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Showing metabocard for 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate (HMDB0012492)

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IdentificationTaxonomyOntologyPhysical propertiesSpectraBiological propertiesConcentrationsLinksReferencesXML
Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2009-07-25 00:01:37 UTC
Update Date2021-09-14 15:44:16 UTC
HMDB IDHMDB0012492
Secondary Accession Numbers
  • HMDB12492
Metabolite Identification
Common Name1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate
DescriptionThe novel carbohydrate-derived b-carboline, 1-pentahydroxypentyl-1,2,3,4-tetrahydro-b-carboline-3-carboxylic acid, was identified in fruit- and vegetable-derived products such as juices, jams, and tomato sauces. This compound occurred as two diastereoisomers, a cis isomer (the major compound) and a trans isomer, ranging from undetectable amounts to 6.5 ug/g. Grape, tomato, pineapple, and tropical juices exhibited the highest amount of this alkaloid (up to 3.8 mg/L), whereas apple, banana, and peach juices showed very low or nondetectable levels. This tetrahydro-b-carboline was also found in jams (up to 0.45 ug/g), and a relative high amount was present in tomato concentrate (6.5 ug/g) and sauce (up to 1.8 ug/g). This b-carboline occurred in fruit-derived products as a glycoconjugate from a chemical condensation of d-glucose and l-tryptophan that is highly favored at low pH values and high temperature. Production, processing treatments, and storage of fruit juices and jams can then release this b-carboline. Fruit-derived products and other foods containing this compound might be an exogenous dietary source of this glucose-derived tetrahydro-b-carboline.(PMID: 12137498 ).
Structure
Data?1582753061
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0012492 (1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate)


  Mrv1652305171818012D          

 26 28  0  0  0  0            999 V2000
   -1.4401   -5.1565    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7256   -5.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0112   -5.1565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0112   -4.3315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7033   -5.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7033   -6.3940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4178   -5.1565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4178   -4.3315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1323   -5.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1323   -6.3940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8467   -5.1565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8467   -4.3315    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5612   -3.9190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2757   -4.3315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2757   -5.1565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5612   -5.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7327   -6.3760    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5532   -6.4623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8888   -5.7086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7092   -5.6223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1942   -6.2898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8586   -7.0435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0381   -7.1297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5612   -3.0940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2757   -2.6815    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8467   -2.6815    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 13 24  1  0  0  0  0
 24 25  2  0  0  0  0
 16 11  1  0  0  0  0
 23 18  1  0  0  0  0
 19 15  1  0  0  0  0
 26 24  1  0  0  0  0
M  END
Download

3D MOL for HMDB0012492 (1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate)

HMDB0029992
     RDKit          3D
Tetrahydropentoxyline
 48 50  0  0  0  0  0  0  0  0999 V2000
   -0.6236    4.2749    0.9203 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7118    3.6456    0.9297 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8788    4.3831    0.9972 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7435    2.1396    0.8695 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6784    1.7777   -0.2441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6488    0.3059   -0.3942 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4094   -0.2963   -0.3948 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6126   -1.6010   -0.5379 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9383   -1.8634   -0.6298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6030   -3.0674   -0.7853 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9828   -3.0381   -0.8501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6750   -1.8335   -0.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9656   -0.6420   -0.6048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6047   -0.6661   -0.5404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2190    0.6205   -0.2429 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9648   -0.2476   -0.0365 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0712   -1.1238   -1.1156 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2692    0.4679    0.1023 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3201    1.3707    1.1284 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3535   -0.5826    0.2144 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2034   -1.2833    1.4210 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7322    0.0396    0.2384 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8912    0.7397   -0.9559 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8007   -1.0567    0.2421 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7360   -1.8231    1.3955 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4405    1.5811    0.8050 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5287    4.4959    0.2455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2481    1.8054    1.8241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3340    2.2213   -1.2157 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6781    2.1474    0.0133 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8515   -2.3131   -0.5725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0312   -3.9794   -0.8502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5157   -3.9734   -0.9717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7553   -1.7864   -0.8095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4687    0.3129   -0.5321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1251    1.1708   -1.1982 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7928   -0.8932    0.8619 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9712   -0.6734   -1.9915 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4839    1.0273   -0.8462 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2124    2.2997    0.8112 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2508   -1.3334   -0.5864 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6465   -2.0953    1.2858 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8724    0.7149    1.1010 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7853    1.7166   -0.8376 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8103   -0.6272    0.1696 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6614   -1.7396   -0.6115 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6131   -1.9125    1.8213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1697    1.1933    1.7193 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
  7 15  1  0
 15 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
 22 24  1  0
 24 25  1  0
 15 26  1  0
 26  4  1  0
 14  6  1  0
 14  9  1  0
  3 27  1  0
  4 28  1  0
  5 29  1  0
  5 30  1  0
  8 31  1  0
 10 32  1  0
 11 33  1  0
 12 34  1  0
 13 35  1  0
 15 36  1  0
 16 37  1  0
 17 38  1  0
 18 39  1  0
 19 40  1  0
 20 41  1  0
 21 42  1  0
 22 43  1  0
 23 44  1  0
 24 45  1  0
 24 46  1  0
 25 47  1  0
 26 48  1  0
M  END
Download

3D SDF for HMDB0012492 (1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate)


  Mrv1652305171818012D          

 26 28  0  0  0  0            999 V2000
   -1.4401   -5.1565    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7256   -5.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0112   -5.1565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0112   -4.3315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7033   -5.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7033   -6.3940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4178   -5.1565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4178   -4.3315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1323   -5.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1323   -6.3940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8467   -5.1565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8467   -4.3315    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5612   -3.9190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2757   -4.3315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2757   -5.1565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5612   -5.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7327   -6.3760    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5532   -6.4623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8888   -5.7086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7092   -5.6223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1942   -6.2898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8586   -7.0435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0381   -7.1297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5612   -3.0940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2757   -2.6815    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8467   -2.6815    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 13 24  1  0  0  0  0
 24 25  2  0  0  0  0
 16 11  1  0  0  0  0
 23 18  1  0  0  0  0
 19 15  1  0  0  0  0
 26 24  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0012492

> <DATABASE_NAME>
hmdb

> <SMILES>
OCC(O)C(O)C(O)C(O)C1NC(CC2=C1NC1=C2C=CC=C1)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C17H22N2O7/c20-6-11(21)14(22)16(24)15(23)13-12-8(5-10(19-13)17(25)26)7-3-1-2-4-9(7)18-12/h1-4,10-11,13-16,18-24H,5-6H2,(H,25,26)

> <INCHI_KEY>
LCHFAYIGHOVWSA-UHFFFAOYSA-N

> <FORMULA>
C17H22N2O7

> <MOLECULAR_WEIGHT>
366.3658

> <EXACT_MASS>
366.142701068

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
48

> <JCHEM_AVERAGE_POLARIZABILITY>
37.55621284662874

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
8

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
1-(1,2,3,4,5-pentahydroxypentyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-3-carboxylic acid

> <ALOGPS_LOGP>
-1.61

> <JCHEM_LOGP>
-4.103012188539728

> <ALOGPS_LOGS>
-1.31

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.605675292218734

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.0379020857182546

> <JCHEM_PKA_STRONGEST_BASIC>
6.549390178418132

> <JCHEM_POLAR_SURFACE_AREA>
166.26999999999998

> <JCHEM_REFRACTIVITY>
89.222

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.81e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
1-(1,2,3,4,5-pentahydroxypentyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-3-carboxylic acid

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for HMDB0012492 (1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate)

HMDB0029992
     RDKit          3D
Tetrahydropentoxyline
 48 50  0  0  0  0  0  0  0  0999 V2000
   -0.6236    4.2749    0.9203 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7118    3.6456    0.9297 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8788    4.3831    0.9972 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7435    2.1396    0.8695 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6784    1.7777   -0.2441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6488    0.3059   -0.3942 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4094   -0.2963   -0.3948 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6126   -1.6010   -0.5379 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9383   -1.8634   -0.6298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6030   -3.0674   -0.7853 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9828   -3.0381   -0.8501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6750   -1.8335   -0.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9656   -0.6420   -0.6048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6047   -0.6661   -0.5404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2190    0.6205   -0.2429 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9648   -0.2476   -0.0365 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0712   -1.1238   -1.1156 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2692    0.4679    0.1023 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3201    1.3707    1.1284 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3535   -0.5826    0.2144 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2034   -1.2833    1.4210 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7322    0.0396    0.2384 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8912    0.7397   -0.9559 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8007   -1.0567    0.2421 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7360   -1.8231    1.3955 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4405    1.5811    0.8050 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5287    4.4959    0.2455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2481    1.8054    1.8241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3340    2.2213   -1.2157 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6781    2.1474    0.0133 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8515   -2.3131   -0.5725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0312   -3.9794   -0.8502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5157   -3.9734   -0.9717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7553   -1.7864   -0.8095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4687    0.3129   -0.5321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1251    1.1708   -1.1982 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7928   -0.8932    0.8619 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9712   -0.6734   -1.9915 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4839    1.0273   -0.8462 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2124    2.2997    0.8112 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2508   -1.3334   -0.5864 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6465   -2.0953    1.2858 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8724    0.7149    1.1010 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7853    1.7166   -0.8376 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8103   -0.6272    0.1696 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6614   -1.7396   -0.6115 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6131   -1.9125    1.8213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1697    1.1933    1.7193 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
  7 15  1  0
 15 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
 22 24  1  0
 24 25  1  0
 15 26  1  0
 26  4  1  0
 14  6  1  0
 14  9  1  0
  3 27  1  0
  4 28  1  0
  5 29  1  0
  5 30  1  0
  8 31  1  0
 10 32  1  0
 11 33  1  0
 12 34  1  0
 13 35  1  0
 15 36  1  0
 16 37  1  0
 17 38  1  0
 18 39  1  0
 19 40  1  0
 20 41  1  0
 21 42  1  0
 22 43  1  0
 23 44  1  0
 24 45  1  0
 24 46  1  0
 25 47  1  0
 26 48  1  0
M  END
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PDB for HMDB0012492 (1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate)

HEADER    PROTEIN                                 17-MAY-18   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   17-MAY-18         0                                  
HETATM    1  O   UNK     0      -2.688  -9.626   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0      -1.355 -10.396   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -0.021  -9.626   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0      -0.021  -8.086   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       1.313 -10.396   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0       1.313 -11.936   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0       2.647  -9.626   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0       2.647  -8.086   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0       3.980 -10.396   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0       3.980 -11.936   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       5.314  -9.626   0.000  0.00  0.00           C+0
HETATM   12  N   UNK     0       5.314  -8.086   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0       6.648  -7.316   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       7.981  -8.086   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       7.981  -9.626   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       6.648 -10.396   0.000  0.00  0.00           C+0
HETATM   17  N   UNK     0       6.968 -11.902   0.000  0.00  0.00           N+0
HETATM   18  C   UNK     0       8.499 -12.063   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       9.126 -10.656   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      10.657 -10.495   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      11.562 -11.741   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      10.936 -13.148   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       9.404 -13.309   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       6.648  -5.776   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0       7.981  -5.006   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0       5.314  -5.006   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4    5                                                  
CONECT    4    3                                                            
CONECT    5    3    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8    9                                                  
CONECT    8    7                                                            
CONECT    9    7   10   11                                                  
CONECT   10    9                                                            
CONECT   11    9   12   16                                                  
CONECT   12   11   13                                                       
CONECT   13   12   14   24                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16   19                                                  
CONECT   16   15   17   11                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19   23                                                  
CONECT   19   18   20   15                                                  
CONECT   20   19   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21   23                                                       
CONECT   23   22   18                                                       
CONECT   24   13   25   26                                                  
CONECT   25   24                                                            
CONECT   26   24                                                            
MASTER        0    0    0    0    0    0    0    0   26    0   56    0
END
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3D PDB for HMDB0012492 (1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate)

COMPND    HMDB0012492
HETATM    1  O1  UNL     1      -2.936  -4.306   0.655  1.00  0.00           O  
HETATM    2  C1  UNL     1      -2.109  -3.751   0.033  1.00  0.00           C  
HETATM    3  O2  UNL     1      -1.277  -4.420  -0.882  1.00  0.00           O  
HETATM    4  C2  UNL     1      -1.856  -2.296   0.126  1.00  0.00           C  
HETATM    5  C3  UNL     1      -2.714  -1.605  -0.820  1.00  0.00           C  
HETATM    6  C4  UNL     1      -2.774  -0.285  -0.324  1.00  0.00           C  
HETATM    7  C5  UNL     1      -1.465   0.255   0.086  1.00  0.00           C  
HETATM    8  N1  UNL     1      -1.690   1.429   0.593  1.00  0.00           N  
HETATM    9  C6  UNL     1      -2.941   1.876   0.564  1.00  0.00           C  
HETATM   10  C7  UNL     1      -3.533   3.051   0.724  1.00  0.00           C  
HETATM   11  C8  UNL     1      -4.852   3.111   0.294  1.00  0.00           C  
HETATM   12  C9  UNL     1      -5.622   2.132  -0.257  1.00  0.00           C  
HETATM   13  C10 UNL     1      -4.910   0.887  -0.394  1.00  0.00           C  
HETATM   14  C11 UNL     1      -3.617   0.770  -0.018  1.00  0.00           C  
HETATM   15  C12 UNL     1      -0.303  -0.584  -0.295  1.00  0.00           C  
HETATM   16  C13 UNL     1       0.951   0.145   0.214  1.00  0.00           C  
HETATM   17  O3  UNL     1       0.923  -0.048   1.589  1.00  0.00           O  
HETATM   18  C14 UNL     1       2.207  -0.192  -0.495  1.00  0.00           C  
HETATM   19  O4  UNL     1       2.191   0.629  -1.659  1.00  0.00           O  
HETATM   20  C15 UNL     1       3.351   0.186   0.446  1.00  0.00           C  
HETATM   21  O5  UNL     1       3.591  -1.040   1.134  1.00  0.00           O  
HETATM   22  C16 UNL     1       4.528   0.706  -0.267  1.00  0.00           C  
HETATM   23  O6  UNL     1       4.444   2.094  -0.476  1.00  0.00           O  
HETATM   24  C17 UNL     1       5.747   0.346   0.500  1.00  0.00           C  
HETATM   25  O7  UNL     1       6.870   0.736  -0.182  1.00  0.00           O  
HETATM   26  N2  UNL     1      -0.517  -1.869   0.327  1.00  0.00           N  
HETATM   27  H1  UNL     1      -0.984  -5.369  -0.665  1.00  0.00           H  
HETATM   28  H2  UNL     1      -2.308  -2.049   1.212  1.00  0.00           H  
HETATM   29  H3  UNL     1      -2.358  -1.836  -1.806  1.00  0.00           H  
HETATM   30  H4  UNL     1      -3.777  -2.082  -0.638  1.00  0.00           H  
HETATM   31  H5  UNL     1      -0.913   1.949   1.226  1.00  0.00           H  
HETATM   32  H6  UNL     1      -2.967   3.851   1.119  1.00  0.00           H  
HETATM   33  H7  UNL     1      -5.344   4.078   0.513  1.00  0.00           H  
HETATM   34  H8  UNL     1      -6.581   2.243  -0.651  1.00  0.00           H  
HETATM   35  H9  UNL     1      -5.472   0.027  -0.780  1.00  0.00           H  
HETATM   36  H10 UNL     1      -0.168  -0.606  -1.395  1.00  0.00           H  
HETATM   37  H11 UNL     1       0.737   1.256   0.072  1.00  0.00           H  
HETATM   38  H12 UNL     1       0.910  -1.002   1.830  1.00  0.00           H  
HETATM   39  H13 UNL     1       2.180  -1.233  -0.817  1.00  0.00           H  
HETATM   40  H14 UNL     1       2.062   1.580  -1.438  1.00  0.00           H  
HETATM   41  H15 UNL     1       3.013   0.902   1.207  1.00  0.00           H  
HETATM   42  H16 UNL     1       3.107  -1.793   0.812  1.00  0.00           H  
HETATM   43  H17 UNL     1       4.561   0.331  -1.342  1.00  0.00           H  
HETATM   44  H18 UNL     1       3.949   2.436   0.372  1.00  0.00           H  
HETATM   45  H19 UNL     1       5.664   0.929   1.463  1.00  0.00           H  
HETATM   46  H20 UNL     1       5.778  -0.724   0.705  1.00  0.00           H  
HETATM   47  H21 UNL     1       7.022   1.694  -0.146  1.00  0.00           H  
HETATM   48  H22 UNL     1       0.204  -2.538   0.056  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   27
CONECT    4    5   26   28
CONECT    5    6   29   30
CONECT    6    7    7   14
CONECT    7    8   15
CONECT    8    9   31
CONECT    9   10   10   14
CONECT   10   11   32
CONECT   11   12   12   33
CONECT   12   13   34
CONECT   13   14   14   35
CONECT   15   16   26   36
CONECT   16   17   18   37
CONECT   17   38
CONECT   18   19   20   39
CONECT   19   40
CONECT   20   21   22   41
CONECT   21   42
CONECT   22   23   24   43
CONECT   23   44
CONECT   24   25   45   46
CONECT   25   47
CONECT   26   48
END
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SMILES for HMDB0012492 (1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate)

OCC(O)C(O)C(O)C(O)C1NC(CC2=C1NC1=C2C=CC=C1)C(O)=O
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INCHI for HMDB0012492 (1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate)

InChI=1S/C17H22N2O7/c20-6-11(21)14(22)16(24)15(23)13-12-8(5-10(19-13)17(25)26)7-3-1-2-4-9(7)18-12/h1-4,10-11,13-16,18-24H,5-6H2,(H,25,26)
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View in JSmolView NMR AssignmentsView Stereo Labels
Synonyms
ValueSource
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-b-carboline-3-carboxylateGenerator
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-b-carboline-3-carboxylic acidGenerator
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylic acidGenerator
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-β-carboline-3-carboxylateGenerator
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acidGenerator
1,2,3,4-Tetrahydro-1-(1,2,3,4,5-pentahydroxypentyl)-b-carboline-3-carboxylic acidHMDB
1-C-(3-Carboxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pentitol, 9ciHMDB
1-(1,2,3,4,5-Pentahydroxypentyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-3-carboxylateHMDB
Chemical FormulaC17H22N2O7
Average Molecular Weight366.3658
Monoisotopic Molecular Weight366.142701068
IUPAC Name1-(1,2,3,4,5-pentahydroxypentyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-3-carboxylic acid
Traditional Name1-(1,2,3,4,5-pentahydroxypentyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-3-carboxylic acid
CAS Registry NumberNot Available
SMILES
OCC(O)C(O)C(O)C(O)C1NC(CC2=C1NC1=C2C=CC=C1)C(O)=O
InChI Identifier
InChI=1S/C17H22N2O7/c20-6-11(21)14(22)16(24)15(23)13-12-8(5-10(19-13)17(25)26)7-3-1-2-4-9(7)18-12/h1-4,10-11,13-16,18-24H,5-6H2,(H,25,26)
InChI KeyLCHFAYIGHOVWSA-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as 8-prenylated xanthones. These are organic compounds containing a C5-isoprenoid group linked to a xanthone moiety at the 8-position. Xanthone is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring that carries a ketone group.
KingdomOrganic compounds
Super ClassOrganoheterocyclic compounds
ClassBenzopyrans
Sub Class1-benzopyrans
Direct Parent8-prenylated xanthones
Alternative Parents
Substituents
  • 4-prenylated xanthone
  • 8-prenylated xanthone
  • Chromone
  • 1-hydroxy-2-unsubstituted benzenoid
  • Pyranone
  • Pyran
  • Benzenoid
  • Heteroaromatic compound
  • Vinylogous acid
  • Polyol
  • Oxacycle
  • Organic oxygen compound
  • Hydrocarbon derivative
  • Organic oxide
  • Organooxygen compound
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External DescriptorsNot Available
Ontology
Not AvailableNot Available
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility25.2 g/LALOGPS
logP-1.6ALOGPS
logP-4.1ChemAxon
logS-1.3ALOGPS
pKa (Strongest Acidic)3.04ChemAxon
pKa (Strongest Basic)6.55ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count8ChemAxon
Hydrogen Donor Count8ChemAxon
Polar Surface Area166.27 ŲChemAxon
Rotatable Bond Count6ChemAxon
Refractivity89.22 m³·mol⁻¹ChemAxon
Polarizability37.56 ųChemAxon
Number of Rings3ChemAxon
BioavailabilityYesChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+184.78631661259
DarkChem[M-H]-182.49131661259
DarkChem[M+H]+184.78631661259
DarkChem[M-H]-182.49131661259
DeepCCS[M+H]+179.42230932474
DeepCCS[M-H]-177.06430932474
DeepCCS[M-2H]-210.83130932474
DeepCCS[M+Na]+186.05830932474
AllCCS[M+H]+187.532859911
AllCCS[M+H-H2O]+184.632859911
AllCCS[M+NH4]+190.132859911
AllCCS[M+Na]+190.832859911
AllCCS[M-H]-186.032859911
AllCCS[M+Na-2H]-186.132859911
AllCCS[M+HCOO]-186.432859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylateOCC(O)C(O)C(O)C(O)C1NC(CC2=C1NC1=C2C=CC=C1)C(O)=O4789.8Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylateOCC(O)C(O)C(O)C(O)C1NC(CC2=C1NC1=C2C=CC=C1)C(O)=O3124.1Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylateOCC(O)C(O)C(O)C(O)C1NC(CC2=C1NC1=C2C=CC=C1)C(O)=O3835.7Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TMS,isomer #1C[Si](C)(C)OCC(O)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213698.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TMS,isomer #2C[Si](C)(C)OC(CO)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213705.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TMS,isomer #3C[Si](C)(C)OC(C(O)CO)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213693.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TMS,isomer #4C[Si](C)(C)OC(C(O)C(O)CO)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213674.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TMS,isomer #5C[Si](C)(C)OC(C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C21)C(O)C(O)C(O)CO3629.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TMS,isomer #6C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O)C(O)CO)N13613.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TMS,isomer #7C[Si](C)(C)N1C(C(=O)O)CC2=C([NH]C3=CC=CC=C23)C1C(O)C(O)C(O)C(O)CO3658.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TMS,isomer #8C[Si](C)(C)N1C2=C(CC(C(=O)O)NC2C(O)C(O)C(O)C(O)CO)C2=CC=CC=C213670.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #1C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213615.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #10C[Si](C)(C)OC(CO)C(O)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213569.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #11C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O)C(CO)O[Si](C)(C)C)N13561.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #12C[Si](C)(C)OC(CO)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23586.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #13C[Si](C)(C)OC(CO)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213628.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #14C[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213599.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #15C[Si](C)(C)OC(C(O)CO)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213565.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #16C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O[Si](C)(C)C)C(O)CO)N13547.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #17C[Si](C)(C)OC(C(O)CO)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23587.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #18C[Si](C)(C)OC(C(O)CO)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213618.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #19C[Si](C)(C)OC(C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C21)C(O[Si](C)(C)C)C(O)C(O)CO3552.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #2C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213610.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #20C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C)C(O)C(O)CO)N13517.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #21C[Si](C)(C)OC(C(O)C(O)CO)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23585.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #22C[Si](C)(C)OC(C(O)C(O)CO)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213590.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #23C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O)C(O)C(O)CO)N13511.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #24C[Si](C)(C)OC(C(O)C(O)C(O)CO)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23589.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #25C[Si](C)(C)OC(C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C21)C(O)C(O)C(O)CO3540.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #26C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O)C(O)CO)N1)N([Si](C)(C)C)C1=CC=CC=C213545.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #27C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O)C(O)CO)N1[Si](C)(C)C3559.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #28C[Si](C)(C)N1C(C(=O)O)CC2=C(C1C(O)C(O)C(O)C(O)CO)N([Si](C)(C)C)C1=CC=CC=C213573.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #3C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213595.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #4C[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213558.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #5C[Si](C)(C)OCC(O)C(O)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213532.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #6C[Si](C)(C)OCC(O)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23580.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #7C[Si](C)(C)OCC(O)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213602.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #8C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213610.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TMS,isomer #9C[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213597.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #1C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213540.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #10C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23551.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #11C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213526.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #12C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213452.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #13C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213447.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #14C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23561.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #15C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213519.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #16C[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213437.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #17C[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23530.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #18C[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213473.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #19C[Si](C)(C)OCC(O)C(O)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23489.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #2C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213495.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #20C[Si](C)(C)OCC(O)C(O)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213475.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #21C[Si](C)(C)OCC(O)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3513.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #22C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213502.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #23C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213469.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #24C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N13472.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #25C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23568.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #26C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213537.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #27C[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213451.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #28C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C)C(O)C(CO)O[Si](C)(C)C)N13456.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #29C[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23557.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #3C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213472.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #30C[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213531.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #31C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O)C(O)C(CO)O[Si](C)(C)C)N13456.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #32C[Si](C)(C)OC(CO)C(O)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23555.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #33C[Si](C)(C)OC(CO)C(O)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213504.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #34C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O)C(CO)O[Si](C)(C)C)N1)N([Si](C)(C)C)C1=CC=CC=C213499.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #35C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C3514.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #36C[Si](C)(C)OC(CO)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3538.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #37C[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213473.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #38C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)CO)N13446.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #39C[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23559.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #4C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213471.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #40C[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213525.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #41C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)CO)N13450.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #42C[Si](C)(C)OC(C(O)CO)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23536.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #43C[Si](C)(C)OC(C(O)CO)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213475.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #44C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O[Si](C)(C)C)C(O)CO)N1)N([Si](C)(C)C)C1=CC=CC=C213499.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #45C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O[Si](C)(C)C)C(O)CO)N1[Si](C)(C)C3523.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #46C[Si](C)(C)OC(C(O)CO)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3538.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #47C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)CO)N13424.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #48C[Si](C)(C)OC(C(O)C(O)CO)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23530.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #49C[Si](C)(C)OC(C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C21)C(O[Si](C)(C)C)C(O)C(O)CO3473.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #5C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23543.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #50C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C)C(O)C(O)CO)N1)N([Si](C)(C)C)C1=CC=CC=C213460.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #51C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C)C(O)C(O)CO)N1[Si](C)(C)C3496.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #52C[Si](C)(C)OC(C(O)C(O)CO)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3529.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #53C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O)C(O)C(O)CO)N1)N([Si](C)(C)C)C1=CC=CC=C213435.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #54C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O)C(O)C(O)CO)N1[Si](C)(C)C3499.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #55C[Si](C)(C)OC(C(O)C(O)C(O)CO)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3529.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #56C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O)C(O)CO)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213510.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #6C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213538.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #7C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213491.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #8C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213461.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TMS,isomer #9C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213467.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #1C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213399.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #10C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213378.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #11C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23532.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #12C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213410.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #13C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23472.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #14C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213411.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #15C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3491.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #16C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213363.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #17C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213349.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #18C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23524.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #19C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213429.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #2C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213381.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #20C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213368.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #21C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23517.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #22C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213412.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #23C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23477.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #24C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213408.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #25C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3503.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #26C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213352.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #27C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23528.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #28C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213412.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #29C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23500.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #3C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213390.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #30C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213407.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #31C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3520.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #32C[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23468.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #33C[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213390.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #34C[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3495.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #35C[Si](C)(C)OCC(O)C(O)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3474.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #36C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213382.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #37C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N13368.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #38C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23541.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #39C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213434.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #4C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23534.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #40C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N13379.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #41C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23531.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #42C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213417.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #43C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1)N([Si](C)(C)C)C1=CC=CC=C213412.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #44C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C3482.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #45C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3510.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #46C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(CO)O[Si](C)(C)C)N13362.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #47C[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23530.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #48C[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213413.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #49C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C)C(O)C(CO)O[Si](C)(C)C)N1)N([Si](C)(C)C)C1=CC=CC=C213417.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #5C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213447.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #50C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C)C(O)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C3499.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #51C[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3528.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #52C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O)C(O)C(CO)O[Si](C)(C)C)N1)N([Si](C)(C)C)C1=CC=CC=C213418.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #53C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O)C(O)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C3495.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #54C[Si](C)(C)OC(CO)C(O)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3526.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #55C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213500.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #56C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)CO)N13373.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #57C[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23521.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #58C[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213426.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #59C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)CO)N1)N([Si](C)(C)C)C1=CC=CC=C213414.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #6C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213357.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #60C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)CO)N1[Si](C)(C)C3490.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #61C[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3518.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #62C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)CO)N1)N([Si](C)(C)C)C1=CC=CC=C213407.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #63C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)CO)N1[Si](C)(C)C3482.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #64C[Si](C)(C)OC(C(O)CO)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3508.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #65C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O[Si](C)(C)C)C(O)CO)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213506.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #66C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)CO)N1)N([Si](C)(C)C)C1=CC=CC=C213379.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #67C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)CO)N1[Si](C)(C)C3457.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #68C[Si](C)(C)OC(C(O)C(O)CO)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3492.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #69C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C)C(O)C(O)CO)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213498.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #7C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213374.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #70C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O)C(O)C(O)CO)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213477.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #8C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23535.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TMS,isomer #9C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213430.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #1C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213310.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #10C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3481.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #11C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213267.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #12C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23468.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #13C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213351.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #14C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23450.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #15C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213344.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #16C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3501.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #17C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23450.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #18C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213348.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #19C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3495.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #2C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213278.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #20C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3446.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #21C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213251.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #22C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23457.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #23C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213348.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #24C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23434.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #25C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213326.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #26C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3487.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #27C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23448.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #28C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213338.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #29C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3487.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #3C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23478.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #30C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3454.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #31C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23447.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #32C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213335.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #33C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3495.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #34C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3480.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #35C[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3444.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #36C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N13284.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #37C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23477.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #38C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213358.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #39C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1)N([Si](C)(C)C)C1=CC=CC=C213334.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #4C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213367.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #40C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C3439.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #41C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3495.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #42C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1)N([Si](C)(C)C)C1=CC=CC=C213353.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #43C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C3446.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #44C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3492.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #45C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213451.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #46C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(CO)O[Si](C)(C)C)N1)N([Si](C)(C)C)C1=CC=CC=C213336.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #47C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C3451.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #48C[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3493.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #49C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C)C(O)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213478.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #5C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213302.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #50C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O)C(O)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213458.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #51C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)CO)N1)N([Si](C)(C)C)C1=CC=CC=C213347.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #52C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)CO)N1[Si](C)(C)C3435.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #53C[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3495.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #54C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)CO)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213471.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #55C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)CO)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213456.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #56C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)CO)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213426.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #6C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23471.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #7C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213364.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #8C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23434.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,5TMS,isomer #9C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213348.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #1C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1[NH]C1=CC=CC=C213229.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #10C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3419.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #11C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23384.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #12C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213286.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #13C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3448.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #14C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3442.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #15C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3427.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #16C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23369.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #17C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213277.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #18C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3438.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #19C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3429.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #2C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23418.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #20C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3422.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #21C[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3419.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #22C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1)N([Si](C)(C)C)C1=CC=CC=C213290.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #23C[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C3388.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #24C[Si](C)(C)OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3448.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #25C[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213422.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #26C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213412.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #27C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213414.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #28C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)CO)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213401.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #3C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213321.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #4C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23390.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #5C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213285.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #6C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3460.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #7C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23395.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #8C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213303.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,6TMS,isomer #9C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3454.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #1C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23352.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #1C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23386.4Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #1C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1[NH]23660.1Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #2C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213276.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #2C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213328.0Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #2C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1NC(C(=O)O[Si](C)(C)C)CC2=C1N([Si](C)(C)C)C1=CC=CC=C213594.0Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #3C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3439.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #3C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3373.5Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #3C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3692.7Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #4C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3412.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #4C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3364.9Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #4C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3663.2Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #5C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3398.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #5C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3376.3Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #5C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3653.6Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #6C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3393.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #6C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3382.7Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #6C[Si](C)(C)OCC(O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3660.4Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #7C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3382.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #7C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3381.9Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #7C[Si](C)(C)OCC(O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C)N1[Si](C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C3638.4Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #8C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213382.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #8C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213369.8Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,7TMS,isomer #8C[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO)O[Si](C)(C)C)N1[Si](C)(C)C)N([Si](C)(C)C)C1=CC=CC=C213630.7Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213961.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213971.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213964.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(C(O)C(O)CO)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C213939.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C21)C(O)C(O)C(O)CO3897.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O)C(O)CO)N13904.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TBDMS,isomer #7CC(C)(C)[Si](C)(C)N1C(C(=O)O)CC2=C([NH]C3=CC=CC=C23)C1C(O)C(O)C(O)C(O)CO3942.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,1TBDMS,isomer #8CC(C)(C)[Si](C)(C)N1C2=C(CC(C(=O)O)NC2C(O)C(O)C(O)C(O)CO)C2=CC=CC=C213879.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214133.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214086.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N14096.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24134.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #13CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214066.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #14CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214102.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #15CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214058.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N14086.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24134.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214061.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC(C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C21)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)CO4036.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214133.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)CO)N14053.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC(C(O)C(O)CO)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24120.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC(C(O)C(O)CO)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214028.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)CO)N14031.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC(C(O)C(O)C(O)CO)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24102.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #25CC(C)(C)[Si](C)(C)OC(C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C21)C(O)C(O)C(O)CO3982.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #26CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O)C(O)CO)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214016.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #27CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O)C(O)CO)N1[Si](C)(C)C(C)(C)C4087.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #28CC(C)(C)[Si](C)(C)N1C(C(=O)O)CC2=C(C1C(O)C(O)C(O)C(O)CO)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214031.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214130.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214058.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214076.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24121.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214045.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214134.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214126.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214254.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24268.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214144.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214159.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214160.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24280.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #15CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214141.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #16CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214110.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #17CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24231.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #18CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214088.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #19CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24203.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214238.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #20CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214078.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #21CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4164.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214234.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214179.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(CO)O[Si](C)(C)C(C)(C)C)N14177.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #25CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24261.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #26CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214145.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #27CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214149.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #28CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N14147.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #29CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24269.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214192.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #30CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214126.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #31CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N14133.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #32CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24248.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #33CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214109.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #34CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214096.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #35CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C4216.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #36CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4179.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #37CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214135.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #38CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N14144.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #39CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24261.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214170.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #40CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214127.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #41CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N14106.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #41CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N13696.2Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #41CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N14697.0Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #42CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24223.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #43CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214087.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #44CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214102.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #45CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N1[Si](C)(C)C(C)(C)C4214.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #46CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4186.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #47CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)CO)N14087.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #48CC(C)(C)[Si](C)(C)OC(C(O)C(O)CO)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24218.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #49CC(C)(C)[Si](C)(C)OC(C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C21)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)CO4070.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24263.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #50CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)CO)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214065.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #51CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)CO)N1[Si](C)(C)C(C)(C)C4211.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #52CC(C)(C)[Si](C)(C)OC(C(O)C(O)CO)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4190.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #53CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)CO)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214057.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #54CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)CO)N1[Si](C)(C)C(C)(C)C4186.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #55CC(C)(C)[Si](C)(C)OC(C(O)C(O)C(O)CO)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4182.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #56CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O)C(O)CO)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214151.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214151.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214231.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214179.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214165.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214284.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #10CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214218.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #11CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24319.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #12CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214161.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #13CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24287.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #14CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214122.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #15CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4279.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #16CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214237.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #17CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214220.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #18CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24349.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #19CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214183.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214267.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #20CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214210.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #21CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24324.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #22CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214163.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #23CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24297.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #24CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214119.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #25CC(C)(C)[Si](C)(C)OCC(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4277.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #26CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214195.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #27CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24309.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #28CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214150.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #29CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24309.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214251.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #30CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214123.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #31CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4300.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #32CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24265.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #33CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214102.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #34CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4276.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #35CC(C)(C)[Si](C)(C)OCC(O)C(O)C(O)C(O)C1C2=C(CC(C(=O)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4225.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #36CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214226.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #37CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(CO)O[Si](C)(C)C(C)(C)C)N14227.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #38CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24341.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #39CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214178.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24342.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #40CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(CO)O[Si](C)(C)C(C)(C)C)N14215.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #41CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24315.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #42CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214162.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #43CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(CO)O[Si](C)(C)C(C)(C)C)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214126.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #44CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(CO)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C4285.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #45CC(C)(C)[Si](C)(C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4274.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #46CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N14194.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #47CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24315.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #48CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214147.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #49CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214123.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214190.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #50CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C4307.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #51CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4292.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #52CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214126.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #53CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C4285.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #54CC(C)(C)[Si](C)(C)OC(CO)C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4293.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #55CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O)C(CO)O[Si](C)(C)C(C)(C)C)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214236.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #56CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N14185.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #56CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N13896.6Standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #56CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N14499.4Standard polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #57CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24294.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #58CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214143.1Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #59CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214117.0Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1NC(C(=O)O)CC2=C1[NH]C1=CC=CC=C214243.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #60CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N1[Si](C)(C)C(C)(C)C4291.3Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #61CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4279.9Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #62CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214105.5Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #63CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N1[Si](C)(C)C(C)(C)C4261.2Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #64CC(C)(C)[Si](C)(C)OC(C(O)CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4265.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #65CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)CO)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214232.4Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #66CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)CO)N1)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214084.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #67CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C([NH]C3=CC=CC=C23)C(C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)CO)N1[Si](C)(C)C(C)(C)C4250.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #68CC(C)(C)[Si](C)(C)OC(C(O)C(O)CO)C(O[Si](C)(C)C(C)(C)C)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1N2[Si](C)(C)C(C)(C)C4266.6Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #69CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C(O)CO)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214231.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #7CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O[Si](C)(C)C(C)(C)C)CC2=C1[NH]C1=CC=CC=C214238.7Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #70CC(C)(C)[Si](C)(C)OC(=O)C1CC2=C(C(C(O[Si](C)(C)C(C)(C)C)C(O)C(O)C(O)CO)N1[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214231.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #8CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1C2=C(CC(C(=O)O)N1[Si](C)(C)C(C)(C)C)C1=CC=CC=C1[NH]24357.8Semi standard non polar33892256
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate,4TBDMS,isomer #9CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C(O)C1NC(C(=O)O)CC2=C1N([Si](C)(C)C(C)(C)C)C1=CC=CC=C214192.2Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate GC-MS (Non-derivatized) - 70eV, Positivesplash10-07bb-9086000000-f9817373dcbb48a00ead2017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate GC-MS (4 TMS) - 70eV, Positivesplash10-066r-1092238000-8a73a9d7c71faf7077422017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 10V, Positive-QTOFsplash10-014j-2019000000-f66e1f938b58a2d0ba872016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 20V, Positive-QTOFsplash10-03di-9453000000-e1c15a396692213251542016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 40V, Positive-QTOFsplash10-014i-9820000000-4592a1a9ad5f5701322f2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 10V, Negative-QTOFsplash10-0q4u-7098000000-cf33a70ee23840fab6762016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 20V, Negative-QTOFsplash10-0abl-8191000000-35b3333d76ce8a3c796c2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 40V, Negative-QTOFsplash10-0a4l-9030000000-f91a3596176e7837fc7f2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 10V, Negative-QTOFsplash10-0002-0396000000-d827a244ffe0a2c0c6fa2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 20V, Negative-QTOFsplash10-00kb-0290000000-97bec0f48574a53ed0712021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 40V, Negative-QTOFsplash10-0fr2-0690000000-7c1bfbeb116d5b8be2c92021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 10V, Positive-QTOFsplash10-00kb-0019000000-9f6a5ad048923d81db752021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 20V, Positive-QTOFsplash10-015a-0039000000-ec40574589c9a65187f82021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 40V, Positive-QTOFsplash10-0fr7-1950000000-243db3326d0d83bf067d2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 10V, Negative-QTOFsplash10-00os-0095000000-434183b2caa2a5fc0e2e2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 20V, Negative-QTOFsplash10-002b-0290000000-cd470a35408a3c672cb42021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 40V, Negative-QTOFsplash10-00kb-0790000000-268f41ef52f47148a6ab2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 10V, Positive-QTOFsplash10-00l2-0019000000-bcc589f4c881eb9d4a532021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 20V, Positive-QTOFsplash10-015a-0029000000-56506c109d6f5437d8fe2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate 40V, Positive-QTOFsplash10-0un9-2790000000-3d689c092b66a1e858f92021-09-24Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB001280
KNApSAcK IDNot Available
Chemspider ID19993304
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound21125948
PDB IDNot Available
ChEBI ID169367
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Herraiz T, Galisteo J: Identification and occurrence of the novel alkaloid pentahydroxypentyl-tetrahydro-beta-carboline-3-carboxylic acid as a tryptophan glycoconjugate in fruit juices and jams. J Agric Food Chem. 2002 Jul 31;50(16):4690-5. [PubMed:12137498 ]