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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 17:32:32 UTC

Update Date

2022-03-07 02:52:17 UTC

HMDB ID

HMDB0029771

Secondary Accession Numbers

HMDB29771

Metabolite Identification

Common Name

7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside]

Description

7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] belongs to the class of organic compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol. Based on a literature review a small amount of articles have been published on 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside].

Structure

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

  Mrv0541 02241210142D          

 36 38  0  0  0  0            999 V2000
   -4.9133   -1.2398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9133   -2.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6284   -2.4776    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1995   -2.4776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4857   -2.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7706   -2.4776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7290   -0.1946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1995   -0.8272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6672   -0.1946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4857   -1.2398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7706   -0.8272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0581   -1.2398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3443   -0.8272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6306   -1.2398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3443   -0.0034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7706   -1.6524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6306    0.4092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0846   -0.0034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8025    0.4092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0846    1.6524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6306    1.2357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3443    1.6524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5177    1.6524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9466   -0.0034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0346   -0.8231    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8392   -0.9936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2477   -0.2813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6948    0.3280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8653    1.1352    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0674   -0.1918    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8308   -0.8643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6284   -0.6512    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  1  0  0  0  0
  2  3  2  0  0  0  0
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  4  5  2  0  0  0  0
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  5 10  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
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 10 16  1  0  0  0  0
 11 12  1  0  0  0  0
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 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 22  1  0  0  0  0
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 20 25  1  0  0  0  0
 21 22  1  0  0  0  0
 21 24  1  0  0  0  0
 22 23  1  0  0  0  0
 26 27  1  0  0  0  0
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 31 34  1  0  0  0  0
 31 35  1  0  0  0  0
 32 33  1  0  0  0  0
 35 36  1  0  0  0  0
M  END

HMDB0029771
     RDKit          3D
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside]
 76 78  0  0  0  0  0  0  0  0999 V2000
   -4.7191   -0.0594   -3.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2261    0.4128   -1.7121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1895    1.3567   -1.7034 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.0196   -0.4970    0.3597 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9087   -1.3088   -0.5654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7572   -1.2896    1.5970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8105   -0.0147   -0.3646 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4185    1.1837    0.2979 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6222   -0.9140   -0.2981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4390   -0.2607   -0.8698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1428   -1.3955   -0.7153 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1854   -1.4031    1.0407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2557   -0.5140   -0.8184 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2362    0.4249    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6231    0.1642    0.0835 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3794    1.1233    0.6824 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8258    0.8413    0.2235 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4487    2.7400    0.2823 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.0841   -0.4841    1.9816 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9706    0.1474    1.5174 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3442   -0.6663    2.8453 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4182    3.0927    0.8518 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1746    3.8225   -0.8293 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1693    3.3040   -1.5996 H   0  0  0  0  0  0  0  0  0  0  0  0
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 32 72  1  0
 33 73  1  0
 34 74  1  0
 35 75  1  0
 36 76  1  0
M  END

  Mrv0541 02241210142D          

 36 38  0  0  0  0            999 V2000
   -4.9133   -1.2398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9133   -2.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6284   -2.4776    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1995   -2.4776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4857   -2.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.7290   -0.1946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1995   -0.8272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 11  1  0  0  0  0
 10 16  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
 13 15  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 22  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 26  1  0  0  0  0
 20 21  1  0  0  0  0
 20 25  1  0  0  0  0
 21 22  1  0  0  0  0
 21 24  1  0  0  0  0
 22 23  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 32  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 31 34  1  0  0  0  0
 31 35  1  0  0  0  0
 32 33  1  0  0  0  0
 35 36  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0029771

> <DATABASE_NAME>
hmdb

> <SMILES>
CC(CCC1(O)C(C)=CC(=O)CC1(C)C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O

> <INCHI_IDENTIFIER>
InChI=1S/C24H40O12/c1-12-7-14(26)8-22(3,4)24(12,32)6-5-13(2)35-20-18(29)17(28)16(27)15(36-20)9-33-21-19(30)23(31,10-25)11-34-21/h7,13,15-21,25,27-32H,5-6,8-11H2,1-4H3

> <INCHI_KEY>
VXZUZURNJDKPBW-UHFFFAOYSA-N

> <FORMULA>
C24H40O12

> <MOLECULAR_WEIGHT>
520.5672

> <EXACT_MASS>
520.251976744

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_AVERAGE_POLARIZABILITY>
54.08203073639895

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
4-(3-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}butyl)-4-hydroxy-3,5,5-trimethylcyclohex-2-en-1-one

> <ALOGPS_LOGP>
-0.92

> <JCHEM_LOGP>
-1.5782289340000009

> <ALOGPS_LOGS>
-2.18

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.307519434605986

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.701516752229308

> <JCHEM_PKA_STRONGEST_BASIC>
-3.1423790163389214

> <JCHEM_POLAR_SURFACE_AREA>
195.6

> <JCHEM_REFRACTIVITY>
123.20209999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.43e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
4-(3-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}butyl)-4-hydroxy-3,5,5-trimethylcyclohex-2-en-1-one

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0029771
     RDKit          3D
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside]
 76 78  0  0  0  0  0  0  0  0999 V2000
   -4.7191   -0.0594   -3.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2261    0.4128   -1.7121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1895    1.3567   -1.7034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6523    1.7801   -0.3808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8928    2.9844   -0.1668 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8327    0.7686    0.6966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0196   -0.4970    0.3597 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9087   -1.3088   -0.5654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7572   -1.2896    1.5970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8105   -0.0147   -0.3646 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4185    1.1837    0.2979 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6222   -0.9140   -0.2981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4390   -0.2607   -0.8698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1428   -1.3955   -0.7153 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1854   -1.4031    1.0407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2557   -0.5140   -0.8184 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2362    0.4249    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6231    0.1642    0.0835 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3794    1.1233    0.6824 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8258    0.8413    0.2235 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2519   -0.4152    0.6243 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5299   -0.5771    0.1188 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5867   -1.7125   -0.6964 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9428   -1.9262   -0.7822 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4433   -1.8068    0.6242 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4090   -3.0272    1.2520 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8192   -1.1696    0.6522 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2125   -0.9739    1.9505 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4752   -0.8327    1.2580 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8884   -1.3346    2.3963 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1208    2.5391    0.1658 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2816    3.2517   -0.0178 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3465    2.3216   -1.1204 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9051    1.3868   -1.9589 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0081    1.8015   -0.6428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4487    2.7400    0.2823 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9857    0.6437   -3.4886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3144   -1.0909   -2.9913 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5427   -0.1139   -3.7801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5798    1.7634   -2.6087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9038    0.5019    0.7545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4817    1.1716    1.6460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3181   -2.0112   -1.1749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5634   -0.6437   -1.1748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5789   -1.8989    0.0881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6807   -2.3624    1.3252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9000   -0.9398    2.1930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6923   -1.2063    2.2240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9289    1.7808   -0.3259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4666   -1.1678    0.7640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8646   -1.9064   -0.7779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0570    0.4745   -0.2045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3980   -0.1863   -1.9329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8491   -2.0974   -0.6330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1145   -1.5075    1.1670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6896   -2.3382    1.2002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7201   -0.5408    1.2668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1710    0.5194    1.0182 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3938    1.1225    1.7762 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5127    1.6320    0.5994 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9019    0.8611   -0.8818 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8774    0.2991   -0.4773 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3593   -1.1458   -1.4546 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1553   -2.9332   -1.2018 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4602   -3.1574    1.5581 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4906   -1.8186    0.0566 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7240   -0.1807    0.1517 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0841   -0.4841    1.9816 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9706    0.1474    1.5174 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3442   -0.6663    2.8453 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4182    3.0927    0.8518 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1746    3.8225   -0.8293 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1693    3.3040   -1.5996 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7167    1.5268   -2.9013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6190    1.7273   -1.5542 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0817    2.3585    0.9094 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  7 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 14 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 25 27  1  0
 27 28  1  0
 25 29  1  0
 29 30  1  0
 19 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 33 35  1  0
 35 36  1  0
 10  2  1  0
 35 17  1  0
 29 22  1  0
  1 37  1  0
  1 38  1  0
  1 39  1  0
  3 40  1  0
  6 41  1  0
  6 42  1  0
  8 43  1  0
  8 44  1  0
  8 45  1  0
  9 46  1  0
  9 47  1  0
  9 48  1  0
 11 49  1  0
 12 50  1  0
 12 51  1  0
 13 52  1  0
 13 53  1  0
 14 54  1  0
 15 55  1  0
 15 56  1  0
 15 57  1  0
 17 58  1  0
 19 59  1  0
 20 60  1  0
 20 61  1  0
 22 62  1  0
 24 63  1  0
 24 64  1  0
 26 65  1  0
 27 66  1  0
 27 67  1  0
 28 68  1  0
 29 69  1  0
 30 70  1  0
 31 71  1  0
 32 72  1  0
 33 73  1  0
 34 74  1  0
 35 75  1  0
 36 76  1  0
M  END

HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      -9.171  -2.314   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -9.171  -3.855   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0     -10.506  -4.625   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0      -7.839  -4.625   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -6.507  -3.855   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -5.172  -4.625   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -8.827  -0.363   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -7.839  -1.544   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -6.845  -0.363   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -6.507  -2.314   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -5.172  -1.544   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -3.842  -2.314   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -2.509  -1.544   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -1.177  -2.314   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      -2.509  -0.006   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0      -5.172  -3.084   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0      -1.177   0.764   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0       0.158  -0.006   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0       1.498   0.764   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       1.498   2.307   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       0.158   3.084   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -1.177   2.307   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      -2.509   3.084   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0       0.158   4.625   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0       2.833   3.084   0.000  0.00  0.00           O+0
HETATM   26  C   UNK     0       2.833  -0.006   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       4.165   0.764   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0       5.500  -0.006   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0       5.665  -1.536   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       7.167  -1.855   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       7.929  -0.525   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       6.897   0.612   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0       7.215   2.119   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0       9.459  -0.358   0.000  0.00  0.00           O+0
HETATM   35  C   UNK     0       9.017  -1.613   0.000  0.00  0.00           C+0
HETATM   36  O   UNK     0      10.506  -1.216   0.000  0.00  0.00           O+0
CONECT    1    2    8                                                       
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6   10                                                  
CONECT    6    5                                                            
CONECT    7    8                                                            
CONECT    8    1    7    9   10                                             
CONECT    9    8                                                            
CONECT   10    5    8   11   16                                             
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13   17                                                       
CONECT   16   10                                                            
CONECT   17   15   18   22                                                  
CONECT   18   17   19                                                       
CONECT   19   18   20   26                                                  
CONECT   20   19   21   25                                                  
CONECT   21   20   22   24                                                  
CONECT   22   17   21   23                                                  
CONECT   23   22                                                            
CONECT   24   21                                                            
CONECT   25   20                                                            
CONECT   26   19   27                                                       
CONECT   27   26   28                                                       
CONECT   28   27   29   32                                                  
CONECT   29   28   30                                                       
CONECT   30   29   31                                                       
CONECT   31   30   32   34   35                                             
CONECT   32   28   31   33                                                  
CONECT   33   32                                                            
CONECT   34   31                                                            
CONECT   35   31   36                                                       
CONECT   36   35                                                            
MASTER        0    0    0    0    0    0    0    0   36    0   76    0
END

COMPND    HMDB0029771
HETATM    1  C1  UNL     1      -4.719  -0.059  -3.001  1.00  0.00           C  
HETATM    2  C2  UNL     1      -5.226   0.413  -1.712  1.00  0.00           C  
HETATM    3  C3  UNL     1      -6.189   1.357  -1.703  1.00  0.00           C  
HETATM    4  C4  UNL     1      -6.652   1.780  -0.381  1.00  0.00           C  
HETATM    5  O1  UNL     1      -6.893   2.984  -0.167  1.00  0.00           O  
HETATM    6  C5  UNL     1      -6.833   0.769   0.697  1.00  0.00           C  
HETATM    7  C6  UNL     1      -6.020  -0.497   0.360  1.00  0.00           C  
HETATM    8  C7  UNL     1      -6.909  -1.309  -0.565  1.00  0.00           C  
HETATM    9  C8  UNL     1      -5.757  -1.290   1.597  1.00  0.00           C  
HETATM   10  C9  UNL     1      -4.810  -0.015  -0.365  1.00  0.00           C  
HETATM   11  O2  UNL     1      -4.418   1.184   0.298  1.00  0.00           O  
HETATM   12  C10 UNL     1      -3.622  -0.914  -0.298  1.00  0.00           C  
HETATM   13  C11 UNL     1      -2.439  -0.261  -0.870  1.00  0.00           C  
HETATM   14  C12 UNL     1      -1.143  -1.396  -0.715  1.00  0.00           C  
HETATM   15  C13 UNL     1      -1.185  -1.403   1.041  1.00  0.00           C  
HETATM   16  O3  UNL     1      -0.256  -0.514  -0.818  1.00  0.00           O  
HETATM   17  C14 UNL     1       0.236   0.425   0.012  1.00  0.00           C  
HETATM   18  O4  UNL     1       1.623   0.164   0.083  1.00  0.00           O  
HETATM   19  C15 UNL     1       2.379   1.123   0.682  1.00  0.00           C  
HETATM   20  C16 UNL     1       3.826   0.841   0.224  1.00  0.00           C  
HETATM   21  O5  UNL     1       4.252  -0.415   0.624  1.00  0.00           O  
HETATM   22  C17 UNL     1       5.530  -0.577   0.119  1.00  0.00           C  
HETATM   23  O6  UNL     1       5.587  -1.712  -0.696  1.00  0.00           O  
HETATM   24  C18 UNL     1       6.943  -1.926  -0.782  1.00  0.00           C  
HETATM   25  C19 UNL     1       7.443  -1.807   0.624  1.00  0.00           C  
HETATM   26  O7  UNL     1       7.409  -3.027   1.252  1.00  0.00           O  
HETATM   27  C20 UNL     1       8.819  -1.170   0.652  1.00  0.00           C  
HETATM   28  O8  UNL     1       9.212  -0.974   1.951  1.00  0.00           O  
HETATM   29  C21 UNL     1       6.475  -0.833   1.258  1.00  0.00           C  
HETATM   30  O9  UNL     1       5.888  -1.335   2.396  1.00  0.00           O  
HETATM   31  C22 UNL     1       2.121   2.539   0.166  1.00  0.00           C  
HETATM   32  O10 UNL     1       3.282   3.252  -0.018  1.00  0.00           O  
HETATM   33  C23 UNL     1       1.347   2.322  -1.120  1.00  0.00           C  
HETATM   34  O11 UNL     1       1.905   1.387  -1.959  1.00  0.00           O  
HETATM   35  C24 UNL     1      -0.008   1.802  -0.643  1.00  0.00           C  
HETATM   36  O12 UNL     1      -0.449   2.740   0.282  1.00  0.00           O  
HETATM   37  H1  UNL     1      -3.986   0.644  -3.489  1.00  0.00           H  
HETATM   38  H2  UNL     1      -4.314  -1.091  -2.991  1.00  0.00           H  
HETATM   39  H3  UNL     1      -5.543  -0.114  -3.780  1.00  0.00           H  
HETATM   40  H4  UNL     1      -6.580   1.763  -2.609  1.00  0.00           H  
HETATM   41  H5  UNL     1      -7.904   0.502   0.755  1.00  0.00           H  
HETATM   42  H6  UNL     1      -6.482   1.172   1.646  1.00  0.00           H  
HETATM   43  H7  UNL     1      -6.318  -2.011  -1.175  1.00  0.00           H  
HETATM   44  H8  UNL     1      -7.563  -0.644  -1.175  1.00  0.00           H  
HETATM   45  H9  UNL     1      -7.579  -1.899   0.088  1.00  0.00           H  
HETATM   46  H10 UNL     1      -5.681  -2.362   1.325  1.00  0.00           H  
HETATM   47  H11 UNL     1      -4.900  -0.940   2.193  1.00  0.00           H  
HETATM   48  H12 UNL     1      -6.692  -1.206   2.224  1.00  0.00           H  
HETATM   49  H13 UNL     1      -3.929   1.781  -0.326  1.00  0.00           H  
HETATM   50  H14 UNL     1      -3.467  -1.168   0.764  1.00  0.00           H  
HETATM   51  H15 UNL     1      -3.865  -1.906  -0.778  1.00  0.00           H  
HETATM   52  H16 UNL     1      -2.057   0.475  -0.205  1.00  0.00           H  
HETATM   53  H17 UNL     1      -2.398  -0.186  -1.933  1.00  0.00           H  
HETATM   54  H18 UNL     1      -1.849  -2.097  -0.633  1.00  0.00           H  
HETATM   55  H19 UNL     1      -0.114  -1.508   1.167  1.00  0.00           H  
HETATM   56  H20 UNL     1      -1.690  -2.338   1.200  1.00  0.00           H  
HETATM   57  H21 UNL     1      -1.720  -0.541   1.267  1.00  0.00           H  
HETATM   58  H22 UNL     1      -0.171   0.519   1.018  1.00  0.00           H  
HETATM   59  H23 UNL     1       2.394   1.122   1.776  1.00  0.00           H  
HETATM   60  H24 UNL     1       4.513   1.632   0.599  1.00  0.00           H  
HETATM   61  H25 UNL     1       3.902   0.861  -0.882  1.00  0.00           H  
HETATM   62  H26 UNL     1       5.877   0.299  -0.477  1.00  0.00           H  
HETATM   63  H27 UNL     1       7.359  -1.146  -1.455  1.00  0.00           H  
HETATM   64  H28 UNL     1       7.155  -2.933  -1.202  1.00  0.00           H  
HETATM   65  H29 UNL     1       6.460  -3.157   1.558  1.00  0.00           H  
HETATM   66  H30 UNL     1       9.491  -1.819   0.057  1.00  0.00           H  
HETATM   67  H31 UNL     1       8.724  -0.181   0.152  1.00  0.00           H  
HETATM   68  H32 UNL     1      10.084  -0.484   1.982  1.00  0.00           H  
HETATM   69  H33 UNL     1       6.971   0.147   1.517  1.00  0.00           H  
HETATM   70  H34 UNL     1       5.344  -0.666   2.845  1.00  0.00           H  
HETATM   71  H35 UNL     1       1.418   3.093   0.852  1.00  0.00           H  
HETATM   72  H36 UNL     1       3.175   3.823  -0.829  1.00  0.00           H  
HETATM   73  H37 UNL     1       1.169   3.304  -1.600  1.00  0.00           H  
HETATM   74  H38 UNL     1       1.717   1.527  -2.901  1.00  0.00           H  
HETATM   75  H39 UNL     1      -0.619   1.727  -1.554  1.00  0.00           H  
HETATM   76  H40 UNL     1      -1.082   2.358   0.909  1.00  0.00           H  
CONECT    1    2   37   38   39
CONECT    2    3    3   10
CONECT    3    4   40
CONECT    4    5    5    6
CONECT    6    7   41   42
CONECT    7    8    9   10
CONECT    8   43   44   45
CONECT    9   46   47   48
CONECT   10   11   12
CONECT   11   49
CONECT   12   13   50   51
CONECT   13   14   52   53
CONECT   14   15   16   54
CONECT   15   55   56   57
CONECT   16   17
CONECT   17   18   35   58
CONECT   18   19
CONECT   19   20   31   59
CONECT   20   21   60   61
CONECT   21   22
CONECT   22   23   29   62
CONECT   23   24
CONECT   24   25   63   64
CONECT   25   26   27   29
CONECT   26   65
CONECT   27   28   66   67
CONECT   28   68
CONECT   29   30   69
CONECT   30   70
CONECT   31   32   33   71
CONECT   32   72
CONECT   33   34   35   73
CONECT   34   74
CONECT   35   36   75
CONECT   36   76
END

HMDB0029771
     RDKit          3D
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside]
 76 78  0  0  0  0  0  0  0  0999 V2000
   -4.7191   -0.0594   -3.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2261    0.4128   -1.7121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1895    1.3567   -1.7034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6523    1.7801   -0.3808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8928    2.9844   -0.1668 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8327    0.7686    0.6966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0196   -0.4970    0.3597 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9087   -1.3088   -0.5654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7572   -1.2896    1.5970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8105   -0.0147   -0.3646 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4185    1.1837    0.2979 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6222   -0.9140   -0.2981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4390   -0.2607   -0.8698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1428   -1.3955   -0.7153 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1854   -1.4031    1.0407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2557   -0.5140   -0.8184 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2362    0.4249    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6231    0.1642    0.0835 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3794    1.1233    0.6824 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8258    0.8413    0.2235 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2519   -0.4152    0.6243 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5299   -0.5771    0.1188 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5867   -1.7125   -0.6964 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9428   -1.9262   -0.7822 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4433   -1.8068    0.6242 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4090   -3.0272    1.2520 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8192   -1.1696    0.6522 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2125   -0.9739    1.9505 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4752   -0.8327    1.2580 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8884   -1.3346    2.3963 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1208    2.5391    0.1658 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2816    3.2517   -0.0178 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3465    2.3216   -1.1204 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9051    1.3868   -1.9589 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0081    1.8015   -0.6428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4487    2.7400    0.2823 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9857    0.6437   -3.4886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3144   -1.0909   -2.9913 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5427   -0.1139   -3.7801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5798    1.7634   -2.6087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9038    0.5019    0.7545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4817    1.1716    1.6460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3181   -2.0112   -1.1749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5634   -0.6437   -1.1748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5789   -1.8989    0.0881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6807   -2.3624    1.3252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9000   -0.9398    2.1930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6923   -1.2063    2.2240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9289    1.7808   -0.3259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4666   -1.1678    0.7640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8646   -1.9064   -0.7779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0570    0.4745   -0.2045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3980   -0.1863   -1.9329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8491   -2.0974   -0.6330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1145   -1.5075    1.1670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6896   -2.3382    1.2002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7201   -0.5408    1.2668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1710    0.5194    1.0182 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3938    1.1225    1.7762 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5127    1.6320    0.5994 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9019    0.8611   -0.8818 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8774    0.2991   -0.4773 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3593   -1.1458   -1.4546 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1553   -2.9332   -1.2018 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4602   -3.1574    1.5581 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4906   -1.8186    0.0566 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7240   -0.1807    0.1517 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0841   -0.4841    1.9816 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9706    0.1474    1.5174 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3442   -0.6663    2.8453 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4182    3.0927    0.8518 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1746    3.8225   -0.8293 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1693    3.3040   -1.5996 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7167    1.5268   -2.9013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6190    1.7273   -1.5542 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0817    2.3585    0.9094 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  7 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 14 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 25 27  1  0
 27 28  1  0
 25 29  1  0
 29 30  1  0
 19 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 33 35  1  0
 35 36  1  0
 10  2  1  0
 35 17  1  0
 29 22  1  0
  1 37  1  0
  1 38  1  0
  1 39  1  0
  3 40  1  0
  6 41  1  0
  6 42  1  0
  8 43  1  0
  8 44  1  0
  8 45  1  0
  9 46  1  0
  9 47  1  0
  9 48  1  0
 11 49  1  0
 12 50  1  0
 12 51  1  0
 13 52  1  0
 13 53  1  0
 14 54  1  0
 15 55  1  0
 15 56  1  0
 15 57  1  0
 17 58  1  0
 19 59  1  0
 20 60  1  0
 20 61  1  0
 22 62  1  0
 24 63  1  0
 24 64  1  0
 26 65  1  0
 27 66  1  0
 27 67  1  0
 28 68  1  0
 29 69  1  0
 30 70  1  0
 31 71  1  0
 32 72  1  0
 33 73  1  0
 34 74  1  0
 35 75  1  0
 36 76  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Not Available

Chemical Formula

C₂₄H₄₀O₁₂

Average Molecular Weight

520.5672

Monoisotopic Molecular Weight

520.251976744

IUPAC Name

4-(3-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}butyl)-4-hydroxy-3,5,5-trimethylcyclohex-2-en-1-one

Traditional Name

4-(3-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}butyl)-4-hydroxy-3,5,5-trimethylcyclohex-2-en-1-one

CAS Registry Number

177261-70-0

SMILES

CC(CCC1(O)C(C)=CC(=O)CC1(C)C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O

InChI Identifier

InChI=1S/C24H40O12/c1-12-7-14(26)8-22(3,4)24(12,32)6-5-13(2)35-20-18(29)17(28)16(27)15(36-20)9-33-21-19(30)23(31,10-25)11-34-21/h7,13,15-21,25,27-32H,5-6,8-11H2,1-4H3

InChI Key

VXZUZURNJDKPBW-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Fatty Acyls

Sub Class

Fatty acyl glycosides

Direct Parent

Fatty acyl glycosides of mono- and disaccharides

Alternative Parents

Substituents

Fatty acyl glycoside of mono- or disaccharide
Megastigmane sesquiterpenoid
Sesquiterpenoid
Alkyl glycoside
Disaccharide
Glycosyl compound
O-glycosyl compound
Cyclohexenone
Oxane
Tetrahydrofuran
Tertiary alcohol
Ketone
Cyclic ketone
Secondary alcohol
Organoheterocyclic compound
Acetal
Oxacycle
Polyol
Alcohol
Organooxygen compound
Hydrocarbon derivative
Organic oxide
Carbonyl group
Organic oxygen compound
Primary alcohol
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Excreta

Biofluid or Excreta

Urine (HMDB: HMDB0029771)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0029771)

Source

Endogenous

Endogenous (HMDB: HMDB0029771)

Plant

Plant (HMDB: HMDB0029771)

Animal

Animal (HMDB: HMDB0029771)

Exogenous

Food

Food (HMDB: HMDB0029771)

Fruit

Fruits (FooDB: FOOD00871)

Exogenous (HMDB: HMDB0029771)

Process

Naturally occurring process

Biological process

Chemical reaction

Lipid Peroxidation (HMDB: HMDB0029771)

Biochemical pathway

Metabolic pathway

Fatty Acid Metabolism (HMDB: HMDB0029771)

Lipid metabolism pathway (HMDB: HMDB0029771)

Biochemical process

Lipid transport (HMDB: HMDB0029771)

Role

Biological role

Energy source (HMDB: HMDB0029771)

Physical Properties

State

Not Available

Experimental Molecular Properties

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

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	3.43 g/L	ALOGPS
logP	-0.92	ALOGPS
logP	-1.6	ChemAxon
logS	-2.2	ALOGPS
pKa (Strongest Acidic)	11.7	ChemAxon
pKa (Strongest Basic)	-3.1	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	12	ChemAxon
Hydrogen Donor Count	7	ChemAxon
Polar Surface Area	195.6 Å²	ChemAxon
Rotatable Bond Count	9	ChemAxon
Refractivity	123.2 m³·mol⁻¹	ChemAxon
Polarizability	54.08 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	214.861	31661259
DarkChem	[M-H]-	206.613	31661259
DeepCCS	[M+H]+	214.585	30932474
DeepCCS	[M-H]-	212.227	30932474
DeepCCS	[M-2H]-	245.565	30932474
DeepCCS	[M+Na]+	220.79	30932474
AllCCS	[M+H]+	221.8	32859911
AllCCS	[M+H-H2O]+	220.3	32859911
AllCCS	[M+NH4]+	223.1	32859911
AllCCS	[M+Na]+	223.5	32859911
AllCCS	[M-H]-	217.7	32859911
AllCCS	[M+Na-2H]-	219.7	32859911
AllCCS	[M+HCOO]-	222.0	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside]	CC(CCC1(O)C(C)=CC(=O)CC1(C)C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O	4011.5	Standard polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside]	CC(CCC1(O)C(C)=CC(=O)CC1(C)C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O	3663.0	Standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside]	CC(CCC1(O)C(C)=CC(=O)CC1(C)C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O	4013.3	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3911.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4000.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O	3932.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O	3970.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O	3930.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O	3916.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #7	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C	3918.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #8	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O	3912.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3841.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #10	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3878.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #11	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3847.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #12	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3868.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #13	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O	3814.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #14	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3831.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #15	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3823.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #16	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3792.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3806.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #18	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O	3746.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #19	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3848.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3798.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #20	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3819.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #21	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3832.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #22	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O	3803.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #23	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3815.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #24	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3821.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #25	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O	3790.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #26	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3824.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #27	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O	3744.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #28	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C	3782.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3828.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3815.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3778.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3799.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #7	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3767.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O	3859.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #9	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3892.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3728.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #10	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3659.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #11	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3599.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #12	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3717.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #13	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3681.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #14	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3686.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #15	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3646.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #16	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3667.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3677.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #18	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3634.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #19	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3675.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3752.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #20	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3585.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #21	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3615.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #22	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3762.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #23	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3746.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #24	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3704.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #25	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3720.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #26	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O	3658.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #27	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3767.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #28	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3723.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #29	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3746.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3744.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #30	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3703.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #31	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3734.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #32	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3740.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #33	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3693.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #34	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3740.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #35	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3649.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #36	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3681.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #37	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3705.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #38	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3663.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #39	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3675.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3711.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #40	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3619.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #41	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3649.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #42	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3664.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #43	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3620.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #44	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3654.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #45	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3578.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #46	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3601.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #47	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3689.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #48	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3696.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #49	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3666.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3718.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #50	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3695.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #51	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3616.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #52	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3643.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #53	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3716.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #54	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3628.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #55	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3644.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #56	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3633.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #6	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3659.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #7	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3700.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3687.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #9	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3654.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3657.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #10	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3619.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #11	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3619.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #12	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3548.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #13	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3616.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #14	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3522.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #15	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3522.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #16	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3597.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3573.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #18	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3565.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #19	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3483.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3645.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #20	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3568.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #21	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3577.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #22	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3495.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #23	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3570.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #24	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3475.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #25	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3472.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #26	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3575.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #27	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3578.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #28	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3518.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #29	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3573.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3619.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #30	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3485.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #31	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3493.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #32	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3587.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #33	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3495.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #34	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3509.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #35	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3498.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #36	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3656.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #37	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3612.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #38	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3623.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #39	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3573.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3613.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #40	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3607.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #41	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3611.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #42	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3551.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #43	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3606.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #44	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3519.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #45	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3530.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #46	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3623.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #47	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3625.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #48	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3590.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #49	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3625.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #5	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3527.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #50	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3546.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #51	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3566.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #52	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3632.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #53	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3549.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #54	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3557.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #55	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3550.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #56	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3549.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #57	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3553.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #58	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3507.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #59	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3547.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3658.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #60	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3472.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #61	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3484.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #62	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3565.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #63	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3493.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #64	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3504.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #65	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3493.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #66	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3589.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #67	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3520.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #68	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3526.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #69	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3523.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #7	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3624.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #70	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3554.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3625.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #9	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3565.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3565.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #10	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3417.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #11	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3521.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #12	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3524.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #13	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3463.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #14	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3518.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #15	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3440.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #16	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3437.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3522.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #18	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3433.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #19	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3439.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3538.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #20	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3430.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #21	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3477.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #22	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3484.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #23	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3406.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #24	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3473.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #25	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3393.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #26	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3378.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #27	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3490.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #28	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3389.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #29	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3403.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3531.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #30	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3389.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #31	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3491.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #32	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3402.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #33	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3413.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #34	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3402.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #35	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3433.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #36	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3529.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #37	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3539.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #38	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3482.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #39	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3525.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #4	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3464.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #40	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3447.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #41	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3457.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #42	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3531.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #43	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3432.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #44	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3446.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #45	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3435.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #46	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3539.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #47	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3454.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #48	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3463.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #49	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3458.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3521.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #50	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3472.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #51	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3474.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #52	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3392.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #53	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3407.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #54	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3399.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #55	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3424.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #56	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3451.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3527.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #7	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3445.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3516.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #9	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3429.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4125.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	4196.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	4140.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4181.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4150.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4138.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #7	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4142.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #8	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O	4118.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4272.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #10	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4304.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #11	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4287.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #12	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4287.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #13	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	4209.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #14	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4255.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #15	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4258.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #16	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4241.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4240.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #18	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	4165.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #19	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4276.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4232.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #20	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4256.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #21	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4255.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #22	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4198.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #23	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	4254.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #24	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	4257.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #25	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4191.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #26	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4261.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #27	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4159.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #28	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4171.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4253.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	4242.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)O[Si](C)(C)C(C)(C)C	4220.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4224.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #7	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4188.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	4285.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #9	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4326.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4354.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #10	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4305.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #11	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4201.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #12	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	4352.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #13	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)O[Si](C)(C)C(C)(C)C	4326.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #14	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4325.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #15	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4223.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #16	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O)O[Si](C)(C)C(C)(C)C	4320.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4320.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #18	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	4241.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #19	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4319.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4388.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #20	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)O[Si](C)(C)C(C)(C)C	4209.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #21	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4221.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #22	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4396.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #23	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4370.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #24	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4359.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #25	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4342.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #26	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	4213.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #27	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4402.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #28	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4388.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #29	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4376.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	4373.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #30	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4280.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #31	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	4377.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #32	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	4371.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #33	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4261.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #34	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4373.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #35	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4243.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #36	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4239.2	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #37	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4352.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #38	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4336.3	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #39	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4324.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)O[Si](C)(C)C(C)(C)C	4356.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #40	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4196.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #41	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	4331.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #42	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	4329.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #43	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4219.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #44	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4327.8	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #45	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4193.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #46	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4197.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #47	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[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)C1O	4351.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #48	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	4346.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #49	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4255.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4348.6	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #50	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4350.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #51	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4230.7	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #52	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4228.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #53	CC1=CC(=O)CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4339.9	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #54	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	4235.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #55	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	4232.5	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #56	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)CCC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4230.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #6	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4242.0	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #7	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4335.1	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	4333.4	Semi standard non polar	33892256
7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #9	CC1=CC(=O)CC(C)(C)C1(CCC(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)O[Si](C)(C)C(C)(C)C	4313.7	Semi standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] GC-MS (Non-derivatized) - 70eV, Positive	splash10-0zg0-7463950000-e0aaf516220cb664a55a	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] GC-MS (2 TMS) - 70eV, Positive	splash10-000t-5441219000-b1ab4b2f81c5f6a405b6	2017-10-06	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 10V, Positive-QTOF	splash10-0zor-1291360000-5948e109e9f5ce7f238b	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 20V, Positive-QTOF	splash10-0a6r-1291000000-e80b2fc717ce271638db	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 40V, Positive-QTOF	splash10-0a6r-6490000000-4ff158f9dc033e341e8f	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 10V, Negative-QTOF	splash10-0699-1492460000-a30882812eb93e3590ed	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 20V, Negative-QTOF	splash10-056r-1591110000-0c642c72f47fe36a24b1	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 40V, Negative-QTOF	splash10-0a6r-4690000000-83e928674b343fe74530	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 10V, Negative-QTOF	splash10-014i-0130090000-509dea1f2d02002e02ff	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 20V, Negative-QTOF	splash10-0wmr-4912210000-e3060a2eb6fc00e6b98c	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 40V, Negative-QTOF	splash10-0a4i-6971000000-6d1833f0a620e4c3cc52	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 10V, Positive-QTOF	splash10-0abc-0791760000-250d99c4982de3e47c30	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 20V, Positive-QTOF	splash10-0a4i-3591120000-55a784dd0f5abffc97d1	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] 40V, Positive-QTOF	splash10-052f-9462200000-111f44be2678dc33a127	2021-09-24	Wishart Lab	View Spectrum

NMR Spectra

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

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB000978

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

74929277

PDB ID

Not Available

ChEBI ID

168244

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Simons K, Toomre D: Lipid rafts and signal transduction. Nat Rev Mol Cell Biol. 2000 Oct;1(1):31-9. [PubMed:11413487 ]
Watson AD: Thematic review series: systems biology approaches to metabolic and cardiovascular disorders. Lipidomics: a global approach to lipid analysis in biological systems. J Lipid Res. 2006 Oct;47(10):2101-11. Epub 2006 Aug 10. [PubMed:16902246 ]
Sethi JK, Vidal-Puig AJ: Thematic review series: adipocyte biology. Adipose tissue function and plasticity orchestrate nutritional adaptation. J Lipid Res. 2007 Jun;48(6):1253-62. Epub 2007 Mar 20. [PubMed:17374880 ]
Lingwood D, Simons K: Lipid rafts as a membrane-organizing principle. Science. 2010 Jan 1;327(5961):46-50. doi: 10.1126/science.1174621. [PubMed:20044567 ]
(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .
Gunstone, Frank D., John L. Harwood, and Albert J. Dijkstra (2007). The lipid handbook with CD-ROM. CRC Press.

Showing metabocard for 7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside] (HMDB0029771)

MOL for HMDB0029771 (7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside])

3D MOL for HMDB0029771 (7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside])

3D SDF for HMDB0029771 (7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside])

3D-SDF for HMDB0029771 (7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside])

PDB for HMDB0029771 (7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside])

3D PDB for HMDB0029771 (7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside])

SMILES for HMDB0029771 (7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside])

INCHI for HMDB0029771 (7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside])

Structure for HMDB0029771 (7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside])

3D Structure for HMDB0029771 (7,8-Dihydrovomifoliol 9-[apiosyl-(1->6)-glucoside])

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra