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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 17:36:55 UTC

Update Date

2022-03-07 02:52:33 UTC

HMDB ID

HMDB0030459

Secondary Accession Numbers

HMDB30459

Metabolite Identification

Common Name

Hordatine B

Description

Hordatine B belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety. Hordatine B has been detected, but not quantified in, a few different foods, such as barleys (Hordeum vulgare), breakfast cereal, and cereals and cereal products. This could make hordatine b a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Hordatine B.

Structure

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


  Mrv0541 02241218332D          

 42 44  0  0  0  0            999 V2000
    0.5768    0.4118    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2476    0.4947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7418   -0.1647    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5768   -0.9068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1647   -1.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6597   -1.8139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4018   -2.0618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0618   -1.4839    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1439    2.6389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3197    2.6389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8247    1.9789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3197    1.3189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1439    1.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5568    1.9789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3811    1.9789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6389    2.3911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8968    2.7211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2368    2.3089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4118    2.6389    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0003    1.8968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8968    3.6282    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6389    3.9582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1547   -0.4947    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8968   -0.7418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4739   -0.1647    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7211   -1.0718    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9789   -1.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9789   -2.2268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2368   -2.7211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2368   -3.5461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5768   -3.9582    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0003   -2.8039    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1647   -3.5461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9068   -3.8761    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2 21  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8 32  1  0  0  0  0
  9 10  1  0  0  0  0
  9 14  2  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 20  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 16 17  1  0  0  0  0
 16 24  2  0  0  0  0
 17 18  2  0  0  0  0
 17 29  1  0  0  0  0
 18 19  1  0  0  0  0
 18 22  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  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
 27 28  2  0  0  0  0
 27 34  1  0  0  0  0
 29 30  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 39 41  1  0  0  0  0
 40 41  1  0  0  0  0
 41 42  2  0  0  0  0
M  END

HMDB0030459
     RDKit          3D
Hordatine B
 82 84  0  0  0  0  0  0  0  0999 V2000
    2.4623   -3.8338    1.4093 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1438   -3.6221    1.0487 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6477   -2.8146    0.0865 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5427   -2.0624   -0.6871 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1663   -1.2105   -1.6824 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9915   -0.3192   -2.4409 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0059    0.3223   -2.0214 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5635    0.3417   -0.7144 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1567   -0.2100    0.3291 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7757    1.1032   -0.5547 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3802    1.1544    0.7402 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6465    1.9880    0.7154 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6628    1.4163   -0.2318 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9375    2.1874   -0.3252 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6294    2.2766    0.9392 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1777    3.0211    2.0544 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3282    2.5614    3.2391 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5579    4.2785    1.8750 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2320   -1.1104   -1.9251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1265   -1.8225   -1.1999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6873   -2.6689   -0.1990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7506   -3.2941    0.4150 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9604   -2.8842   -0.1897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5818   -4.1259   -0.7524 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8230   -5.0234   -1.4821 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3807   -6.1742   -2.0053 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7127   -6.4756   -1.8226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2983   -7.6266   -2.3382 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4737   -5.5843   -1.0958 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9147   -4.4359   -0.5745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6217   -1.8993   -1.2537 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2045   -0.5689   -1.0403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4313    0.3966   -0.8289 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6035   -0.3126   -1.0600 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1630    0.9824   -0.8500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8282    1.5728    0.5071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4755    2.9290    0.5967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2112    3.6146    1.9181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8873    4.9106    1.8788 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2995    4.9729    1.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9145    4.8755    3.0109 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9860    5.1356    0.6540 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8861   -2.8549    1.7786 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0373   -4.0333    0.4579 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6438   -4.6502    2.0985 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6082   -2.2515   -0.5232 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6711   -0.2047   -3.5360 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5191    0.9518   -2.7880 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1739    1.5866   -1.3571 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6456    0.1009    1.0300 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6744    1.5057    1.5086 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4383    3.0445    0.5322 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0377    1.9345    1.7750 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1912    1.4179   -1.2587 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8810    0.3379    0.0166 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6948    3.2181   -0.7219 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6335    1.7059   -1.0667 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5506    1.7315    1.0219 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7824    1.6331    3.4340 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8721    4.9200    1.1167 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7787    4.5229    2.5367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5500   -0.4475   -2.7083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6490   -2.4675    0.5768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7663   -4.7666   -1.6174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7751   -6.8668   -2.5742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3114   -8.4865   -1.7804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5342   -5.8224   -0.9490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5127   -3.7326   -0.0013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9548   -2.2567   -2.2490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2522   -1.1308   -1.2402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2570    0.9395   -1.0147 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7586    1.7028   -1.6030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2198    0.9278    1.3164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7488    1.6903    0.5826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5566    2.8157    0.4195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0138    3.5658   -0.1986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6489    3.0295    2.7522 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.3597    5.8014    1.8559 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4187    4.7570    3.9008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9080    5.9983    0.0834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5951    4.3729    0.3048 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  2  3
 16 18  1  0
  5 19  2  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  2  0
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 26 27  2  0
 27 28  1  0
 27 29  1  0
 29 30  2  0
 23 31  1  0
 31 32  1  0
 32 33  2  0
 32 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  1  0
 37 38  1  0
 38 39  1  0
 39 40  1  0
 40 41  2  3
 40 42  1  0
 21  3  1  0
 30 24  1  0
 31 20  1  0
  1 43  1  0
  1 44  1  0
  1 45  1  0
  4 46  1  0
  6 47  1  0
  7 48  1  0
 10 49  1  0
 11 50  1  0
 11 51  1  0
 12 52  1  0
 12 53  1  0
 13 54  1  0
 13 55  1  0
 14 56  1  0
 14 57  1  0
 15 58  1  0
 17 59  1  0
 18 60  1  0
 18 61  1  0
 19 62  1  0
 23 63  1  0
 25 64  1  0
 26 65  1  0
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 30 68  1  0
 31 69  1  0
 34 70  1  0
 35 71  1  0
 35 72  1  0
 36 73  1  0
 36 74  1  0
 37 75  1  0
 37 76  1  0
 38 77  1  0
 38 78  1  0
 39 79  1  0
 41 80  1  0
 42 81  1  0
 42 82  1  0
M  END


  Mrv0541 02241218332D          

 42 44  0  0  0  0            999 V2000
    0.5768    0.4118    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2476    0.4947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7418   -0.1647    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5768   -0.9068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1647   -1.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6597   -1.8139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4018   -2.0618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0618   -1.4839    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1439    2.6389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3197    2.6389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8247    1.9789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3197    1.3189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1439    1.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5568    1.9789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3811    1.9789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6389    2.3911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8968    2.7211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2368    2.3089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4118    2.6389    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0003    1.8968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4947    1.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2368    1.4839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9789    1.1539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7211    1.5668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3811    1.0718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3811    0.2468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7211   -0.1647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8968    0.0003    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8968    3.6282    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6389    3.9582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1547   -0.4947    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8968   -0.7418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4739   -0.1647    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7211   -1.0718    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9789   -1.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9789   -2.2268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2368   -2.7211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2368   -3.5461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5768   -3.9582    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0003   -2.8039    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1647   -3.5461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9068   -3.8761    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2 21  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8 32  1  0  0  0  0
  9 10  1  0  0  0  0
  9 14  2  0  0  0  0
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 11 12  1  0  0  0  0
 11 20  1  0  0  0  0
 12 13  2  0  0  0  0
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 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
 27 28  2  0  0  0  0
 27 34  1  0  0  0  0
 29 30  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 39 41  1  0  0  0  0
 40 41  1  0  0  0  0
 41 42  2  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0030459

> <DATABASE_NAME>
hmdb

> <SMILES>
COC1=C2OC(C(C(=O)NCCCCNC(N)=N)C2=CC(\C=C/C(=O)NCCCCNC(N)=N)=C1)C1=CC=C(O)C=C1

> <INCHI_IDENTIFIER>
InChI=1S/C29H40N8O5/c1-41-22-17-18(6-11-23(39)34-12-2-4-14-36-28(30)31)16-21-24(27(40)35-13-3-5-15-37-29(32)33)25(42-26(21)22)19-7-9-20(38)10-8-19/h6-11,16-17,24-25,38H,2-5,12-15H2,1H3,(H,34,39)(H,35,40)(H4,30,31,36)(H4,32,33,37)/b11-6-

> <INCHI_KEY>
LRLXAXGCQUOKIO-WDZFZDKYSA-N

> <FORMULA>
C29H40N8O5

> <MOLECULAR_WEIGHT>
580.6785

> <EXACT_MASS>
580.31216643

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
62.90308700294213

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
N-(4-carbamimidamidobutyl)-5-[(1Z)-2-[(4-carbamimidamidobutyl)carbamoyl]eth-1-en-1-yl]-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide

> <ALOGPS_LOGP>
1.22

> <JCHEM_LOGP>
-0.2012811464481761

> <ALOGPS_LOGS>
-4.08

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
2

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.466796527120472

> <JCHEM_PKA_STRONGEST_BASIC>
12.42492104006033

> <JCHEM_POLAR_SURFACE_AREA>
220.69

> <JCHEM_REFRACTIVITY>
181.43209999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
15

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
4.86e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
N-(4-carbamimidamidobutyl)-5-[(1Z)-2-[(4-carbamimidamidobutyl)carbamoyl]eth-1-en-1-yl]-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0030459
     RDKit          3D
Hordatine B
 82 84  0  0  0  0  0  0  0  0999 V2000
    2.4623   -3.8338    1.4093 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6477   -2.8146    0.0865 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5427   -2.0624   -0.6871 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1663   -1.2105   -1.6824 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9915   -0.3192   -2.4409 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0059    0.3223   -2.0214 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5635    0.3417   -0.7144 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1567   -0.2100    0.3291 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7757    1.1032   -0.5547 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3802    1.1544    0.7402 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6465    1.9880    0.7154 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6628    1.4163   -0.2318 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9375    2.1874   -0.3252 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.4737   -5.5843   -1.0958 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6217   -1.8993   -1.2537 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4313    0.3966   -0.8289 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.8282    1.5728    0.5071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4755    2.9290    0.5967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2112    3.6146    1.9181 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -7.2995    4.9729    1.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.1912    1.4179   -1.2587 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8810    0.3379    0.0166 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6948    3.2181   -0.7219 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6335    1.7059   -1.0667 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5506    1.7315    1.0219 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7824    1.6331    3.4340 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8721    4.9200    1.1167 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7787    4.5229    2.5367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5500   -0.4475   -2.7083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6490   -2.4675    0.5768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7663   -4.7666   -1.6174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7751   -6.8668   -2.5742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3114   -8.4865   -1.7804 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.7488    1.6903    0.5826 H   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0
  2  3  1  0
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 12 13  1  0
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 15 16  1  0
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  5 19  2  0
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 29 30  2  0
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 39 40  1  0
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 21  3  1  0
 30 24  1  0
 31 20  1  0
  1 43  1  0
  1 44  1  0
  1 45  1  0
  4 46  1  0
  6 47  1  0
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 10 49  1  0
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 38 78  1  0
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 41 80  1  0
 42 81  1  0
 42 82  1  0
M  END

HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  O   UNK     0       1.077   0.769   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0      -0.462   0.923   0.000  0.00  0.00           C+0
HETATM    3  N   UNK     0      -1.385  -0.307   0.000  0.00  0.00           N+0
HETATM    4  C   UNK     0      -1.077  -1.693   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       0.307  -2.309   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       1.231  -3.386   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       2.617  -3.849   0.000  0.00  0.00           C+0
HETATM    8  N   UNK     0       3.849  -2.770   0.000  0.00  0.00           N+0
HETATM    9  C   UNK     0       4.002   4.926   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       2.463   4.926   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       1.539   3.694   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       2.463   2.462   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       4.002   2.309   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.773   3.694   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       6.311   3.694   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      -4.926   4.463   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -3.541   5.079   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -2.309   4.310   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0      -0.769   4.926   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0      -0.001   3.541   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -0.923   2.309   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -2.309   2.770   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -3.694   2.154   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -5.079   2.925   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -6.311   2.001   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      -6.311   0.461   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -5.079  -0.307   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0      -3.541   0.001   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0      -3.541   6.773   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0      -4.926   7.389   0.000  0.00  0.00           C+0
HETATM   31  N   UNK     0       2.155  -0.923   0.000  0.00  0.00           N+0
HETATM   32  C   UNK     0       3.541  -1.385   0.000  0.00  0.00           C+0
HETATM   33  N   UNK     0       4.618  -0.307   0.000  0.00  0.00           N+0
HETATM   34  N   UNK     0      -5.079  -2.001   0.000  0.00  0.00           N+0
HETATM   35  C   UNK     0      -3.694  -2.617   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      -3.694  -4.157   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      -2.309  -5.079   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0      -2.309  -6.619   0.000  0.00  0.00           C+0
HETATM   39  N   UNK     0      -1.077  -7.389   0.000  0.00  0.00           N+0
HETATM   40  N   UNK     0      -0.001  -5.234   0.000  0.00  0.00           N+0
HETATM   41  C   UNK     0       0.307  -6.619   0.000  0.00  0.00           C+0
HETATM   42  N   UNK     0       1.693  -7.235   0.000  0.00  0.00           N+0
CONECT    1    2                                                            
CONECT    2    1    3   21                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    7   32                                                       
CONECT    9   10   14                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12   20                                                  
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14    9   13   15                                                  
CONECT   15   14                                                            
CONECT   16   17   24                                                       
CONECT   17   16   18   29                                                  
CONECT   18   17   19   22                                                  
CONECT   19   18   20                                                       
CONECT   20   11   19   21                                                  
CONECT   21    2   20   22                                                  
CONECT   22   18   21   23                                                  
CONECT   23   22   24                                                       
CONECT   24   16   23   25                                                  
CONECT   25   24   26                                                       
CONECT   26   25   27                                                       
CONECT   27   26   28   34                                                  
CONECT   28   27                                                            
CONECT   29   17   30                                                       
CONECT   30   29                                                            
CONECT   31   32                                                            
CONECT   32    8   31   33                                                  
CONECT   33   32                                                            
CONECT   34   27   35                                                       
CONECT   35   34   36                                                       
CONECT   36   35   37                                                       
CONECT   37   36   38                                                       
CONECT   38   37   39                                                       
CONECT   39   38   41                                                       
CONECT   40   41                                                            
CONECT   41   39   40   42                                                  
CONECT   42   41                                                            
MASTER        0    0    0    0    0    0    0    0   42    0   88    0
END

COMPND    HMDB0030459
HETATM    1  C1  UNL     1       2.462  -3.834   1.409  1.00  0.00           C  
HETATM    2  O1  UNL     1       1.144  -3.622   1.049  1.00  0.00           O  
HETATM    3  C2  UNL     1       0.648  -2.815   0.087  1.00  0.00           C  
HETATM    4  C3  UNL     1       1.543  -2.062  -0.687  1.00  0.00           C  
HETATM    5  C4  UNL     1       1.166  -1.210  -1.682  1.00  0.00           C  
HETATM    6  C5  UNL     1       1.992  -0.319  -2.441  1.00  0.00           C  
HETATM    7  C6  UNL     1       3.006   0.322  -2.021  1.00  0.00           C  
HETATM    8  C7  UNL     1       3.564   0.342  -0.714  1.00  0.00           C  
HETATM    9  O2  UNL     1       3.157  -0.210   0.329  1.00  0.00           O  
HETATM   10  N1  UNL     1       4.776   1.103  -0.555  1.00  0.00           N  
HETATM   11  C8  UNL     1       5.380   1.154   0.740  1.00  0.00           C  
HETATM   12  C9  UNL     1       6.647   1.988   0.715  1.00  0.00           C  
HETATM   13  C10 UNL     1       7.663   1.416  -0.232  1.00  0.00           C  
HETATM   14  C11 UNL     1       8.938   2.187  -0.325  1.00  0.00           C  
HETATM   15  N2  UNL     1       9.629   2.277   0.939  1.00  0.00           N  
HETATM   16  C12 UNL     1       9.178   3.021   2.054  1.00  0.00           C  
HETATM   17  N3  UNL     1       9.328   2.561   3.239  1.00  0.00           N  
HETATM   18  N4  UNL     1       8.558   4.278   1.875  1.00  0.00           N  
HETATM   19  C13 UNL     1      -0.232  -1.110  -1.925  1.00  0.00           C  
HETATM   20  C14 UNL     1      -1.126  -1.823  -1.200  1.00  0.00           C  
HETATM   21  C15 UNL     1      -0.687  -2.669  -0.199  1.00  0.00           C  
HETATM   22  O3  UNL     1      -1.751  -3.294   0.415  1.00  0.00           O  
HETATM   23  C16 UNL     1      -2.960  -2.884  -0.190  1.00  0.00           C  
HETATM   24  C17 UNL     1      -3.582  -4.126  -0.752  1.00  0.00           C  
HETATM   25  C18 UNL     1      -2.823  -5.023  -1.482  1.00  0.00           C  
HETATM   26  C19 UNL     1      -3.381  -6.174  -2.005  1.00  0.00           C  
HETATM   27  C20 UNL     1      -4.713  -6.476  -1.823  1.00  0.00           C  
HETATM   28  O4  UNL     1      -5.298  -7.627  -2.338  1.00  0.00           O  
HETATM   29  C21 UNL     1      -5.474  -5.584  -1.096  1.00  0.00           C  
HETATM   30  C22 UNL     1      -4.915  -4.436  -0.574  1.00  0.00           C  
HETATM   31  C23 UNL     1      -2.622  -1.899  -1.254  1.00  0.00           C  
HETATM   32  C24 UNL     1      -3.204  -0.569  -1.040  1.00  0.00           C  
HETATM   33  O5  UNL     1      -2.431   0.397  -0.829  1.00  0.00           O  
HETATM   34  N5  UNL     1      -4.604  -0.313  -1.060  1.00  0.00           N  
HETATM   35  C25 UNL     1      -5.163   0.982  -0.850  1.00  0.00           C  
HETATM   36  C26 UNL     1      -4.828   1.573   0.507  1.00  0.00           C  
HETATM   37  C27 UNL     1      -5.476   2.929   0.597  1.00  0.00           C  
HETATM   38  C28 UNL     1      -5.211   3.615   1.918  1.00  0.00           C  
HETATM   39  N6  UNL     1      -5.887   4.911   1.879  1.00  0.00           N  
HETATM   40  C29 UNL     1      -7.299   4.973   1.871  1.00  0.00           C  
HETATM   41  N7  UNL     1      -7.914   4.875   3.011  1.00  0.00           N  
HETATM   42  N8  UNL     1      -7.986   5.136   0.654  1.00  0.00           N  
HETATM   43  H1  UNL     1       2.886  -2.855   1.779  1.00  0.00           H  
HETATM   44  H2  UNL     1       3.037  -4.033   0.458  1.00  0.00           H  
HETATM   45  H3  UNL     1       2.644  -4.650   2.098  1.00  0.00           H  
HETATM   46  H4  UNL     1       2.608  -2.252  -0.523  1.00  0.00           H  
HETATM   47  H5  UNL     1       1.671  -0.205  -3.536  1.00  0.00           H  
HETATM   48  H6  UNL     1       3.519   0.952  -2.788  1.00  0.00           H  
HETATM   49  H7  UNL     1       5.174   1.587  -1.357  1.00  0.00           H  
HETATM   50  H8  UNL     1       5.646   0.101   1.030  1.00  0.00           H  
HETATM   51  H9  UNL     1       4.674   1.506   1.509  1.00  0.00           H  
HETATM   52  H10 UNL     1       6.438   3.045   0.532  1.00  0.00           H  
HETATM   53  H11 UNL     1       7.038   1.934   1.775  1.00  0.00           H  
HETATM   54  H12 UNL     1       7.191   1.418  -1.259  1.00  0.00           H  
HETATM   55  H13 UNL     1       7.881   0.338   0.017  1.00  0.00           H  
HETATM   56  H14 UNL     1       8.695   3.218  -0.722  1.00  0.00           H  
HETATM   57  H15 UNL     1       9.634   1.706  -1.067  1.00  0.00           H  
HETATM   58  H16 UNL     1      10.551   1.732   1.022  1.00  0.00           H  
HETATM   59  H17 UNL     1       9.782   1.633   3.434  1.00  0.00           H  
HETATM   60  H18 UNL     1       8.872   4.920   1.117  1.00  0.00           H  
HETATM   61  H19 UNL     1       7.779   4.523   2.537  1.00  0.00           H  
HETATM   62  H20 UNL     1      -0.550  -0.447  -2.708  1.00  0.00           H  
HETATM   63  H21 UNL     1      -3.649  -2.468   0.577  1.00  0.00           H  
HETATM   64  H22 UNL     1      -1.766  -4.767  -1.617  1.00  0.00           H  
HETATM   65  H23 UNL     1      -2.775  -6.867  -2.574  1.00  0.00           H  
HETATM   66  H24 UNL     1      -5.311  -8.487  -1.780  1.00  0.00           H  
HETATM   67  H25 UNL     1      -6.534  -5.822  -0.949  1.00  0.00           H  
HETATM   68  H26 UNL     1      -5.513  -3.733  -0.001  1.00  0.00           H  
HETATM   69  H27 UNL     1      -2.955  -2.257  -2.249  1.00  0.00           H  
HETATM   70  H28 UNL     1      -5.252  -1.131  -1.240  1.00  0.00           H  
HETATM   71  H29 UNL     1      -6.257   0.939  -1.015  1.00  0.00           H  
HETATM   72  H30 UNL     1      -4.759   1.703  -1.603  1.00  0.00           H  
HETATM   73  H31 UNL     1      -5.220   0.928   1.316  1.00  0.00           H  
HETATM   74  H32 UNL     1      -3.749   1.690   0.583  1.00  0.00           H  
HETATM   75  H33 UNL     1      -6.557   2.816   0.420  1.00  0.00           H  
HETATM   76  H34 UNL     1      -5.014   3.566  -0.199  1.00  0.00           H  
HETATM   77  H35 UNL     1      -5.649   3.029   2.752  1.00  0.00           H  
HETATM   78  H36 UNL     1      -4.138   3.798   2.075  1.00  0.00           H  
HETATM   79  H37 UNL     1      -5.360   5.801   1.856  1.00  0.00           H  
HETATM   80  H38 UNL     1      -7.419   4.757   3.901  1.00  0.00           H  
HETATM   81  H39 UNL     1      -7.908   5.998   0.083  1.00  0.00           H  
HETATM   82  H40 UNL     1      -8.595   4.373   0.305  1.00  0.00           H  
CONECT    1    2   43   44   45
CONECT    2    3
CONECT    3    4    4   21
CONECT    4    5   46
CONECT    5    6   19   19
CONECT    6    7    7   47
CONECT    7    8   48
CONECT    8    9    9   10
CONECT   10   11   49
CONECT   11   12   50   51
CONECT   12   13   52   53
CONECT   13   14   54   55
CONECT   14   15   56   57
CONECT   15   16   58
CONECT   16   17   17   18
CONECT   17   59
CONECT   18   60   61
CONECT   19   20   62
CONECT   20   21   21   31
CONECT   21   22
CONECT   22   23
CONECT   23   24   31   63
CONECT   24   25   25   30
CONECT   25   26   64
CONECT   26   27   27   65
CONECT   27   28   29
CONECT   28   66
CONECT   29   30   30   67
CONECT   30   68
CONECT   31   32   69
CONECT   32   33   33   34
CONECT   34   35   70
CONECT   35   36   71   72
CONECT   36   37   73   74
CONECT   37   38   75   76
CONECT   38   39   77   78
CONECT   39   40   79
CONECT   40   41   41   42
CONECT   41   80
CONECT   42   81   82
END

HMDB0030459
     RDKit          3D
Hordatine B
 82 84  0  0  0  0  0  0  0  0999 V2000
    2.4623   -3.8338    1.4093 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1438   -3.6221    1.0487 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6477   -2.8146    0.0865 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5427   -2.0624   -0.6871 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1663   -1.2105   -1.6824 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9915   -0.3192   -2.4409 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0059    0.3223   -2.0214 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5635    0.3417   -0.7144 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1567   -0.2100    0.3291 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7757    1.1032   -0.5547 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3802    1.1544    0.7402 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6465    1.9880    0.7154 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6628    1.4163   -0.2318 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9375    2.1874   -0.3252 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6294    2.2766    0.9392 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1777    3.0211    2.0544 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3282    2.5614    3.2391 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5579    4.2785    1.8750 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2320   -1.1104   -1.9251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1265   -1.8225   -1.1999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6873   -2.6689   -0.1990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7506   -3.2941    0.4150 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9604   -2.8842   -0.1897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5818   -4.1259   -0.7524 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8230   -5.0234   -1.4821 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3807   -6.1742   -2.0053 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7127   -6.4756   -1.8226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2983   -7.6266   -2.3382 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4737   -5.5843   -1.0958 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9147   -4.4359   -0.5745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6217   -1.8993   -1.2537 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2045   -0.5689   -1.0403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4313    0.3966   -0.8289 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6035   -0.3126   -1.0600 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1630    0.9824   -0.8500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8282    1.5728    0.5071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4755    2.9290    0.5967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2112    3.6146    1.9181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8873    4.9106    1.8788 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2995    4.9729    1.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9145    4.8755    3.0109 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9860    5.1356    0.6540 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8861   -2.8549    1.7786 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0373   -4.0333    0.4579 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6438   -4.6502    2.0985 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6082   -2.2515   -0.5232 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6711   -0.2047   -3.5360 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5191    0.9518   -2.7880 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1739    1.5866   -1.3571 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6456    0.1009    1.0300 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6744    1.5057    1.5086 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4383    3.0445    0.5322 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0377    1.9345    1.7750 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1912    1.4179   -1.2587 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8810    0.3379    0.0166 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6948    3.2181   -0.7219 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6335    1.7059   -1.0667 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5506    1.7315    1.0219 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7824    1.6331    3.4340 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8721    4.9200    1.1167 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7787    4.5229    2.5367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5500   -0.4475   -2.7083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6490   -2.4675    0.5768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7663   -4.7666   -1.6174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7751   -6.8668   -2.5742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3114   -8.4865   -1.7804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5342   -5.8224   -0.9490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5127   -3.7326   -0.0013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9548   -2.2567   -2.2490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2522   -1.1308   -1.2402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2570    0.9395   -1.0147 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7586    1.7028   -1.6030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2198    0.9278    1.3164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7488    1.6903    0.5826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5566    2.8157    0.4195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0138    3.5658   -0.1986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6489    3.0295    2.7522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1378    3.7981    2.0753 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3597    5.8014    1.8559 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4187    4.7570    3.9008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9080    5.9983    0.0834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5951    4.3729    0.3048 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  2  3
 16 18  1  0
  5 19  2  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 27 29  1  0
 29 30  2  0
 23 31  1  0
 31 32  1  0
 32 33  2  0
 32 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  1  0
 37 38  1  0
 38 39  1  0
 39 40  1  0
 40 41  2  3
 40 42  1  0
 21  3  1  0
 30 24  1  0
 31 20  1  0
  1 43  1  0
  1 44  1  0
  1 45  1  0
  4 46  1  0
  6 47  1  0
  7 48  1  0
 10 49  1  0
 11 50  1  0
 11 51  1  0
 12 52  1  0
 12 53  1  0
 13 54  1  0
 13 55  1  0
 14 56  1  0
 14 57  1  0
 15 58  1  0
 17 59  1  0
 18 60  1  0
 18 61  1  0
 19 62  1  0
 23 63  1  0
 25 64  1  0
 26 65  1  0
 28 66  1  0
 29 67  1  0
 30 68  1  0
 31 69  1  0
 34 70  1  0
 35 71  1  0
 35 72  1  0
 36 73  1  0
 36 74  1  0
 37 75  1  0
 37 76  1  0
 38 77  1  0
 38 78  1  0
 39 79  1  0
 41 80  1  0
 42 81  1  0
 42 82  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
N-(4-Carbamimidamidobutyl)-5-[(1Z)-2-[(4-carbamimidamidobutyl)-C-hydroxycarbonimidoyl]eth-1-en-1-yl]-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-carboximidate	HMDB

Chemical Formula

C₂₉H₄₀N₈O₅

Average Molecular Weight

580.6785

Monoisotopic Molecular Weight

580.31216643

IUPAC Name

N-(4-carbamimidamidobutyl)-5-[(1Z)-2-[(4-carbamimidamidobutyl)carbamoyl]eth-1-en-1-yl]-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide

Traditional Name

N-(4-carbamimidamidobutyl)-5-[(1Z)-2-[(4-carbamimidamidobutyl)carbamoyl]eth-1-en-1-yl]-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide

CAS Registry Number

10502-21-3

SMILES

COC1=C2OC(C(C(=O)NCCCCNC(N)=N)C2=CC(\C=C/C(=O)NCCCCNC(N)=N)=C1)C1=CC=C(O)C=C1

InChI Identifier

InChI=1S/C29H40N8O5/c1-41-22-17-18(6-11-23(39)34-12-2-4-14-36-28(30)31)16-21-24(27(40)35-13-3-5-15-37-29(32)33)25(42-26(21)22)19-7-9-20(38)10-8-19/h6-11,16-17,24-25,38H,2-5,12-15H2,1H3,(H,34,39)(H,35,40)(H4,30,31,36)(H4,32,33,37)/b11-6-

InChI Key

LRLXAXGCQUOKIO-WDZFZDKYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

2-arylbenzofuran flavonoids

Sub Class

Not Available

Direct Parent

2-arylbenzofuran flavonoids

Alternative Parents

Substituents

2-arylbenzofuran flavonoid
Neolignan skeleton
Benzofuran
Coumaran
Anisole
Styrene
Alkyl aryl ether
1-hydroxy-2-unsubstituted benzenoid
Phenol
Monocyclic benzene moiety
Benzenoid
Carboxamide group
Guanidine
Secondary carboxylic acid amide
Carboxylic acid derivative
Ether
Oxacycle
Organoheterocyclic compound
Carboximidamide
Organic oxygen compound
Organic nitrogen compound
Hydrocarbon derivative
Carbonyl group
Imine
Organopnictogen compound
Organonitrogen compound
Organooxygen compound
Organic oxide
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Extracellular (HMDB: HMDB0030459)
Cytoplasm (HMDB: HMDB0030459)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0030459)

Source

Endogenous

Endogenous (HMDB: HMDB0030459)

Plant

Poaceae (HMDB: HMDB0030459)

Exogenous

Food

Food (HMDB: HMDB0030459)

Cereal and cereal product

Cereal

Barley (FooDB: FOOD00088)

Cereal product

Breakfast cereal (FooDB: FOOD00270)

Cereals and cereal products (FooDB: FOOD00858)

Process

Not Available

Role

Biological role

fungicide (HMDB: HMDB0030459)
allelopathic (HMDB: HMDB0030459)

Industrial application

Manufacturing industry

Material processing agent

Coloring agent

Fluorescent agent

fungicide (HMDB: HMDB0030459)

Agriculture

Pesticide

Insecticide

pesticide (HMDB: HMDB0030459)

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	132 - 135 °C	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	275.1 mg/L @ 25 °C (est)	The Good Scents Company Information System
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	0.049 g/L	ALOGPS
logP	1.22	ALOGPS
logP	-0.2	ChemAxon
logS	-4.1	ALOGPS
pKa (Strongest Acidic)	9.47	ChemAxon
pKa (Strongest Basic)	12.42	ChemAxon
Physiological Charge	2	ChemAxon
Hydrogen Acceptor Count	11	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	220.69 Å²	ChemAxon
Rotatable Bond Count	15	ChemAxon
Refractivity	181.43 m³·mol⁻¹	ChemAxon
Polarizability	62.9 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	231.633	30932474
DeepCCS	[M-H]-	229.237	30932474
DeepCCS	[M-2H]-	262.122	30932474
DeepCCS	[M+Na]+	237.545	30932474
AllCCS	[M+H]+	235.5	32859911
AllCCS	[M+H-H2O]+	234.4	32859911
AllCCS	[M+NH4]+	236.6	32859911
AllCCS	[M+Na]+	236.9	32859911
AllCCS	[M-H]-	226.0	32859911
AllCCS	[M+Na-2H]-	229.2	32859911
AllCCS	[M+HCOO]-	232.8	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Hordatine B	COC1=C2OC(C(C(=O)NCCCCNC(N)=N)C2=CC(\C=C/C(=O)NCCCCNC(N)=N)=C1)C1=CC=C(O)C=C1	7195.8	Standard polar	33892256
Hordatine B	COC1=C2OC(C(C(=O)NCCCCNC(N)=N)C2=CC(\C=C/C(=O)NCCCCNC(N)=N)=C1)C1=CC=C(O)C=C1	4841.4	Standard non polar	33892256
Hordatine B	COC1=C2OC(C(C(=O)NCCCCNC(N)=N)C2=CC(\C=C/C(=O)NCCCCNC(N)=N)=C1)C1=CC=C(O)C=C1	6463.9	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Hordatine B,1TMS,isomer #1	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5948.8	Semi standard non polar	33892256
Hordatine B,1TMS,isomer #2	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	6111.5	Semi standard non polar	33892256
Hordatine B,1TMS,isomer #3	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6111.5	Semi standard non polar	33892256
Hordatine B,1TMS,isomer #4	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5933.5	Semi standard non polar	33892256
Hordatine B,1TMS,isomer #5	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5974.5	Semi standard non polar	33892256
Hordatine B,1TMS,isomer #6	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5888.7	Semi standard non polar	33892256
Hordatine B,1TMS,isomer #7	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5924.0	Semi standard non polar	33892256
Hordatine B,1TMS,isomer #8	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5976.7	Semi standard non polar	33892256
Hordatine B,1TMS,isomer #9	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5888.8	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #1	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	6002.9	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #1	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4809.7	Standard non polar	33892256
Hordatine B,2TMS,isomer #10	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5954.8	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #10	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4701.0	Standard non polar	33892256
Hordatine B,2TMS,isomer #11	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5994.6	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #11	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5026.0	Standard non polar	33892256
Hordatine B,2TMS,isomer #12	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5914.5	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #12	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4963.7	Standard non polar	33892256
Hordatine B,2TMS,isomer #13	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5948.8	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #13	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4866.4	Standard non polar	33892256
Hordatine B,2TMS,isomer #14	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5969.0	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #14	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5019.9	Standard non polar	33892256
Hordatine B,2TMS,isomer #15	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5950.1	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #15	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4800.8	Standard non polar	33892256
Hordatine B,2TMS,isomer #16	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	6041.1	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #16	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5061.9	Standard non polar	33892256
Hordatine B,2TMS,isomer #17	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5953.8	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #17	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4701.5	Standard non polar	33892256
Hordatine B,2TMS,isomer #18	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5971.7	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #18	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5019.5	Standard non polar	33892256
Hordatine B,2TMS,isomer #19	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5950.8	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #19	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4800.8	Standard non polar	33892256
Hordatine B,2TMS,isomer #2	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	6003.0	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #2	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4809.7	Standard non polar	33892256
Hordatine B,2TMS,isomer #20	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6041.0	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #20	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5061.8	Standard non polar	33892256
Hordatine B,2TMS,isomer #21	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5949.4	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #21	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4866.3	Standard non polar	33892256
Hordatine B,2TMS,isomer #22	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5991.5	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #22	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5026.4	Standard non polar	33892256
Hordatine B,2TMS,isomer #23	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5914.8	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #23	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4963.7	Standard non polar	33892256
Hordatine B,2TMS,isomer #24	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5761.1	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #24	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4606.5	Standard non polar	33892256
Hordatine B,2TMS,isomer #25	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5805.5	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #25	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4907.6	Standard non polar	33892256
Hordatine B,2TMS,isomer #26	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5740.1	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #26	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4800.5	Standard non polar	33892256
Hordatine B,2TMS,isomer #27	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5835.3	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #27	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4911.0	Standard non polar	33892256
Hordatine B,2TMS,isomer #28	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5739.4	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #28	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4800.5	Standard non polar	33892256
Hordatine B,2TMS,isomer #29	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5788.0	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #29	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4733.8	Standard non polar	33892256
Hordatine B,2TMS,isomer #3	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5859.1	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #3	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4487.1	Standard non polar	33892256
Hordatine B,2TMS,isomer #30	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5867.1	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #30	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5041.5	Standard non polar	33892256
Hordatine B,2TMS,isomer #31	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5798.6	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #31	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4964.5	Standard non polar	33892256
Hordatine B,2TMS,isomer #32	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5807.7	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #32	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4848.8	Standard non polar	33892256
Hordatine B,2TMS,isomer #33	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5723.6	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #33	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4618.1	Standard non polar	33892256
Hordatine B,2TMS,isomer #34	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5801.2	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #34	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4964.4	Standard non polar	33892256
Hordatine B,2TMS,isomer #35	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5744.4	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #35	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4892.6	Standard non polar	33892256
Hordatine B,2TMS,isomer #36	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5818.7	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #36	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4735.4	Standard non polar	33892256
Hordatine B,2TMS,isomer #37	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5723.4	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #37	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4617.9	Standard non polar	33892256
Hordatine B,2TMS,isomer #38	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5808.9	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #38	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4849.1	Standard non polar	33892256
Hordatine B,2TMS,isomer #4	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5868.9	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #4	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4838.1	Standard non polar	33892256
Hordatine B,2TMS,isomer #5	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5797.8	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #5	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4747.8	Standard non polar	33892256
Hordatine B,2TMS,isomer #6	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5862.7	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #6	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4703.7	Standard non polar	33892256
Hordatine B,2TMS,isomer #7	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5866.3	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #7	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4838.1	Standard non polar	33892256
Hordatine B,2TMS,isomer #8	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5797.7	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #8	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4747.7	Standard non polar	33892256
Hordatine B,2TMS,isomer #9	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	6125.4	Semi standard non polar	33892256
Hordatine B,2TMS,isomer #9	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5007.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #1	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	6046.3	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #1	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4834.5	Standard non polar	33892256
Hordatine B,3TMS,isomer #10	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5892.5	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #10	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4856.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #100	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5670.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #100	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4489.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #11	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5829.5	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #11	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4779.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #12	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5883.8	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #12	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4728.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #13	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5876.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #13	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4845.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #14	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5855.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #14	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4615.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #15	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5926.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #15	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4900.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #16	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5745.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #16	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4521.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #17	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5668.8	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #17	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4377.0	Standard non polar	33892256
Hordatine B,3TMS,isomer #18	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5708.5	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #18	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4411.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #19	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5717.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #19	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4521.1	Standard non polar	33892256
Hordatine B,3TMS,isomer #2	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5879.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #2	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4469.1	Standard non polar	33892256
Hordatine B,3TMS,isomer #20	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5670.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #20	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4378.0	Standard non polar	33892256
Hordatine B,3TMS,isomer #21	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5726.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #21	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4621.1	Standard non polar	33892256
Hordatine B,3TMS,isomer #22	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5745.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #22	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4778.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #23	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5791.1	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #23	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4879.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #24	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5726.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #24	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4786.5	Standard non polar	33892256
Hordatine B,3TMS,isomer #25	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5697.2	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #25	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4660.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #26	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5724.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #26	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4786.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #27	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5661.1	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #27	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4705.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #28	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5765.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #28	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4782.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #29	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5695.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #29	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4659.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #3	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5879.3	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #3	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4845.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #30	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5726.2	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #30	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4620.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #31	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5988.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #31	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4711.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #32	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	6002.3	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #32	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5068.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #33	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5975.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #33	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4859.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #34	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	6028.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #34	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5112.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #35	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5988.1	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #35	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4908.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #36	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5999.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #36	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5068.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #37	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5975.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #37	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4859.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #38	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	6029.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #38	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5112.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #39	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5823.3	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #39	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4741.5	Standard non polar	33892256
Hordatine B,3TMS,isomer #4	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5856.3	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #4	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4615.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #40	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5759.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #40	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4644.8	Standard non polar	33892256
Hordatine B,3TMS,isomer #41	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5806.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #41	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4609.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #42	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5795.3	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #42	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4722.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #43	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5799.8	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #43	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4471.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #44	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5831.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #44	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4771.1	Standard non polar	33892256
Hordatine B,3TMS,isomer #45	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5844.5	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #45	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4871.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #46	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5835.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #46	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4940.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #47	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5859.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #47	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5081.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #48	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5837.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #48	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4852.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #49	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5902.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #49	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5126.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #5	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5926.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #5	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4900.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #50	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5785.2	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #50	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4855.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #51	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5787.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #51	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5011.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #52	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5767.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #52	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4811.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #53	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5815.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #53	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5066.0	Standard non polar	33892256
Hordatine B,3TMS,isomer #54	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5832.8	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #54	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4930.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #55	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5811.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #55	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4684.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #56	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5839.8	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #56	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4970.5	Standard non polar	33892256
Hordatine B,3TMS,isomer #57	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5824.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #57	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4651.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #58	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5888.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #58	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5103.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #59	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5857.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #59	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4771.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #6	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5885.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #6	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4728.5	Standard non polar	33892256
Hordatine B,3TMS,isomer #60	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5818.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #60	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4721.1	Standard non polar	33892256
Hordatine B,3TMS,isomer #61	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5801.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #61	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4470.5	Standard non polar	33892256
Hordatine B,3TMS,isomer #62	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5831.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #62	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4770.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #63	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5805.8	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #63	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4610.0	Standard non polar	33892256
Hordatine B,3TMS,isomer #64	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5805.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #64	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4742.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #65	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5761.3	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #65	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4645.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #66	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5826.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #66	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4652.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #67	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5890.2	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #67	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5102.8	Standard non polar	33892256
Hordatine B,3TMS,isomer #68	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5815.2	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #68	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4927.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #69	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5859.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #69	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5081.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #7	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5889.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #7	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4857.0	Standard non polar	33892256
Hordatine B,3TMS,isomer #70	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5789.5	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #70	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5011.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #71	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5859.1	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #71	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4771.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #72	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5812.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #72	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4685.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #73	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5836.1	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #73	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4853.1	Standard non polar	33892256
Hordatine B,3TMS,isomer #74	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5767.8	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #74	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4811.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #75	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5839.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #75	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4970.6	Standard non polar	33892256
Hordatine B,3TMS,isomer #76	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5900.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #76	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5127.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #77	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5815.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #77	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5065.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #78	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5849.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #78	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4943.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #79	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5783.5	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #79	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4854.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #8	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5829.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #8	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4779.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #80	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5844.3	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #80	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4871.0	Standard non polar	33892256
Hordatine B,3TMS,isomer #81	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5643.6	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #81	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4662.0	Standard non polar	33892256
Hordatine B,3TMS,isomer #82	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5576.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #82	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4524.5	Standard non polar	33892256
Hordatine B,3TMS,isomer #83	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5640.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #83	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4664.2	Standard non polar	33892256
Hordatine B,3TMS,isomer #84	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5576.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #84	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4524.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #85	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5664.8	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #85	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4730.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #86	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5737.2	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #86	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4980.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #87	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5654.4	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #87	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4873.8	Standard non polar	33892256
Hordatine B,3TMS,isomer #88	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5668.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #88	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4879.1	Standard non polar	33892256
Hordatine B,3TMS,isomer #89	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5598.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #89	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4787.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #9	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5880.7	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #9	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4468.7	Standard non polar	33892256
Hordatine B,3TMS,isomer #90	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5685.2	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #90	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4733.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #91	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5695.9	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #91	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4772.0	Standard non polar	33892256
Hordatine B,3TMS,isomer #92	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5624.1	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #92	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4664.4	Standard non polar	33892256
Hordatine B,3TMS,isomer #93	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5651.1	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #93	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4497.3	Standard non polar	33892256
Hordatine B,3TMS,isomer #94	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5754.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #94	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4868.1	Standard non polar	33892256
Hordatine B,3TMS,isomer #95	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5754.5	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #95	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4867.8	Standard non polar	33892256
Hordatine B,3TMS,isomer #96	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5674.1	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #96	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4781.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #97	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5639.3	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #97	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4665.5	Standard non polar	33892256
Hordatine B,3TMS,isomer #98	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5574.0	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #98	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4571.9	Standard non polar	33892256
Hordatine B,3TMS,isomer #99	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5675.3	Semi standard non polar	33892256
Hordatine B,3TMS,isomer #99	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4782.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #1	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5900.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #1	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4489.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #10	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5721.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #10	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4241.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #100	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5685.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #100	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4672.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #101	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5696.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #101	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4780.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #102	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5677.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #102	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4532.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #103	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5711.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #103	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4817.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #104	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5630.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #104	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4557.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #105	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5638.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #105	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4680.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #106	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5620.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #106	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4473.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #107	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5648.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #107	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4725.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #108	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5649.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #108	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4658.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #109	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5640.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #109	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4385.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #11	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5754.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #11	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4541.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #110	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5651.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #110	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4683.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #111	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5652.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #111	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4333.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #112	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5702.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #112	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4756.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #113	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5681.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #113	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4403.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #114	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5714.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #114	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4770.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #115	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5752.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #115	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4886.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #116	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5726.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #116	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4688.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #117	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5744.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #117	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4944.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #118	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5728.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #118	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5012.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #119	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5697.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #119	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4770.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #12	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5742.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #12	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4407.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #120	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5727.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #120	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5040.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #121	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5724.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #121	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4703.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #122	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5787.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #122	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5145.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #123	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5736.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #123	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4805.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #124	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5663.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #124	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4921.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #125	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5638.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #125	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4704.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #126	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5665.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #126	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4958.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #127	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5646.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #127	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4654.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #128	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5726.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #128	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5090.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #129	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5676.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #129	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4746.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #13	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5738.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #13	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4525.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #130	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5674.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #130	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4566.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #131	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5722.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #131	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5006.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #132	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5695.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #132	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4659.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #133	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5701.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #133	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4591.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #134	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5664.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #134	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4330.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #135	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5718.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #135	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4752.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #136	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5654.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #136	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4654.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #137	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5697.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #137	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4779.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #138	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5645.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #138	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4680.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #139	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5683.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #139	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4401.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #14	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5699.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #14	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4410.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #140	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5640.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #140	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4386.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #141	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5674.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #141	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4532.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #142	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5620.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #142	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4473.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #143	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5651.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #143	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4682.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #144	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5699.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #144	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4815.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #145	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5649.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #145	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4724.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #146	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5679.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #146	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4675.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #147	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5630.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #147	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4557.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #148	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5700.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #148	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4526.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #149	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5702.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #149	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4591.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #15	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5723.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #15	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4447.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #150	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5669.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #150	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4567.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #151	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5724.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #151	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4704.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #152	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5648.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #152	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4655.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #153	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5716.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #153	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5002.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #154	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5787.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #154	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5145.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #155	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5727.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #155	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5090.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #156	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5729.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #156	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5012.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #157	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5659.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #157	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4917.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #158	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5752.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #158	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4886.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #159	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5695.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #159	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4660.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #16	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5792.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #16	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4913.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #160	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5735.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #160	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4805.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #161	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5678.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #161	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4746.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #162	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5701.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #162	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4773.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #163	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5638.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #163	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4704.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #164	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5724.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #164	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4687.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #165	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5735.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #165	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5044.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #166	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5665.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #166	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4958.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #167	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5744.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #167	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4943.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #168	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5722.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #168	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4769.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #169	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5506.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #169	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4420.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #17	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5741.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #17	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4792.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #170	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5551.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #170	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4716.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #171	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5495.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #171	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4591.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #172	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5491.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #172	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4593.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #173	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5431.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #173	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4487.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #174	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5503.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #174	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4429.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #175	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5625.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #175	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4789.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #176	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5539.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #176	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4690.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #177	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5625.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #177	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4788.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #178	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5552.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #178	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4689.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #179	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5591.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #179	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4540.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #18	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5789.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #18	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4901.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #180	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5590.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #180	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4550.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #181	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5519.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #181	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4461.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #182	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5647.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #182	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4648.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #183	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5533.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #183	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4460.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #19	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5722.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #19	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4819.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #2	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5905.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #2	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4881.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #20	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5762.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #20	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4547.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #21	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5732.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #21	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4546.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #22	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5760.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #22	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4671.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #23	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5691.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #23	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4608.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #24	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5760.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #24	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4830.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #25	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5806.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #25	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4947.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #26	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5744.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #26	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4876.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #27	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5772.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #27	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4809.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #28	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5718.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #28	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4710.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #29	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5763.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #29	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4649.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #3	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5875.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #3	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4673.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #30	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5754.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #30	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4524.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #31	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5698.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #31	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4409.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #32	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5742.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #32	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4407.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #33	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5729.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #33	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4501.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #34	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5725.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #34	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4241.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #35	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5754.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #35	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4542.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #36	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5764.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #36	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4650.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #37	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5762.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #37	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4806.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #38	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5789.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #38	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4901.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #39	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5762.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #39	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4671.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #4	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5926.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #4	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4929.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #40	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5808.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #40	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4947.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #41	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5719.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #41	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4710.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #42	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5720.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #42	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4819.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #43	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5692.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #43	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4608.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #44	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5744.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #44	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4876.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #45	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5753.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #45	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4795.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #46	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5729.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #46	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4546.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #47	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5759.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #47	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4830.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #48	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5722.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #48	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4447.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #49	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5790.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #49	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4914.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #5	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5903.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #5	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4774.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #50	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5762.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #50	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4547.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #51	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5609.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #51	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4260.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #52	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5589.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #52	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4460.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #53	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5635.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #53	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4563.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #54	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5587.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #54	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4433.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #55	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5537.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #55	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4319.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #56	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5575.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #56	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4432.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #57	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5517.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #57	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4335.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #58	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5586.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #58	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4464.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #59	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5536.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #59	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4319.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #6	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5904.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #6	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4881.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #60	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5592.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #60	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4258.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #61	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	5604.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #61	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C	4558.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #62	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	5687.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #62	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C	4659.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #63	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	5610.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #63	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C	4561.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #64	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5680.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #64	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4843.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #65	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5606.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #65	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4730.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #66	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5687.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #66	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4659.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #67	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	5618.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #67	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C)[Si](C)(C)C	4733.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #68	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	5547.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #68	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C)[Si](C)(C)C	4632.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #69	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	5607.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #69	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C	4561.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #7	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5875.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #7	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4673.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #70	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5618.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #70	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4556.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #71	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5846.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #71	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4748.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #72	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5821.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #72	COC1=CC(/C=C\C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4524.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #73	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5847.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #73	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4785.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #74	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5849.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #74	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4633.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #75	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5836.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #75	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4750.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #76	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5821.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #76	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4525.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #77	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5846.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #77	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4786.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #78	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5847.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #78	COC1=CC(/C=C\C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4711.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #79	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5915.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #79	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5139.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #8	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5927.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #8	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4929.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #80	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5852.4	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #80	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4980.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #81	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5877.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #81	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5120.5	Standard non polar	33892256
Hordatine B,4TMS,isomer #82	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5839.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #82	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4908.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #83	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5869.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #83	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5165.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #84	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5869.2	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #84	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4819.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #85	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5832.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #85	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	4767.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #86	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5837.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #86	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	4908.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #87	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5811.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #87	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4768.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #88	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5842.5	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #88	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	4949.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #89	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5856.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #89	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C)[Si](C)(C)C	5010.7	Standard non polar	33892256
Hordatine B,4TMS,isomer #9	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5746.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #9	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4500.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #90	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5867.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #90	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C	5165.8	Standard non polar	33892256
Hordatine B,4TMS,isomer #91	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	5842.7	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #91	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C	4949.2	Standard non polar	33892256
Hordatine B,4TMS,isomer #92	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5892.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #92	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C	5215.4	Standard non polar	33892256
Hordatine B,4TMS,isomer #93	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5857.3	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #93	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4983.6	Standard non polar	33892256
Hordatine B,4TMS,isomer #94	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5831.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #94	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4766.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #95	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5856.8	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #95	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5010.3	Standard non polar	33892256
Hordatine B,4TMS,isomer #96	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	5846.0	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #96	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N[Si](C)(C)C)N[Si](C)(C)C)[Si](C)(C)C	4710.9	Standard non polar	33892256
Hordatine B,4TMS,isomer #97	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5913.9	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #97	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	5140.0	Standard non polar	33892256
Hordatine B,4TMS,isomer #98	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	5868.1	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #98	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	4819.1	Standard non polar	33892256
Hordatine B,4TMS,isomer #99	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	5710.6	Semi standard non polar	33892256
Hordatine B,4TMS,isomer #99	COC1=CC(/C=C\C(=O)N(CCCCN(C(N)=N[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C	4519.5	Standard non polar	33892256
Hordatine B,1TBDMS,isomer #1	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	6135.1	Semi standard non polar	33892256
Hordatine B,1TBDMS,isomer #2	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	6280.8	Semi standard non polar	33892256
Hordatine B,1TBDMS,isomer #3	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6280.7	Semi standard non polar	33892256
Hordatine B,1TBDMS,isomer #4	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	6153.3	Semi standard non polar	33892256
Hordatine B,1TBDMS,isomer #5	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	6187.5	Semi standard non polar	33892256
Hordatine B,1TBDMS,isomer #6	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	6085.1	Semi standard non polar	33892256
Hordatine B,1TBDMS,isomer #7	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6145.3	Semi standard non polar	33892256
Hordatine B,1TBDMS,isomer #8	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6188.0	Semi standard non polar	33892256
Hordatine B,1TBDMS,isomer #9	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6086.1	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #1	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	6427.7	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #1	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5156.8	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #10	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	6361.3	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #10	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	5006.7	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #11	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	6431.3	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #11	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	5335.2	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #12	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	6330.1	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #12	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	5263.3	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #13	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6365.9	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #13	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5199.3	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #14	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6367.7	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #14	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5330.8	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #15	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	6301.5	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #15	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C	5126.3	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #16	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6409.8	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #16	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5355.2	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #17	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6361.4	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #17	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5007.4	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #18	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6368.4	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #18	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5330.4	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #19	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6302.2	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #19	COC1=CC(/C=C\C(=O)NCCCCNC(=N[Si](C)(C)C(C)(C)C)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5126.3	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #2	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	6428.0	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #2	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	5156.8	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #20	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6409.4	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #20	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5355.2	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #21	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	6366.2	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #21	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	5199.2	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #22	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	6429.3	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #22	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	5335.6	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #23	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	6329.7	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #23	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	5263.2	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #24	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	6165.2	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #24	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	4915.1	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #25	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	6248.7	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #25	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	5226.3	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #26	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	6158.2	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #26	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	5126.8	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #27	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6274.0	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #27	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5229.6	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #28	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6155.0	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #28	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)N(CCCCNC(N)=N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5126.9	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #29	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	6230.2	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #29	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	5030.6	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #3	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	6240.8	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #3	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	4809.2	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #30	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	6337.3	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #30	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	5345.3	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #31	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	6247.4	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #31	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	5263.1	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #32	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	6230.4	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #32	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCN(C(N)=N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5137.7	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #33	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	6151.6	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #33	COC1=CC(/C=C\C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	4916.4	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #34	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	6249.9	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #34	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	5263.0	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #35	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	6167.0	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #35	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	5174.6	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #36	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6260.8	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #36	COC1=CC(/C=C\C(=O)N(CCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5033.1	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #37	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6149.7	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #37	COC1=CC(/C=C\C(=O)N(CCCCNC(N)=N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	4916.5	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #38	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	6231.9	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #38	COC1=CC(/C=C\C(=O)NCCCCN(C(N)=N[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N	5137.5	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #4	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	6308.8	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #4	COC1=CC(/C=C\C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5174.4	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #5	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	6223.3	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #5	COC1=CC(/C=C\C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(=N)N	5077.3	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #6	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	6255.4	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #6	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)N(CCCCNC(=N)N)[Si](C)(C)C(C)(C)C	5057.0	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #7	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	6306.8	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #7	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCN(C(=N)N)[Si](C)(C)C(C)(C)C	5174.6	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #8	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	6223.2	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #8	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N)=CC2=C1OC(C1=CC=C(O[Si](C)(C)C(C)(C)C)C=C1)C2C(=O)NCCCCNC(N)=N[Si](C)(C)C(C)(C)C	5077.3	Standard non polar	33892256
Hordatine B,2TBDMS,isomer #9	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	6528.6	Semi standard non polar	33892256
Hordatine B,2TBDMS,isomer #9	COC1=CC(/C=C\C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C)=CC2=C1OC(C1=CC=C(O)C=C1)C2C(=O)NCCCCNC(=N)N[Si](C)(C)C(C)(C)C	5320.8	Standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (Non-derivatized) - 70eV, Positive	splash10-0udi-1100920000-284d99bf43ebe9e91a23	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (1 TMS) - 70eV, Positive	splash10-00di-2100091000-0317a0296432353d04ed	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS ("Hordatine B,1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TBDMS_1_1) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TBDMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TBDMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TBDMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TBDMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TBDMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TBDMS_1_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TBDMS_1_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Hordatine B GC-MS (TBDMS_1_9) - 70eV, Positive	Not Available	2021-10-15	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 - Hordatine B 10V, Positive-QTOF	splash10-0059-1900150000-a403f4358983e1ec168c	2016-08-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 20V, Positive-QTOF	splash10-01t9-5900110000-29f36fe2735de7c324f6	2016-08-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 40V, Positive-QTOF	splash10-01t9-6901000000-d59e69aeb383e0f32ae3	2016-08-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 10V, Negative-QTOF	splash10-002r-1000490000-e35f5cf4883cbdd5f055	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 20V, Negative-QTOF	splash10-0abj-7001980000-09bad48f7eee2d0bf289	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 40V, Negative-QTOF	splash10-0a4l-9102200000-92777699576c86e6c5a4	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 10V, Positive-QTOF	splash10-001i-0000190000-59287dc3866db0fc51f4	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 20V, Positive-QTOF	splash10-01x0-0000490000-4d2ef73aebd28bd5fa8b	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 40V, Positive-QTOF	splash10-03dl-9005600000-c25b6afd28888d0d7727	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 10V, Negative-QTOF	splash10-004i-0000090000-f4c286e94a48276042cc	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 20V, Negative-QTOF	splash10-00bl-2000290000-4ff94ead834306fabf85	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Hordatine B 40V, Negative-QTOF	splash10-004l-4001690000-d199a5f5106ebca64dfb	2021-09-25	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

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

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

131751021

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

rw1820171

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Showing metabocard for Hordatine B (HMDB0030459)

MOL for HMDB0030459 (Hordatine B)

3D MOL for HMDB0030459 (Hordatine B)

3D SDF for HMDB0030459 (Hordatine B)

3D-SDF for HMDB0030459 (Hordatine B)

PDB for HMDB0030459 (Hordatine B)

3D PDB for HMDB0030459 (Hordatine B)

SMILES for HMDB0030459 (Hordatine B)

INCHI for HMDB0030459 (Hordatine B)

Structure for HMDB0030459 (Hordatine B)

3D Structure for HMDB0030459 (Hordatine B)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra