.1549    1.0212 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3236   -1.7904    0.1645 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0626   -1.3399   -0.9786 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7466   -1.9154    0.5590 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2644   -3.1303   -0.2564 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6767   -3.4820    0.0763 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1349   -4.6421   -0.7620 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5014   -4.9860   -0.4045 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7128   -6.1560    0.1549 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5993   -6.9951    0.3669 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0196   -6.5051    0.4985 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5675   -0.8194    0.3588 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5012   -0.4264   -0.6483 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5806   -1.1253   -1.6930 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2944    0.6669   -0.5000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2647    1.4456   -1.1523 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4591    2.8602   -0.8100 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3796    3.7968   -1.0045 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1301    4.3896   -2.2375 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1424    5.2899   -2.4540 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3059    5.6853   -1.4448 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5077    5.1293   -0.1933 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5225    4.2095    0.0069 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0967    1.3641   -2.6819 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1189    0.8377   -3.2163 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0981    1.9056   -3.4550 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6255   -0.7349    0.4546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7959    0.1452    0.0991 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9889   -0.3964    0.5104 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4724    0.9636    0.0967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8629    1.6313    1.3640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7986    0.9578    2.4051 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6377    0.7451   -0.7928 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3580    1.7637   -1.5119 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0382    2.9376   -0.9747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2845    3.9965   -0.3976 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8444    5.0998   -0.0777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2323    5.2841   -0.2879 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0783    6.1561    0.4512 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2337   -2.7739    3.8403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8047   -1.9415    3.6681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3742   -1.0749    3.0887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0215   -2.7571    1.5761 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5085   -4.3412    2.3288 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6901   -4.7281    0.9760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2207   -4.7017    2.7039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3053   -2.6480   -0.1914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4204   -2.5059    1.9912 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8557   -2.3289    1.6107 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1271   -2.8554   -1.3158 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5425   -3.9512   -0.0758 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6035   -3.9450    1.1364 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3826   -2.6764    0.2067 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0289   -4.4771   -1.8359 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4741   -5.5017   -0.5134 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2970   -7.7024   -0.3182 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0381   -6.8960    1.2728 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3687   -6.6441    1.4875 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7292   -6.6465   -0.2634 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4951   -0.0371    1.1357 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1286    1.1331    0.5339 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2501    0.8818   -1.0541 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7644    2.9674    0.2978 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4077    3.2024   -1.3258 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7591    4.1297   -3.0591 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9740    5.7327   -3.4509 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5346    6.3991   -1.6566 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8585    5.4358    0.6065 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6211    3.8185    1.0255 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3365    1.6112   -4.3978 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7026   -1.0485    0.8315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6498    1.4743   -0.3924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1811    2.6291    1.4029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3155   -0.0355   -1.5771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4387    0.1269   -0.2109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6670    2.1621   -2.3947 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1276    1.2303   -2.1952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6730    3.4379   -1.7937 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8584    2.5775   -0.2663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7688    4.9428   -1.1062 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8295    5.8068    0.4194 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2790    7.1443    0.1778 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3078    5.9490    1.1159 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  3
 13 14  1  0
 13 15  1  0
  8 16  1  0
 16 17  1  0
 17 18  2  0
 17 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  2  0
 20 28  1  0
 28 29  2  0
 28 30  1  0
  4 31  1  0
 31 32  2  0
 31 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  2  0
 34 37  1  0
 37 38  1  0
 38 39  1  0
 39 40  1  0
 40 41  2  3
 41 42  1  0
 41 43  1  0
 27 22  1  0
  1 44  1  0
  1 45  1  0
  1 46  1  0
  2 47  1  0
  3 48  1  0
  3 49  1  0
  3 50  1  0
  4 51  1  0
  5 52  1  0
  8 53  1  0
  9 54  1  0
  9 55  1  0
 10 56  1  0
 10 57  1  0
 11 58  1  0
 11 59  1  0
 14 60  1  0
 14 61  1  0
 15 62  1  0
 15 63  1  0
 16 64  1  0
 19 65  1  0
 20 66  1  0
 21 67  1  0
 21 68  1  0
 23 69  1  0
 24 70  1  0
 25 71  1  0
 26 72  1  0
 27 73  1  0
 30 74  1  0
 33 75  1  0
 34 76  1  0
 35 77  1  0
 37 78  1  0
 37 79  1  0
 38 80  1  0
 38 81  1  0
 39 82  1  0
 39 83  1  0
 42 84  1  0
 42 85  1  0
 43 86  1  0
 43 87  1  0
M  END


  Mrv1652309112101152D          

 43 43  0  0  0  0            999 V2000
   10.5098   -8.0128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8561   -8.5161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0934   -8.2015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9650   -9.3338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3113   -9.8371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4203  -10.6549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5486   -9.5226    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8949  -10.0258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1322   -9.7113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4785  -10.2145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -9.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0620  -10.4032    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2993  -10.0887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6456  -10.5920    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1904   -9.2709    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0038  -10.8436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3501  -11.3468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7277   -9.6484    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.3815   -9.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2725   -8.3274    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1442   -9.4597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2531  -10.2774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0158  -10.5920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1248  -11.4097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4710  -11.9130    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.5800  -12.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9262  -13.2340    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3427  -13.0453    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.7979   -8.9564    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.5606   -9.2709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6695  -10.0887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2143   -8.7677    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.9770   -9.0822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6307   -8.5790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3934   -8.8935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0472   -8.3903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8099   -8.7048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9188   -9.5226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2651  -10.0258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5024   -9.7113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0860   -9.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8487  -10.2145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4322  -10.4032    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
  8 16  1  0  0  0  0
 16 17  2  0  0  0  0
  4 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 21 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 37  1  0  0  0  0
 37 38  2  0  0  0  0
 38 39  1  0  0  0  0
 39 40  2  0  0  0  0
 35 40  1  0  0  0  0
 33 41  1  0  0  0  0
 41 42  2  0  0  0  0
 41 43  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0246226

> <DATABASE_NAME>
hmdb

> <SMILES>
CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(O)=O)C(=O)NC(CCCN=C(N)N)C=O

> <INCHI_IDENTIFIER>
InChI=1S/C27H44N10O6/c1-16(2)21(23(40)34-18(15-38)10-6-12-32-25(28)29)37-22(39)19(11-7-13-33-26(30)31)35-27(43)36-20(24(41)42)14-17-8-4-3-5-9-17/h3-5,8-9,15-16,18-21H,6-7,10-14H2,1-2H3,(H,34,40)(H,37,39)(H,41,42)(H4,28,29,32)(H4,30,31,33)(H2,35,36,43)

> <INCHI_KEY>
SDNYTAYICBFYFH-UHFFFAOYSA-N

> <FORMULA>
C27H44N10O6

> <MOLECULAR_WEIGHT>
604.713

> <EXACT_MASS>
604.344529177

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_ATOM_COUNT>
87

> <JCHEM_AVERAGE_POLARIZABILITY>
63.858655903433174

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-[({4-[(diaminomethylidene)amino]-1-{[1-({5-[(diaminomethylidene)amino]-1-oxopentan-2-yl}carbamoyl)-2-methylpropyl]carbamoyl}butyl}carbamoyl)amino]-3-phenylpropanoic acid

> <ALOGPS_LOGP>
-0.47

> <JCHEM_LOGP>
-3.378645324984637

> <ALOGPS_LOGS>
-4.32

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
12.249334591788998

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.395971656052776

> <JCHEM_PKA_STRONGEST_BASIC>
11.359578005788203

> <JCHEM_POLAR_SURFACE_AREA>
282.5

> <JCHEM_REFRACTIVITY>
157.64299999999994

> <JCHEM_ROTATABLE_BOND_COUNT>
19

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.90e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-[({4-[(diaminomethylidene)amino]-1-{[1-({5-[(diaminomethylidene)amino]-1-oxopentan-2-yl}carbamoyl)-2-methylpropyl]carbamoyl}butyl}carbamoyl)amino]-3-phenylpropanoic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0246226
     RDKit          3D
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde
 87 87  0  0  0  0  0  0  0  0999 V2000
   -2.8093   -2.0989    3.2015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9653   -2.7718    1.8403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5536   -4.2325    1.9339 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1337   -2.1330    0.8042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7306   -2.1549    1.0212 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3236   -1.7904    0.1645 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0626   -1.3399   -0.9786 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7466   -1.9154    0.5590 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2644   -3.1303   -0.2564 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6767   -3.4820    0.0763 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1349   -4.6421   -0.7620 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5014   -4.9860   -0.4045 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7128   -6.1560    0.1549 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5993   -6.9951    0.3669 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0196   -6.5051    0.4985 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5675   -0.8194    0.3588 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5012   -0.4264   -0.6483 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5806   -1.1253   -1.6930 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2944    0.6669   -0.5000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2647    1.4456   -1.1523 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4591    2.8602   -0.8100 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3796    3.7968   -1.0045 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1301    4.3896   -2.2375 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1424    5.2899   -2.4540 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3059    5.6853   -1.4448 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5077    5.1293   -0.1933 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5225    4.2095    0.0069 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0967    1.3641   -2.6819 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1189    0.8377   -3.2163 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0981    1.9056   -3.4550 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6255   -0.7349    0.4546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7959    0.1452    0.0991 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9889   -0.3964    0.5104 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4724    0.9636    0.0967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8629    1.6313    1.3640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7986    0.9578    2.4051 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6377    0.7451   -0.7928 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3580    1.7637   -1.5119 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0382    2.9376   -0.9747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2845    3.9965   -0.3976 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8444    5.0998   -0.0777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2323    5.2841   -0.2879 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0783    6.1561    0.4512 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2337   -2.7739    3.8403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8047   -1.9415    3.6681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3742   -1.0749    3.0887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0215   -2.7571    1.5761 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5085   -4.3412    2.3288 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6901   -4.7281    0.9760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2207   -4.7017    2.7039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3053   -2.6480   -0.1914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4204   -2.5059    1.9912 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8557   -2.3289    1.6107 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1271   -2.8554   -1.3158 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5425   -3.9512   -0.0758 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6035   -3.9450    1.1364 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3826   -2.6764    0.2067 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0289   -4.4771   -1.8359 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4741   -5.5017   -0.5134 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2970   -7.7024   -0.3182 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0381   -6.8960    1.2728 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3687   -6.6441    1.4875 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7292   -6.6465   -0.2634 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4951   -0.0371    1.1357 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1286    1.1331    0.5339 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2501    0.8818   -1.0541 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7644    2.9674    0.2978 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4077    3.2024   -1.3258 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7591    4.1297   -3.0591 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9740    5.7327   -3.4509 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5346    6.3991   -1.6566 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8585    5.4358    0.6065 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6211    3.8185    1.0255 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3365    1.6112   -4.3978 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7026   -1.0485    0.8315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6498    1.4743   -0.3924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1811    2.6291    1.4029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3155   -0.0355   -1.5771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4387    0.1269   -0.2109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6670    2.1621   -2.3947 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1276    1.2303   -2.1952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6730    3.4379   -1.7937 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8584    2.5775   -0.2663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7688    4.9428   -1.1062 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8295    5.8068    0.4194 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2790    7.1443    0.1778 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3078    5.9490    1.1159 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  3
 13 14  1  0
 13 15  1  0
  8 16  1  0
 16 17  1  0
 17 18  2  0
 17 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  2  0
 20 28  1  0
 28 29  2  0
 28 30  1  0
  4 31  1  0
 31 32  2  0
 31 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  2  0
 34 37  1  0
 37 38  1  0
 38 39  1  0
 39 40  1  0
 40 41  2  3
 41 42  1  0
 41 43  1  0
 27 22  1  0
  1 44  1  0
  1 45  1  0
  1 46  1  0
  2 47  1  0
  3 48  1  0
  3 49  1  0
  3 50  1  0
  4 51  1  0
  5 52  1  0
  8 53  1  0
  9 54  1  0
  9 55  1  0
 10 56  1  0
 10 57  1  0
 11 58  1  0
 11 59  1  0
 14 60  1  0
 14 61  1  0
 15 62  1  0
 15 63  1  0
 16 64  1  0
 19 65  1  0
 20 66  1  0
 21 67  1  0
 21 68  1  0
 23 69  1  0
 24 70  1  0
 25 71  1  0
 26 72  1  0
 27 73  1  0
 30 74  1  0
 33 75  1  0
 34 76  1  0
 35 77  1  0
 37 78  1  0
 37 79  1  0
 38 80  1  0
 38 81  1  0
 39 82  1  0
 39 83  1  0
 42 84  1  0
 42 85  1  0
 43 86  1  0
 43 87  1  0
M  END

HEADER    PROTEIN                                 11-SEP-21   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   11-SEP-21         0                                  
HETATM    1  C   UNK     0      19.618 -14.957   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      18.398 -15.897   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      16.974 -15.310   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      18.601 -17.423   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      17.381 -18.363   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      17.584 -19.889   0.000  0.00  0.00           O+0
HETATM    7  N   UNK     0      15.957 -17.775   0.000  0.00  0.00           N+0
HETATM    8  C   UNK     0      14.737 -18.715   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      13.313 -18.128   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      12.093 -19.067   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      10.669 -18.480   0.000  0.00  0.00           C+0
HETATM   12  N   UNK     0       9.449 -19.419   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0       8.025 -18.832   0.000  0.00  0.00           C+0
HETATM   14  N   UNK     0       6.805 -19.772   0.000  0.00  0.00           N+0
HETATM   15  N   UNK     0       7.822 -17.306   0.000  0.00  0.00           N+0
HETATM   16  C   UNK     0      14.941 -20.241   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      13.720 -21.181   0.000  0.00  0.00           O+0
HETATM   18  N   UNK     0      20.025 -18.010   0.000  0.00  0.00           N+0
HETATM   19  C   UNK     0      21.245 -17.071   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      21.042 -15.544   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0      22.669 -17.658   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      22.872 -19.185   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      24.296 -19.772   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      24.500 -21.298   0.000  0.00  0.00           C+0
HETATM   25  N   UNK     0      23.279 -22.238   0.000  0.00  0.00           N+0
HETATM   26  C   UNK     0      23.483 -23.764   0.000  0.00  0.00           C+0
HETATM   27  N   UNK     0      22.262 -24.703   0.000  0.00  0.00           N+0
HETATM   28  N   UNK     0      24.906 -24.351   0.000  0.00  0.00           N+0
HETATM   29  N   UNK     0      23.889 -16.719   0.000  0.00  0.00           N+0
HETATM   30  C   UNK     0      25.313 -17.306   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      25.516 -18.832   0.000  0.00  0.00           O+0
HETATM   32  N   UNK     0      26.533 -16.366   0.000  0.00  0.00           N+0
HETATM   33  C   UNK     0      27.957 -16.953   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      29.177 -16.014   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      30.601 -16.601   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      31.821 -15.662   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      33.245 -16.249   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0      33.448 -17.775   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0      32.228 -18.715   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0      30.804 -18.128   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0      28.160 -18.480   0.000  0.00  0.00           C+0
HETATM   42  O   UNK     0      29.584 -19.067   0.000  0.00  0.00           O+0
HETATM   43  O   UNK     0      26.940 -19.419   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5   18                                                  
CONECT    5    4    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8                                                       
CONECT    8    7    9   16                                                  
CONECT    9    8   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13                                                            
CONECT   16    8   17                                                       
CONECT   17   16                                                            
CONECT   18    4   19                                                       
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   22   29                                                  
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27   28                                                  
CONECT   27   26                                                            
CONECT   28   26                                                            
CONECT   29   21   30                                                       
CONECT   30   29   31   32                                                  
CONECT   31   30                                                            
CONECT   32   30   33                                                       
CONECT   33   32   34   41                                                  
CONECT   34   33   35                                                       
CONECT   35   34   36   40                                                  
CONECT   36   35   37                                                       
CONECT   37   36   38                                                       
CONECT   38   37   39                                                       
CONECT   39   38   40                                                       
CONECT   40   39   35                                                       
CONECT   41   33   42   43                                                  
CONECT   42   41                                                            
CONECT   43   41                                                            
MASTER        0    0    0    0    0    0    0    0   43    0   86    0
END

COMPND    HMDB0246226
HETATM    1  C1  UNL     1      -2.809  -2.099   3.201  1.00  0.00           C  
HETATM    2  C2  UNL     1      -2.965  -2.772   1.840  1.00  0.00           C  
HETATM    3  C3  UNL     1      -2.554  -4.233   1.934  1.00  0.00           C  
HETATM    4  C4  UNL     1      -2.134  -2.133   0.804  1.00  0.00           C  
HETATM    5  N1  UNL     1      -0.731  -2.155   1.021  1.00  0.00           N  
HETATM    6  C5  UNL     1       0.324  -1.790   0.165  1.00  0.00           C  
HETATM    7  O1  UNL     1       0.063  -1.340  -0.979  1.00  0.00           O  
HETATM    8  C6  UNL     1       1.747  -1.915   0.559  1.00  0.00           C  
HETATM    9  C7  UNL     1       2.264  -3.130  -0.256  1.00  0.00           C  
HETATM   10  C8  UNL     1       3.677  -3.482   0.076  1.00  0.00           C  
HETATM   11  C9  UNL     1       4.135  -4.642  -0.762  1.00  0.00           C  
HETATM   12  N2  UNL     1       5.501  -4.986  -0.404  1.00  0.00           N  
HETATM   13  C10 UNL     1       5.713  -6.156   0.155  1.00  0.00           C  
HETATM   14  N3  UNL     1       4.599  -6.995   0.367  1.00  0.00           N  
HETATM   15  N4  UNL     1       7.020  -6.505   0.499  1.00  0.00           N  
HETATM   16  N5  UNL     1       2.567  -0.819   0.359  1.00  0.00           N  
HETATM   17  C11 UNL     1       3.501  -0.426  -0.648  1.00  0.00           C  
HETATM   18  O2  UNL     1       3.581  -1.125  -1.693  1.00  0.00           O  
HETATM   19  N6  UNL     1       4.294   0.667  -0.500  1.00  0.00           N  
HETATM   20  C12 UNL     1       5.265   1.446  -1.152  1.00  0.00           C  
HETATM   21  C13 UNL     1       5.459   2.860  -0.810  1.00  0.00           C  
HETATM   22  C14 UNL     1       4.380   3.797  -1.005  1.00  0.00           C  
HETATM   23  C15 UNL     1       4.130   4.390  -2.237  1.00  0.00           C  
HETATM   24  C16 UNL     1       3.142   5.290  -2.454  1.00  0.00           C  
HETATM   25  C17 UNL     1       2.306   5.685  -1.445  1.00  0.00           C  
HETATM   26  C18 UNL     1       2.508   5.129  -0.193  1.00  0.00           C  
HETATM   27  C19 UNL     1       3.522   4.209   0.007  1.00  0.00           C  
HETATM   28  C20 UNL     1       5.097   1.364  -2.682  1.00  0.00           C  
HETATM   29  O3  UNL     1       4.119   0.838  -3.216  1.00  0.00           O  
HETATM   30  O4  UNL     1       6.098   1.906  -3.455  1.00  0.00           O  
HETATM   31  C21 UNL     1      -2.626  -0.735   0.455  1.00  0.00           C  
HETATM   32  O5  UNL     1      -1.796   0.145   0.099  1.00  0.00           O  
HETATM   33  N7  UNL     1      -3.989  -0.396   0.510  1.00  0.00           N  
HETATM   34  C22 UNL     1      -4.472   0.964   0.097  1.00  0.00           C  
HETATM   35  C23 UNL     1      -4.863   1.631   1.364  1.00  0.00           C  
HETATM   36  O6  UNL     1      -4.799   0.958   2.405  1.00  0.00           O  
HETATM   37  C24 UNL     1      -5.638   0.745  -0.793  1.00  0.00           C  
HETATM   38  C25 UNL     1      -6.358   1.764  -1.512  1.00  0.00           C  
HETATM   39  C26 UNL     1      -7.038   2.938  -0.975  1.00  0.00           C  
HETATM   40  N8  UNL     1      -6.284   3.996  -0.398  1.00  0.00           N  
HETATM   41  C27 UNL     1      -6.844   5.100  -0.078  1.00  0.00           C  
HETATM   42  N9  UNL     1      -8.232   5.284  -0.288  1.00  0.00           N  
HETATM   43  N10 UNL     1      -6.078   6.156   0.451  1.00  0.00           N  
HETATM   44  H1  UNL     1      -2.234  -2.774   3.840  1.00  0.00           H  
HETATM   45  H2  UNL     1      -3.805  -1.942   3.668  1.00  0.00           H  
HETATM   46  H3  UNL     1      -2.374  -1.075   3.089  1.00  0.00           H  
HETATM   47  H4  UNL     1      -4.022  -2.757   1.576  1.00  0.00           H  
HETATM   48  H5  UNL     1      -1.509  -4.341   2.329  1.00  0.00           H  
HETATM   49  H6  UNL     1      -2.690  -4.728   0.976  1.00  0.00           H  
HETATM   50  H7  UNL     1      -3.221  -4.702   2.704  1.00  0.00           H  
HETATM   51  H8  UNL     1      -2.305  -2.648  -0.191  1.00  0.00           H  
HETATM   52  H9  UNL     1      -0.420  -2.506   1.991  1.00  0.00           H  
HETATM   53  H10 UNL     1       1.856  -2.329   1.611  1.00  0.00           H  
HETATM   54  H11 UNL     1       2.127  -2.855  -1.316  1.00  0.00           H  
HETATM   55  H12 UNL     1       1.543  -3.951  -0.076  1.00  0.00           H  
HETATM   56  H13 UNL     1       3.603  -3.945   1.136  1.00  0.00           H  
HETATM   57  H14 UNL     1       4.383  -2.676   0.207  1.00  0.00           H  
HETATM   58  H15 UNL     1       4.029  -4.477  -1.836  1.00  0.00           H  
HETATM   59  H16 UNL     1       3.474  -5.502  -0.513  1.00  0.00           H  
HETATM   60  H17 UNL     1       4.297  -7.702  -0.318  1.00  0.00           H  
HETATM   61  H18 UNL     1       4.038  -6.896   1.273  1.00  0.00           H  
HETATM   62  H19 UNL     1       7.369  -6.644   1.488  1.00  0.00           H  
HETATM   63  H20 UNL     1       7.729  -6.646  -0.263  1.00  0.00           H  
HETATM   64  H21 UNL     1       2.495  -0.037   1.136  1.00  0.00           H  
HETATM   65  H22 UNL     1       4.129   1.133   0.534  1.00  0.00           H  
HETATM   66  H23 UNL     1       6.250   0.882  -1.054  1.00  0.00           H  
HETATM   67  H24 UNL     1       5.764   2.967   0.298  1.00  0.00           H  
HETATM   68  H25 UNL     1       6.408   3.202  -1.326  1.00  0.00           H  
HETATM   69  H26 UNL     1       4.759   4.130  -3.059  1.00  0.00           H  
HETATM   70  H27 UNL     1       2.974   5.733  -3.451  1.00  0.00           H  
HETATM   71  H28 UNL     1       1.535   6.399  -1.657  1.00  0.00           H  
HETATM   72  H29 UNL     1       1.858   5.436   0.607  1.00  0.00           H  
HETATM   73  H30 UNL     1       3.621   3.819   1.025  1.00  0.00           H  
HETATM   74  H31 UNL     1       6.337   1.611  -4.398  1.00  0.00           H  
HETATM   75  H32 UNL     1      -4.703  -1.049   0.832  1.00  0.00           H  
HETATM   76  H33 UNL     1      -3.650   1.474  -0.392  1.00  0.00           H  
HETATM   77  H34 UNL     1      -5.181   2.629   1.403  1.00  0.00           H  
HETATM   78  H35 UNL     1      -5.315  -0.036  -1.577  1.00  0.00           H  
HETATM   79  H36 UNL     1      -6.439   0.127  -0.211  1.00  0.00           H  
HETATM   80  H37 UNL     1      -5.667   2.162  -2.395  1.00  0.00           H  
HETATM   81  H38 UNL     1      -7.128   1.230  -2.195  1.00  0.00           H  
HETATM   82  H39 UNL     1      -7.673   3.438  -1.794  1.00  0.00           H  
HETATM   83  H40 UNL     1      -7.858   2.577  -0.266  1.00  0.00           H  
HETATM   84  H41 UNL     1      -8.769   4.943  -1.106  1.00  0.00           H  
HETATM   85  H42 UNL     1      -8.829   5.807   0.419  1.00  0.00           H  
HETATM   86  H43 UNL     1      -6.279   7.144   0.178  1.00  0.00           H  
HETATM   87  H44 UNL     1      -5.308   5.949   1.116  1.00  0.00           H  
CONECT    1    2   44   45   46
CONECT    2    3    4   47
CONECT    3   48   49   50
CONECT    4    5   31   51
CONECT    5    6   52
CONECT    6    7    7    8
CONECT    8    9   16   53
CONECT    9   10   54   55
CONECT   10   11   56   57
CONECT   11   12   58   59
CONECT   12   13   13
CONECT   13   14   15
CONECT   14   60   61
CONECT   15   62   63
CONECT   16   17   64
CONECT   17   18   18   19
CONECT   19   20   65
CONECT   20   21   28   66
CONECT   21   22   67   68
CONECT   22   23   23   27
CONECT   23   24   69
CONECT   24   25   25   70
CONECT   25   26   71
CONECT   26   27   27   72
CONECT   27   73
CONECT   28   29   29   30
CONECT   30   74
CONECT   31   32   32   33
CONECT   33   34   75
CONECT   34   35   37   76
CONECT   35   36   36   77
CONECT   37   38   78   79
CONECT   38   39   80   81
CONECT   39   40   82   83
CONECT   40   41   41
CONECT   41   42   43
CONECT   42   84   85
CONECT   43   86   87
END

HMDB0246226
     RDKit          3D
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde
 87 87  0  0  0  0  0  0  0  0999 V2000
   -2.8093   -2.0989    3.2015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9653   -2.7718    1.8403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5536   -4.2325    1.9339 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1337   -2.1330    0.8042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7306   -2.1549    1.0212 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3236   -1.7904    0.1645 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0626   -1.3399   -0.9786 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7466   -1.9154    0.5590 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2644   -3.1303   -0.2564 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6767   -3.4820    0.0763 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1349   -4.6421   -0.7620 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5014   -4.9860   -0.4045 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7128   -6.1560    0.1549 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5993   -6.9951    0.3669 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0196   -6.5051    0.4985 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5675   -0.8194    0.3588 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5012   -0.4264   -0.6483 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5806   -1.1253   -1.6930 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2944    0.6669   -0.5000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2647    1.4456   -1.1523 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4591    2.8602   -0.8100 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3796    3.7968   -1.0045 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1301    4.3896   -2.2375 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1424    5.2899   -2.4540 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3059    5.6853   -1.4448 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5077    5.1293   -0.1933 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5225    4.2095    0.0069 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0967    1.3641   -2.6819 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1189    0.8377   -3.2163 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0981    1.9056   -3.4550 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6255   -0.7349    0.4546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7959    0.1452    0.0991 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9889   -0.3964    0.5104 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4724    0.9636    0.0967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8629    1.6313    1.3640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7986    0.9578    2.4051 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6377    0.7451   -0.7928 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3580    1.7637   -1.5119 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0382    2.9376   -0.9747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2845    3.9965   -0.3976 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8444    5.0998   -0.0777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2323    5.2841   -0.2879 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0783    6.1561    0.4512 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2337   -2.7739    3.8403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8047   -1.9415    3.6681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3742   -1.0749    3.0887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0215   -2.7571    1.5761 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5085   -4.3412    2.3288 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6901   -4.7281    0.9760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2207   -4.7017    2.7039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3053   -2.6480   -0.1914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4204   -2.5059    1.9912 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8557   -2.3289    1.6107 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1271   -2.8554   -1.3158 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5425   -3.9512   -0.0758 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6035   -3.9450    1.1364 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3826   -2.6764    0.2067 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0289   -4.4771   -1.8359 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4741   -5.5017   -0.5134 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2970   -7.7024   -0.3182 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0381   -6.8960    1.2728 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3687   -6.6441    1.4875 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7292   -6.6465   -0.2634 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4951   -0.0371    1.1357 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1286    1.1331    0.5339 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2501    0.8818   -1.0541 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7644    2.9674    0.2978 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4077    3.2024   -1.3258 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7591    4.1297   -3.0591 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9740    5.7327   -3.4509 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5346    6.3991   -1.6566 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8585    5.4358    0.6065 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6211    3.8185    1.0255 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3365    1.6112   -4.3978 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7026   -1.0485    0.8315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6498    1.4743   -0.3924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1811    2.6291    1.4029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3155   -0.0355   -1.5771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4387    0.1269   -0.2109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6670    2.1621   -2.3947 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1276    1.2303   -2.1952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6730    3.4379   -1.7937 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8584    2.5775   -0.2663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7688    4.9428   -1.1062 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8295    5.8068    0.4194 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2790    7.1443    0.1778 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3078    5.9490    1.1159 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  3
 13 14  1  0
 13 15  1  0
  8 16  1  0
 16 17  1  0
 17 18  2  0
 17 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  2  0
 20 28  1  0
 28 29  2  0
 28 30  1  0
  4 31  1  0
 31 32  2  0
 31 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  2  0
 34 37  1  0
 37 38  1  0
 38 39  1  0
 39 40  1  0
 40 41  2  3
 41 42  1  0
 41 43  1  0
 27 22  1  0
  1 44  1  0
  1 45  1  0
  1 46  1  0
  2 47  1  0
  3 48  1  0
  3 49  1  0
  3 50  1  0
  4 51  1  0
  5 52  1  0
  8 53  1  0
  9 54  1  0
  9 55  1  0
 10 56  1  0
 10 57  1  0
 11 58  1  0
 11 59  1  0
 14 60  1  0
 14 61  1  0
 15 62  1  0
 15 63  1  0
 16 64  1  0
 19 65  1  0
 20 66  1  0
 21 67  1  0
 21 68  1  0
 23 69  1  0
 24 70  1  0
 25 71  1  0
 26 72  1  0
 27 73  1  0
 30 74  1  0
 33 75  1  0
 34 76  1  0
 35 77  1  0
 37 78  1  0
 37 79  1  0
 38 80  1  0
 38 81  1  0
 39 82  1  0
 39 83  1  0
 42 84  1  0
 42 85  1  0
 43 86  1  0
 43 87  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Not Available

Chemical Formula

C₂₇H₄₄N₁₀O₆

Average Molecular Weight

604.713

Monoisotopic Molecular Weight

604.344529177

IUPAC Name

2-[({4-[(diaminomethylidene)amino]-1-{[1-({5-[(diaminomethylidene)amino]-1-oxopentan-2-yl}carbamoyl)-2-methylpropyl]carbamoyl}butyl}carbamoyl)amino]-3-phenylpropanoic acid

Traditional Name

2-[({4-[(diaminomethylidene)amino]-1-{[1-({5-[(diaminomethylidene)amino]-1-oxopentan-2-yl}carbamoyl)-2-methylpropyl]carbamoyl}butyl}carbamoyl)amino]-3-phenylpropanoic acid

CAS Registry Number

Not Available

SMILES

CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(O)=O)C(=O)NC(CCCN=C(N)N)C=O

InChI Identifier

InChI=1S/C27H44N10O6/c1-16(2)21(23(40)34-18(15-38)10-6-12-32-25(28)29)37-22(39)19(11-7-13-33-26(30)31)35-27(43)36-20(24(41)42)14-17-8-4-3-5-9-17/h3-5,8-9,15-16,18-21H,6-7,10-14H2,1-2H3,(H,34,40)(H,37,39)(H,41,42)(H4,28,29,32)(H4,30,31,33)(H2,35,36,43)

InChI Key

SDNYTAYICBFYFH-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Dipeptides

Alternative Parents

Substituents

Alpha-dipeptide
Phenylalanine or derivatives
N-carbamoyl-alpha-amino acid
N-carbamoyl-alpha-amino acid or derivatives
N-acyl-alpha amino acid or derivatives
Valine or derivatives
Alpha-amino acid amide
3-phenylpropanoic-acid
N-substituted-alpha-amino acid
Amphetamine or derivatives
Alpha-amino acid or derivatives
Fatty acyl
Fatty amide
Benzenoid
N-acyl-amine
Monocyclic benzene moiety
Carboxamide group
Guanidine
Urea
Secondary carboxylic acid amide
Carbonic acid derivative
Organic 1,3-dipolar compound
Carboxylic acid
Propargyl-type 1,3-dipolar organic compound
Carboximidamide
Monocarboxylic acid or derivatives
Organic nitrogen compound
Aldehyde
Carbonyl group
Hydrocarbon derivative
Organic oxygen compound
Organopnictogen compound
Organic oxide
Organooxygen compound
Organonitrogen compound
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Non-excretory biofluid

Biofluid or Excreta

Blood (PMID: 31557052)

Process

Not Available

Role

Not Available

Physical Properties

State

Not Available

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
logP	-0.47	ALOGPS
logP	-3.4	ChemAxon
logS	-4.3	ALOGPS
pKa (Strongest Acidic)	3.4	ChemAxon
pKa (Strongest Basic)	11.36	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	12	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	282.5 Å²	ChemAxon
Rotatable Bond Count	19	ChemAxon
Refractivity	157.64 m³·mol⁻¹	ChemAxon
Polarizability	63.86 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	230.278	30932474
DeepCCS	[M-H]-	227.882	30932474
DeepCCS	[M-2H]-	260.767	30932474
DeepCCS	[M+Na]+	236.19	30932474
AllCCS	[M+H]+	241.9	32859911
AllCCS	[M+H-H2O]+	241.1	32859911
AllCCS	[M+NH4]+	242.5	32859911
AllCCS	[M+Na]+	242.7	32859911
AllCCS	[M-H]-	227.8	32859911
AllCCS	[M+Na-2H]-	231.1	32859911
AllCCS	[M+HCOO]-	234.8	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(O)=O)C(=O)NC(CCCN=C(N)N)C=O	3674.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(O)=O)C(=O)NC(CCCN=C(N)N)C=O	3674.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(O)=O)C(=O)NC(CCCN=C(N)N)C=O	5630.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(O)=O)C(=O)NC(CCCN=C(N)N)C=O	5630.7	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TMS,isomer #3	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	5338.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TMS,isomer #3	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	4385.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TMS,isomer #3	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	10242.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TMS,isomer #4	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5338.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TMS,isomer #4	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4385.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TMS,isomer #4	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	10242.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5223.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	4125.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	10191.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #10	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5233.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #10	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4212.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #10	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	10235.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5138.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	4137.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	10279.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5184.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	4139.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	10251.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5234.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	4133.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	10287.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #14	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	5443.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #14	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	4221.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #14	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	9652.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #15	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5396.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #15	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4327.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #15	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9721.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #16	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5202.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #16	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4308.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #16	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9948.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	5281.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	4387.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	9961.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5104.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4285.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9998.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5148.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4283.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9969.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5183.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4247.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9911.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #20	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5247.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #20	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4292.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #20	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9974.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #21	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5443.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #21	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4220.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #21	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	9652.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #22	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5203.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #22	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4309.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #22	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9947.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5104.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4285.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9998.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5148.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4283.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9969.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5246.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4293.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9974.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5282.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4384.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9961.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #27	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5023.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #27	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4315.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #27	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	10159.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #28	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4924.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #28	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4285.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #28	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	10179.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #29	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4975.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #29	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4267.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #29	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	10148.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #3	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5183.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #3	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4246.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #3	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9911.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4956.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4313.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	10109.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4981.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4258.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	10198.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5018.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4262.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	10171.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #4	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5007.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #4	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4268.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #4	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	10088.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4922.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4196.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	10122.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4953.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4235.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	10127.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5041.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4239.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	10112.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5417.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	4131.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	10067.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #9	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5423.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #9	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	4132.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TMS,isomer #9	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	10067.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5265.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3961.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9732.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #10	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5155.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #10	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4205.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #10	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9636.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4996.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4145.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9658.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5028.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4170.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9663.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5112.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4168.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9644.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #14	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5299.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #14	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4086.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #14	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	9263.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #15	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5092.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #15	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4208.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #15	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9615.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #16	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4997.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #16	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4143.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #16	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9658.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5029.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4169.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9663.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5111.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4166.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9644.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5156.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4209.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9636.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5270.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3962.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9732.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #20	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4938.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #20	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4236.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #20	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9849.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #21	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4861.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #21	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4199.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #21	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9861.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #22	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4885.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #22	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4209.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #22	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9864.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4864.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4223.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9822.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4879.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4161.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9882.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4901.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4178.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9888.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5497.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3865.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9431.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #27	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5467.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #27	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3949.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #27	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9548.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #28	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5297.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #28	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4038.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #28	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9762.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #29	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5333.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #29	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	4016.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #29	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9787.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #3	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5131.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #3	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4076.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #3	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9922.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5193.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3983.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9815.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5232.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3979.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9787.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5285.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	3992.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	9805.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #33	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5505.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #33	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	3868.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #33	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	9431.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #34	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5303.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #34	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4040.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #34	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9762.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #35	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5200.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #35	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3985.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #35	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9815.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #36	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5238.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #36	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3981.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #36	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9787.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #37	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5289.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #37	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3990.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #37	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9805.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #38	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5334.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #38	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4016.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #38	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9787.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #39	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5097.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #39	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4081.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #39	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	10009.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #4	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5039.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #4	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3989.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #4	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9958.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #40	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5049.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #40	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4082.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #40	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	10009.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #41	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5100.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #41	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4070.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #41	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9980.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #42	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5064.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #42	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	4074.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #42	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9946.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #43	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5050.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #43	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	4020.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #43	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	10052.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #44	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5078.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #44	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	4016.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #44	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	10026.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #45	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5469.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #45	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4155.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #45	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9044.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #46	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5324.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #46	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4165.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #46	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9284.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #47	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	5304.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #47	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	4179.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #47	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	9225.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #48	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5220.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #48	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4136.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #48	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9346.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #49	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5258.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #49	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4133.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #49	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9315.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5070.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	4016.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9964.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #50	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5354.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #50	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4123.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #50	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9318.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #51	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5469.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #51	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4153.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #51	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	9044.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #52	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5289.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #52	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4240.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #52	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9407.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #53	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5330.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #53	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4264.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #53	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9422.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #54	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5180.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #54	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4208.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #54	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9466.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #55	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5230.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #55	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4204.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #55	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9435.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #56	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5311.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #56	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4205.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #56	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9439.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #57	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5329.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #57	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4266.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #57	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9422.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #58	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5110.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #58	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4253.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #58	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9677.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #59	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5176.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #59	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4316.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #59	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9670.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5114.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	3983.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	9966.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #60	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5005.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #60	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4239.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #60	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9703.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #61	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5056.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #61	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4227.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #61	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9671.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #62	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5086.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #62	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4260.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #62	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9725.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #63	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5110.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #63	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4262.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #63	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9696.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #64	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5198.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #64	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4281.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #64	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9698.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #65	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5020.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #65	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4239.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #65	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9636.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #66	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5052.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #66	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4207.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #66	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9725.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #67	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5089.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #67	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4201.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #67	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9698.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #68	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5326.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #68	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4163.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #68	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9284.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #69	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5221.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #69	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4133.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #69	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	9346.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5299.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4086.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9263.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #70	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5259.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #70	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4131.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #70	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	9315.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #71	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5352.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #71	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4119.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #71	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	9318.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #72	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5305.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #72	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4185.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #72	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	9225.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #73	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5110.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #73	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4251.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #73	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9678.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #74	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5175.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #74	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4316.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #74	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9670.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #75	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5005.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #75	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4237.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #75	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9703.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #76	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5056.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #76	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4226.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #76	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9671.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #77	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5020.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #77	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4238.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #77	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9636.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #78	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5051.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #78	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4205.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #78	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9725.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #79	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5086.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #79	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4259.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #79	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9725.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5259.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4163.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9389.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #80	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5088.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #80	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4199.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #80	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9698.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #81	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5110.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #81	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4264.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #81	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9696.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #82	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5197.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #82	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4279.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #82	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9698.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #83	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4881.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #83	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4250.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #83	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9933.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #84	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4931.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #84	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4236.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #84	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9905.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #85	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4900.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #85	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4276.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #85	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9844.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #86	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4932.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #86	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4267.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #86	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9866.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #9	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5091.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #9	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4210.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,3TMS,isomer #9	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9615.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5371.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3765.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9086.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #10	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5083.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #10	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3880.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #10	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9516.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #100	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4986.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #100	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4012.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #100	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9784.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #101	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5025.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #101	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4003.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #101	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9758.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #102	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5024.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #102	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4056.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #102	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9686.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #103	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5014.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #103	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	4022.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #103	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	9723.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #104	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5522.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #104	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4040.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #104	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	8261.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #105	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5363.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #105	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4114.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #105	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	8686.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #106	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5326.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #106	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4091.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #106	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	8608.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #107	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5252.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #107	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4085.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #107	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	8753.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #108	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5300.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #108	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4076.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #108	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	8719.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #109	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5383.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #109	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4062.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #109	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	8721.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5112.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3901.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9522.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #110	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5357.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #110	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4097.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #110	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	8707.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #111	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5229.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #111	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4116.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #111	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	8965.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #112	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5207.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #112	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4154.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #112	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	8874.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #113	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5131.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #113	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4124.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #113	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	8999.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #114	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5175.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #114	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4112.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #114	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	8966.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #115	CC(C)C(NC(=O)C(CCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	5252.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #115	CC(C)C(NC(=O)C(CCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	4225.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #115	CC(C)C(NC(=O)C(CCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	8811.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #116	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5122.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #116	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4110.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #116	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	8941.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #117	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5134.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #117	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4110.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #117	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	8911.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #118	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5221.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #118	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4107.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #118	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	8908.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #119	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5130.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #119	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4099.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #119	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	8927.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5176.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3880.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9510.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #120	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5164.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #120	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4087.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #120	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9025.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #121	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5193.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #121	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4076.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #121	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	8999.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #122	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5363.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #122	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4117.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #122	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	8686.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #123	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5357.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #123	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4097.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #123	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	8707.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #124	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5253.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #124	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4086.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #124	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	8752.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #125	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5300.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #125	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4077.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #125	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	8719.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #126	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5382.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #126	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4064.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #126	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	8721.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #127	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5326.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #127	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4092.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #127	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	8608.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #128	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5195.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #128	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4185.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #128	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9150.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #129	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5233.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #129	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4226.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #129	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9142.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5224.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3899.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9498.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #130	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5234.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #130	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4225.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #130	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9142.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #131	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5093.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #131	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4183.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #131	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9180.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #132	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5135.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #132	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4177.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #132	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9147.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #133	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5136.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #133	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4177.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #133	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9200.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #134	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5156.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #134	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4176.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #134	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9172.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #135	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5241.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #135	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4173.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #135	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9173.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #136	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5241.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #136	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4224.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #136	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9164.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #137	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5095.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #137	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4170.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #137	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9113.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #138	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5115.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #138	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4148.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #138	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9205.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #139	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5135.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #139	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4178.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #139	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9200.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #14	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5028.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #14	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3987.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #14	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9713.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #140	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5148.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #140	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4137.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #140	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9179.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #141	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5156.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #141	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4178.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #141	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9172.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #142	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5240.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #142	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4174.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #142	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9173.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #143	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5121.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #143	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4260.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #143	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9431.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #144	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4966.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #144	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4199.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #144	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9453.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #145	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5010.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #145	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4190.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #145	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9426.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #146	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5034.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #146	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4243.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #146	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9459.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #147	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5067.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #147	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4241.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #147	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9430.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #148	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4968.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #148	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4221.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #148	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9364.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #149	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5030.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #149	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4229.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #149	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9396.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #15	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4994.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #15	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3999.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #15	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9712.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #150	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5043.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #150	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4206.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #150	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9480.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #151	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5062.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #151	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4200.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #151	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9455.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #152	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4986.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #152	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4201.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #152	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9388.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #153	CC(C)C(C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5228.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #153	CC(C)C(C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4116.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #153	CC(C)C(C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	8965.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #154	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5208.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #154	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4157.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #154	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	8874.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #155	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5133.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #155	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4124.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #155	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	8999.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #156	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5176.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #156	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4114.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #156	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	8966.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #157	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5131.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #157	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4103.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #157	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	8927.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #158	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5163.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #158	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4086.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #158	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	9025.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #159	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5122.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #159	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4117.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #159	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	8941.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #16	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5014.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #16	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4009.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #16	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9716.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #160	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5191.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #160	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4076.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #160	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	8999.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #161	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5135.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #161	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4112.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #161	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	8911.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #162	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5219.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #162	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4109.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #162	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	8908.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #163	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5253.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #163	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4227.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #163	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	8811.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #164	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5119.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #164	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	4262.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #164	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9431.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #165	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4966.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #165	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4197.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #165	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9453.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #166	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5010.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #166	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4188.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #166	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9426.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #167	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5034.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #167	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4246.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #167	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9459.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #168	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5067.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #168	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	4244.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #168	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9430.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #169	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4969.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #169	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4224.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #169	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9364.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	4985.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	4001.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9677.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #170	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4986.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #170	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4202.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #170	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9388.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #171	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5030.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #171	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4232.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #171	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9396.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #172	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5042.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #172	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4207.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #172	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9480.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #173	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5062.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #173	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4202.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #173	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9455.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #174	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4879.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #174	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4265.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #174	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9602.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	4994.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	3930.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	9746.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5003.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	3947.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	9753.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5329.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3826.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9256.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #20	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5324.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #20	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4030.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #20	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	8667.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #21	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5210.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #21	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4085.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #21	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	8924.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #22	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5185.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #22	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4049.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #22	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	8865.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5103.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4027.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	8971.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5123.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4050.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	8977.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5222.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4032.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	8957.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5323.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4032.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	8667.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #27	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5154.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #27	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4146.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #27	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9108.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #28	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5187.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #28	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4117.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #28	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9127.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #29	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5044.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #29	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4086.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #29	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9151.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #3	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5182.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #3	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3944.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #3	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9478.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	5085.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4110.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9156.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5160.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4091.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9140.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5187.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4117.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9127.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #33	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5021.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #33	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4172.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #33	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9384.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #34	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5093.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #34	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4201.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #34	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9382.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #35	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4944.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #35	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4152.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #35	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9398.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #36	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4965.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #36	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4164.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #36	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9401.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #37	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5019.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #37	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4137.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #37	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9423.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #38	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5018.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #38	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4160.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #38	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9429.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #39	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	5081.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #39	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4146.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #39	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9408.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #4	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5225.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #4	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3899.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #4	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9498.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #40	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4928.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #40	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4159.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #40	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9360.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #41	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4940.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #41	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4111.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #41	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9420.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #42	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4964.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #42	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4125.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #42	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9427.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #43	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5211.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #43	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4089.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #43	CC(C)C(C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	8924.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #44	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5104.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #44	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4030.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #44	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	8971.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #45	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5123.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #45	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	4054.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #45	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	8977.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #46	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5221.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #46	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4034.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #46	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	8957.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #47	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5186.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #47	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4051.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #47	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	8865.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #48	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5021.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #48	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4172.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #48	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9384.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #49	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5093.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #49	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	4203.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #49	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9382.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5080.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3879.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9516.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #50	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4946.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #50	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4154.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #50	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9398.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #51	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4966.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #51	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4167.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #51	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9401.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #52	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4929.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #52	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	4161.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #52	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C	9360.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #53	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4940.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #53	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4111.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #53	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9420.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #54	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5017.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #54	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4140.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #54	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9423.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #55	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4963.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #55	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	4125.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #55	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9427.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #56	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5018.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #56	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	4163.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #56	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9429.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #57	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5081.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #57	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4148.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #57	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9408.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #58	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4850.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #58	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4184.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #58	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9629.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #59	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4873.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #59	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4191.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #59	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9633.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5109.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3900.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9522.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #60	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4870.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #60	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4225.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #60	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9569.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #61	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4875.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #61	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	4205.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #61	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C	9592.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #62	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5528.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #62	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3750.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #62	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	8883.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #63	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5400.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #63	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3844.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #63	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9096.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #64	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5353.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #64	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3820.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #64	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9040.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #65	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5284.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #65	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3806.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #65	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9156.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #66	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5316.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #66	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3795.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #66	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9128.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #67	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5384.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #67	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	3807.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #67	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	9122.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #68	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5531.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #68	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	3751.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #68	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	8884.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #69	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5362.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #69	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3904.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #69	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9265.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5172.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	3879.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	9510.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #70	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5377.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #70	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3883.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #70	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9285.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #71	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5247.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #71	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3865.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #71	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9321.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #72	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5285.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #72	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3852.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #72	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9292.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #73	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5336.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #73	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3872.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #73	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9295.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #74	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5372.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #74	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3882.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #74	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9285.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #75	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5165.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #75	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3969.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #75	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9530.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #76	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5264.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #76	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3997.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #76	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9520.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #77	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5110.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #77	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	3965.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #77	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9548.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #78	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5156.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #78	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	3955.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #78	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9519.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #79	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5160.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #79	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3936.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #79	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9571.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5376.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	3767.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	9086.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #80	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5182.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #80	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3935.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #80	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9545.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #81	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5236.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #81	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	3967.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #81	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	9553.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #82	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	5102.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #82	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	3947.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #82	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N	9487.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #83	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5110.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #83	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	3929.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #83	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	9578.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #84	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	5131.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #84	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	3919.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #84	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N)[Si](C)(C)C	9553.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #85	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5406.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #85	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3847.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #85	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9097.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #86	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5290.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #86	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	3808.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #86	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	9156.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #87	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	5322.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #87	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	3797.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #87	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C	9128.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #88	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5386.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #88	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	3810.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #88	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	9122.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #89	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5354.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #89	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	3822.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #89	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	9040.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #9	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	5187.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #9	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	3945.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #9	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C)[Si](C)(C)C	9478.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #90	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5172.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #90	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3970.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #90	CC(C)C(C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9530.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #91	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	5265.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #91	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	3998.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #91	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C	9520.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #92	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5117.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #92	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	3966.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #92	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9548.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #93	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	5164.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #93	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	3957.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #93	CC(C)C(C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C	9520.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #94	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	5107.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #94	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	3948.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #94	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C	9487.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #95	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5116.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #95	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3930.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #95	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9578.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #96	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5161.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #96	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3937.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #96	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9571.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #97	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	5138.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #97	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	3921.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #97	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N[Si](C)(C)C)[Si](C)(C)C	9553.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #98	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	5183.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #98	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	3936.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #98	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C)C(=O)NC(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C	9545.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #99	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5240.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #99	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3968.3	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,4TMS,isomer #99	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C)CCCN=C(N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	9553.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TBDMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5308.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TBDMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4511.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TBDMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	10262.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TBDMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	5399.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TBDMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	4492.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,1TBDMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	10279.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	5587.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	4415.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #1	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	10014.4	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #10	CC(C)C(C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	5611.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #10	CC(C)C(C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	4477.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #10	CC(C)C(C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	10048.6	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	5533.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	4408.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #11	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	10082.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	5558.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	4422.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #12	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	10060.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	5604.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	4376.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #13	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	10075.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #14	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	5726.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #14	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	4493.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #14	CC(C)C(NC(=O)C(CCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	9286.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #15	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	5695.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #15	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	4550.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #15	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	9450.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #16	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	5579.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #16	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	4578.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #16	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	9686.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	5596.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	4646.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #17	CC(C)C(NC(=O)C(CCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N	9711.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5494.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4558.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #18	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9723.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5511.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4557.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #19	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9700.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5552.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4534.4	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #2	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9661.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #20	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	5609.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #20	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	4564.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #20	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	9706.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #21	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5726.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #21	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	4492.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #21	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	9286.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #22	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	5580.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #22	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	4579.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #22	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	9686.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	5494.8	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	4558.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #23	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	9723.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	5512.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	4558.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #24	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	9700.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5609.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4564.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #25	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)N(C(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	9706.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5597.2	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4646.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #26	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(C=O)CCCN=C(N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	9711.7	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #27	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	5427.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #27	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	4612.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #27	CC(C)C(C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C	9932.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #28	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5320.4	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #28	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4578.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #28	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	9947.3	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #29	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5374.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #29	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4567.9	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #29	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	9921.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #3	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	5552.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #3	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	4534.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #3	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N[Si](C)(C)C(C)(C)C	9661.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5374.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4590.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #30	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9904.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	5389.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	4562.8	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #31	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	9960.1	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	5413.6	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	4565.2	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #32	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O)[Si](C)(C)C(C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	9938.8	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #4	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5426.0	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #4	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4572.0	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #4	CC(C)C(C(=O)NC(C=O)CCCN=C(N)N)N(C(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	9874.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5339.5	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4527.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #5	CC(C)C(NC(=O)C(CCCN=C(N)N)N(C(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9897.0	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	5359.3	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	4557.7	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #6	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)N(C(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)NC(C=O)CCCN=C(N)N	9903.5	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	5454.9	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	4548.1	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #7	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O[Si](C)(C)C(C)(C)C)C(=O)N(C(C=O)CCCN=C(N)N)[Si](C)(C)C(C)(C)C	9892.9	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	5724.7	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	4360.5	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #8	CC(C)C(NC(=O)C(CCCN=C(N)N[Si](C)(C)C(C)(C)C)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N	9850.2	Standard polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #9	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N[Si](C)(C)C(C)(C)C	5731.1	Semi standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #9	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N[Si](C)(C)C(C)(C)C	4362.6	Standard non polar	33892256
[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde,2TBDMS,isomer #9	CC(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)NC(=CO[Si](C)(C)C(C)(C)C)CCCN=C(N)N[Si](C)(C)C(C)(C)C	9850.3	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TMS_1_1) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TBDMS_1_1) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TBDMS_1_2) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TBDMS_1_3) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TBDMS_1_4) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TBDMS_1_5) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde GC-MS (TBDMS_1_6) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde 10V, Positive-QTOF	splash10-059b-0439153000-5cdad19ff5663369a5c4	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde 20V, Positive-QTOF	splash10-0feb-0911000000-495176e502c8f66f2922	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde 40V, Positive-QTOF	splash10-03fr-1921000000-2ae06326382ddb0372da	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde 10V, Negative-QTOF	splash10-114l-0900424000-83285004b0554f8cf084	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde 20V, Negative-QTOF	splash10-08g3-1202490000-f8bebaaf3f85ee5c6250	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde 40V, Negative-QTOF	splash10-052f-9810000000-bcecd322c8d6f0551ddf	2021-10-12	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-10-13	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Blood

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Detected but not Quantified	Not Quantified	Not Specified	Not Specified	Normal	31557052	details

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

2120

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

2205

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Barupal DK, Fiehn O: Generating the Blood Exposome Database Using a Comprehensive Text Mining and Database Fusion Approach. Environ Health Perspect. 2019 Sep;127(9):97008. doi: 10.1289/EHP4713. Epub 2019 Sep 26. [PubMed:31557052 ]

Showing metabocard for [(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde (HMDB0246226)

MOL for HMDB0246226 ([(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde)

3D MOL for HMDB0246226 ([(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde)

3D SDF for HMDB0246226 ([(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde)

3D-SDF for HMDB0246226 ([(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde)

PDB for HMDB0246226 ([(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde)

3D PDB for HMDB0246226 ([(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde)

SMILES for HMDB0246226 ([(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde)

INCHI for HMDB0246226 ([(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde)

Structure for HMDB0246226 ([(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde)

3D Structure for HMDB0246226 ([(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehyde)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra