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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 17:32:33 UTC

Update Date

2022-03-07 02:52:17 UTC

HMDB ID

HMDB0029773

Secondary Accession Numbers

HMDB29773

Metabolite Identification

Common Name

6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside]

Description

6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 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 significant number of articles have been published on 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside].

Structure

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


  Mrv0541 02241208532D          

 36 38  0  0  0  0            999 V2000
   -4.9736   -1.2389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9736   -2.0635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8324   -2.4758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 32 33  1  0  0  0  0
 35 36  1  0  0  0  0
M  END

HMDB0029773
     RDKit          3D
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside]
 74 76  0  0  0  0  0  0  0  0999 V2000
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M  END


  Mrv0541 02241208532D          

 36 38  0  0  0  0            999 V2000
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 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>
HMDB0029773

> <DATABASE_NAME>
hmdb

> <SMILES>
CC(OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)\C=C\C1(O)C(C)=CC(=O)CC1(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C24H38O12/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/h5-7,13,15-21,25,27-32H,8-11H2,1-4H3/b6-5+

> <INCHI_KEY>
WGPMCTNBJPAHNW-AATRIKPKSA-N

> <FORMULA>
C24H38O12

> <MOLECULAR_WEIGHT>
518.5513

> <EXACT_MASS>
518.23632668

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_AVERAGE_POLARIZABILITY>
53.383705971983375

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

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

> <ALOGPS_LOGP>
-0.90

> <JCHEM_LOGP>
-1.6283356706666672

> <ALOGPS_LOGS>
-2.39

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.292561435344112

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.69637302065727

> <JCHEM_PKA_STRONGEST_BASIC>
-3.1423790163389214

> <JCHEM_POLAR_SURFACE_AREA>
195.6

> <JCHEM_REFRACTIVITY>
124.01069999999994

> <JCHEM_ROTATABLE_BOND_COUNT>
8

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.10e+00 g/l

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

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0029773
     RDKit          3D
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside]
 74 76  0  0  0  0  0  0  0  0999 V2000
   -5.8448    0.4136    2.6875 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3100    0.5254    1.2549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4314    1.1613    0.9955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8729    1.2642   -0.3844 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5083    2.2779   -0.7738 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5267    0.1187   -1.2644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0307   -0.0491   -1.1764 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4250    1.0832   -2.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7036   -1.3221   -1.9491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4915   -0.0716    0.2038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1214   -1.3843    0.5374 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1923    0.7047    0.1956 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1207    0.0972   -0.2417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8272    0.8254   -0.2655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0441    2.3249   -0.1722 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9653    0.3944    0.7340 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1824   -0.0882    0.1776 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3153    0.5358    0.6950 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4418    0.3159   -0.1336 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5131    1.1726    0.4479 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7166    1.2949   -0.0944 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5947    0.3123   -0.1429 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1354    0.1127   -1.4263 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2636   -0.6639   -1.2746 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7798   -0.4564    0.1271 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4886   -1.5525    0.9157 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2535   -0.1217    0.1642 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5825    0.1557    1.4778 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9296    0.7090    0.5905 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7286    0.7386    1.9482 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7620   -1.0986   -0.2868 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4611   -1.3176   -1.4716 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5325   -2.0044   -0.4032 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9154   -3.3212   -0.1489 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4046   -1.5795    0.4794 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7199   -2.3107    0.1566 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7608    0.2955    2.7488 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3452   -0.4952    3.0876 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1790    1.2765    3.2685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0233    1.6074    1.7910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8038    0.3101   -2.3202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0063   -0.7886   -0.8752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1244    1.9365   -1.3857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5070    0.7294   -2.5384 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1355    1.4000   -2.7854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6937   -1.3103   -2.3806 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4053   -1.3455   -2.8216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8580   -2.1931   -1.3114 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7300   -1.7526    1.2127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1537    1.7378    0.5435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1646   -0.9101   -0.5795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3593    0.6531   -1.2536 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8224    2.5791   -0.9122 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2976    2.6530    0.8546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1177    2.8593   -0.4637 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1375   -0.0113   -0.9193 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1497    0.7951   -1.1142 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5903    0.8252    1.5616 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0625    2.2295    0.6631 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3716   -0.6539    0.2820 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1522   -1.7112   -1.5555 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0410   -0.2254   -1.9668 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1515   -1.7292    1.6206 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7949   -1.0041   -0.2125 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4390    0.7696   -0.4519 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4519    1.1349    1.6163 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2517    1.6533    0.1413 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6290    1.7058    2.2080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3460   -1.5396    0.5387 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8924   -1.2537   -2.2759 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1695   -1.9774   -1.4522 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7316   -3.4663   -0.7244 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6707   -1.6793    1.5659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4106   -2.3012    0.8480 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  2  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
 13 51  1  0
 14 52  1  0
 15 53  1  0
 15 54  1  0
 15 55  1  0
 17 56  1  0
 19 57  1  0
 20 58  1  0
 20 59  1  0
 22 60  1  0
 24 61  1  0
 24 62  1  0
 26 63  1  0
 27 64  1  0
 27 65  1  0
 28 66  1  0
 29 67  1  0
 30 68  1  0
 31 69  1  0
 32 70  1  0
 33 71  1  0
 34 72  1  0
 35 73  1  0
 36 74  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      -9.284  -2.313   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -9.284  -3.852   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0     -10.618  -4.621   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0      -7.953  -4.621   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -6.621  -3.852   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -5.287  -4.621   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -8.940  -0.363   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -7.953  -1.543   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -6.960  -0.363   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -6.621  -2.313   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -5.287  -1.543   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -3.958  -2.313   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -2.627  -1.543   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -1.295  -2.313   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      -2.627  -0.006   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0      -5.287  -3.082   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0      -1.295   0.763   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0       0.038  -0.006   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0       1.378   0.763   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       1.378   2.305   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       0.038   3.082   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -1.295   2.305   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      -2.627   3.082   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0       0.038   4.621   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0       2.712   3.082   0.000  0.00  0.00           O+0
HETATM   26  C   UNK     0       2.712  -0.006   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       4.043   0.763   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0       5.467  -0.389   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0       5.990  -1.838   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       7.527  -1.787   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       7.955  -0.304   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       6.680   0.561   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0       6.624   2.100   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0       9.402   0.222   0.000  0.00  0.00           O+0
HETATM   35  C   UNK     0       9.274  -1.096   0.000  0.00  0.00           C+0
HETATM   36  O   UNK     0      10.618  -0.350   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    HMDB0029773
HETATM    1  C1  UNL     1      -5.845   0.414   2.688  1.00  0.00           C  
HETATM    2  C2  UNL     1      -6.310   0.525   1.255  1.00  0.00           C  
HETATM    3  C3  UNL     1      -7.431   1.161   0.996  1.00  0.00           C  
HETATM    4  C4  UNL     1      -7.873   1.264  -0.384  1.00  0.00           C  
HETATM    5  O1  UNL     1      -8.508   2.278  -0.774  1.00  0.00           O  
HETATM    6  C5  UNL     1      -7.527   0.119  -1.264  1.00  0.00           C  
HETATM    7  C6  UNL     1      -6.031  -0.049  -1.176  1.00  0.00           C  
HETATM    8  C7  UNL     1      -5.425   1.083  -2.012  1.00  0.00           C  
HETATM    9  C8  UNL     1      -5.704  -1.322  -1.949  1.00  0.00           C  
HETATM   10  C9  UNL     1      -5.492  -0.072   0.204  1.00  0.00           C  
HETATM   11  O2  UNL     1      -5.121  -1.384   0.537  1.00  0.00           O  
HETATM   12  C10 UNL     1      -4.192   0.705   0.196  1.00  0.00           C  
HETATM   13  C11 UNL     1      -3.121   0.097  -0.242  1.00  0.00           C  
HETATM   14  C12 UNL     1      -1.827   0.825  -0.265  1.00  0.00           C  
HETATM   15  C13 UNL     1      -2.044   2.325  -0.172  1.00  0.00           C  
HETATM   16  O3  UNL     1      -0.965   0.394   0.734  1.00  0.00           O  
HETATM   17  C14 UNL     1       0.182  -0.088   0.178  1.00  0.00           C  
HETATM   18  O4  UNL     1       1.315   0.536   0.695  1.00  0.00           O  
HETATM   19  C15 UNL     1       2.442   0.316  -0.134  1.00  0.00           C  
HETATM   20  C16 UNL     1       3.513   1.173   0.448  1.00  0.00           C  
HETATM   21  O5  UNL     1       4.717   1.295  -0.094  1.00  0.00           O  
HETATM   22  C17 UNL     1       5.595   0.312  -0.143  1.00  0.00           C  
HETATM   23  O6  UNL     1       6.135   0.113  -1.426  1.00  0.00           O  
HETATM   24  C18 UNL     1       7.264  -0.664  -1.275  1.00  0.00           C  
HETATM   25  C19 UNL     1       7.780  -0.456   0.127  1.00  0.00           C  
HETATM   26  O7  UNL     1       7.489  -1.552   0.916  1.00  0.00           O  
HETATM   27  C20 UNL     1       9.253  -0.122   0.164  1.00  0.00           C  
HETATM   28  O8  UNL     1       9.582   0.156   1.478  1.00  0.00           O  
HETATM   29  C21 UNL     1       6.930   0.709   0.591  1.00  0.00           C  
HETATM   30  O9  UNL     1       6.729   0.739   1.948  1.00  0.00           O  
HETATM   31  C22 UNL     1       2.762  -1.099  -0.287  1.00  0.00           C  
HETATM   32  O10 UNL     1       3.461  -1.318  -1.472  1.00  0.00           O  
HETATM   33  C23 UNL     1       1.533  -2.004  -0.403  1.00  0.00           C  
HETATM   34  O11 UNL     1       1.915  -3.321  -0.149  1.00  0.00           O  
HETATM   35  C24 UNL     1       0.405  -1.580   0.479  1.00  0.00           C  
HETATM   36  O12 UNL     1      -0.720  -2.311   0.157  1.00  0.00           O  
HETATM   37  H1  UNL     1      -4.761   0.296   2.749  1.00  0.00           H  
HETATM   38  H2  UNL     1      -6.345  -0.495   3.088  1.00  0.00           H  
HETATM   39  H3  UNL     1      -6.179   1.277   3.269  1.00  0.00           H  
HETATM   40  H4  UNL     1      -8.023   1.607   1.791  1.00  0.00           H  
HETATM   41  H5  UNL     1      -7.804   0.310  -2.320  1.00  0.00           H  
HETATM   42  H6  UNL     1      -8.006  -0.789  -0.875  1.00  0.00           H  
HETATM   43  H7  UNL     1      -5.124   1.937  -1.386  1.00  0.00           H  
HETATM   44  H8  UNL     1      -4.507   0.729  -2.538  1.00  0.00           H  
HETATM   45  H9  UNL     1      -6.136   1.400  -2.785  1.00  0.00           H  
HETATM   46  H10 UNL     1      -4.694  -1.310  -2.381  1.00  0.00           H  
HETATM   47  H11 UNL     1      -6.405  -1.345  -2.822  1.00  0.00           H  
HETATM   48  H12 UNL     1      -5.858  -2.193  -1.311  1.00  0.00           H  
HETATM   49  H13 UNL     1      -5.730  -1.753   1.213  1.00  0.00           H  
HETATM   50  H14 UNL     1      -4.154   1.738   0.544  1.00  0.00           H  
HETATM   51  H15 UNL     1      -3.165  -0.910  -0.579  1.00  0.00           H  
HETATM   52  H16 UNL     1      -1.359   0.653  -1.254  1.00  0.00           H  
HETATM   53  H17 UNL     1      -2.822   2.579  -0.912  1.00  0.00           H  
HETATM   54  H18 UNL     1      -2.298   2.653   0.855  1.00  0.00           H  
HETATM   55  H19 UNL     1      -1.118   2.859  -0.464  1.00  0.00           H  
HETATM   56  H20 UNL     1       0.138  -0.011  -0.919  1.00  0.00           H  
HETATM   57  H21 UNL     1       2.150   0.795  -1.114  1.00  0.00           H  
HETATM   58  H22 UNL     1       3.590   0.825   1.562  1.00  0.00           H  
HETATM   59  H23 UNL     1       3.062   2.230   0.663  1.00  0.00           H  
HETATM   60  H24 UNL     1       5.372  -0.654   0.282  1.00  0.00           H  
HETATM   61  H25 UNL     1       7.152  -1.711  -1.555  1.00  0.00           H  
HETATM   62  H26 UNL     1       8.041  -0.225  -1.967  1.00  0.00           H  
HETATM   63  H27 UNL     1       8.152  -1.729   1.621  1.00  0.00           H  
HETATM   64  H28 UNL     1       9.795  -1.004  -0.212  1.00  0.00           H  
HETATM   65  H29 UNL     1       9.439   0.770  -0.452  1.00  0.00           H  
HETATM   66  H30 UNL     1       9.452   1.135   1.616  1.00  0.00           H  
HETATM   67  H31 UNL     1       7.252   1.653   0.141  1.00  0.00           H  
HETATM   68  H32 UNL     1       6.629   1.706   2.208  1.00  0.00           H  
HETATM   69  H33 UNL     1       3.346  -1.540   0.539  1.00  0.00           H  
HETATM   70  H34 UNL     1       2.892  -1.254  -2.276  1.00  0.00           H  
HETATM   71  H35 UNL     1       1.170  -1.977  -1.452  1.00  0.00           H  
HETATM   72  H36 UNL     1       2.732  -3.466  -0.724  1.00  0.00           H  
HETATM   73  H37 UNL     1       0.671  -1.679   1.566  1.00  0.00           H  
HETATM   74  H38 UNL     1      -1.411  -2.301   0.848  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   13   50
CONECT   13   14   51
CONECT   14   15   16   52
CONECT   15   53   54   55
CONECT   16   17
CONECT   17   18   35   56
CONECT   18   19
CONECT   19   20   31   57
CONECT   20   21   58   59
CONECT   21   22
CONECT   22   23   29   60
CONECT   23   24
CONECT   24   25   61   62
CONECT   25   26   27   29
CONECT   26   63
CONECT   27   28   64   65
CONECT   28   66
CONECT   29   30   67
CONECT   30   68
CONECT   31   32   33   69
CONECT   32   70
CONECT   33   34   35   71
CONECT   34   72
CONECT   35   36   73
CONECT   36   74
END

HMDB0029773
     RDKit          3D
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside]
 74 76  0  0  0  0  0  0  0  0999 V2000
   -5.8448    0.4136    2.6875 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3100    0.5254    1.2549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4314    1.1613    0.9955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8729    1.2642   -0.3844 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5083    2.2779   -0.7738 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5267    0.1187   -1.2644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0307   -0.0491   -1.1764 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4250    1.0832   -2.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7036   -1.3221   -1.9491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4915   -0.0716    0.2038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1214   -1.3843    0.5374 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1923    0.7047    0.1956 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1207    0.0972   -0.2417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8272    0.8254   -0.2655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0441    2.3249   -0.1722 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9653    0.3944    0.7340 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1824   -0.0882    0.1776 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3153    0.5358    0.6950 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4418    0.3159   -0.1336 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5131    1.1726    0.4479 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7166    1.2949   -0.0944 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5947    0.3123   -0.1429 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1354    0.1127   -1.4263 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2636   -0.6639   -1.2746 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7798   -0.4564    0.1271 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4886   -1.5525    0.9157 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2535   -0.1217    0.1642 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5825    0.1557    1.4778 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9296    0.7090    0.5905 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7286    0.7386    1.9482 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7620   -1.0986   -0.2868 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4611   -1.3176   -1.4716 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5325   -2.0044   -0.4032 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9154   -3.3212   -0.1489 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4046   -1.5795    0.4794 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7199   -2.3107    0.1566 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7608    0.2955    2.7488 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3452   -0.4952    3.0876 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1790    1.2765    3.2685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0233    1.6074    1.7910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8038    0.3101   -2.3202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0063   -0.7886   -0.8752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1244    1.9365   -1.3857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5070    0.7294   -2.5384 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1355    1.4000   -2.7854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6937   -1.3103   -2.3806 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4053   -1.3455   -2.8216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8580   -2.1931   -1.3114 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7300   -1.7526    1.2127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1537    1.7378    0.5435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1646   -0.9101   -0.5795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3593    0.6531   -1.2536 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8224    2.5791   -0.9122 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2976    2.6530    0.8546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1177    2.8593   -0.4637 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1375   -0.0113   -0.9193 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1497    0.7951   -1.1142 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5903    0.8252    1.5616 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0625    2.2295    0.6631 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3716   -0.6539    0.2820 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1522   -1.7112   -1.5555 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0410   -0.2254   -1.9668 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1515   -1.7292    1.6206 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7949   -1.0041   -0.2125 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4390    0.7696   -0.4519 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4519    1.1349    1.6163 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2517    1.6533    0.1413 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6290    1.7058    2.2080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3460   -1.5396    0.5387 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8924   -1.2537   -2.2759 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1695   -1.9774   -1.4522 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7316   -3.4663   -0.7244 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6707   -1.6793    1.5659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4106   -2.3012    0.8480 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  2  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
 13 51  1  0
 14 52  1  0
 15 53  1  0
 15 54  1  0
 15 55  1  0
 17 56  1  0
 19 57  1  0
 20 58  1  0
 20 59  1  0
 22 60  1  0
 24 61  1  0
 24 62  1  0
 26 63  1  0
 27 64  1  0
 27 65  1  0
 28 66  1  0
 29 67  1  0
 30 68  1  0
 31 69  1  0
 32 70  1  0
 33 71  1  0
 34 72  1  0
 35 73  1  0
 36 74  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Not Available

Chemical Formula

C₂₄H₃₈O₁₂

Average Molecular Weight

518.5513

Monoisotopic Molecular Weight

518.23632668

IUPAC Name

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

Traditional Name

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

CAS Registry Number

Not Available

SMILES

CC(OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)\C=C\C1(O)C(C)=CC(=O)CC1(C)C

InChI Identifier

InChI=1S/C24H38O12/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/h5-7,13,15-21,25,27-32H,8-11H2,1-4H3/b6-5+

InChI Key

WGPMCTNBJPAHNW-AATRIKPKSA-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
Cyclofarsesane sesquiterpenoid
Megastigmane sesquiterpenoid
Sesquiterpenoid
Ionone derivative
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

Loquat (FooDB: FOOD00076)

Fruits (FooDB: FOOD00871)

Process

Not Available

Role

Not Available

Physical Properties

State

Not Available

Experimental Molecular Properties

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

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	2.1 g/L	ALOGPS
logP	-0.9	ALOGPS
logP	-1.6	ChemAxon
logS	-2.4	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	8	ChemAxon
Refractivity	124.01 m³·mol⁻¹	ChemAxon
Polarizability	53.38 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]+	217.755	31661259
DarkChem	[M-H]-	209.882	31661259
DeepCCS	[M+H]+	217.501	30932474
DeepCCS	[M-H]-	215.105	30932474
DeepCCS	[M-2H]-	247.989	30932474
DeepCCS	[M+Na]+	223.413	30932474
AllCCS	[M+H]+	221.6	32859911
AllCCS	[M+H-H2O]+	220.1	32859911
AllCCS	[M+NH4]+	223.0	32859911
AllCCS	[M+Na]+	223.4	32859911
AllCCS	[M-H]-	216.4	32859911
AllCCS	[M+Na-2H]-	218.3	32859911
AllCCS	[M+HCOO]-	220.6	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside]	CC(OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)\C=C\C1(O)C(C)=CC(=O)CC1(C)C	4278.1	Standard polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside]	CC(OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)\C=C\C1(O)C(C)=CC(=O)CC1(C)C	3625.9	Standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside]	CC(OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)\C=C\C1(O)C(C)=CC(=O)CC1(C)C	3944.4	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O	3916.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O	3857.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O	3880.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O	3852.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O	3837.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C	3836.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #7	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3899.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TMS,isomer #8	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O	3830.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3845.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #10	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3763.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #11	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3736.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #12	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3749.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #13	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O	3695.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #14	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3821.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #15	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3783.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #16	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3757.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3767.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #18	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O	3735.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #19	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3810.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O	3785.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #20	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3755.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #21	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3760.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #22	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O	3730.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #23	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3783.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #24	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3766.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #25	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O	3685.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #26	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3796.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #27	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C	3718.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #28	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3772.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3828.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3815.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3791.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3806.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #7	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O	3755.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3797.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TMS,isomer #9	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3771.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3722.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #10	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3676.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #11	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O	3616.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #12	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3722.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #13	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3680.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #14	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3703.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #15	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3666.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #16	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3689.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3695.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #18	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3654.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #19	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3691.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3758.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #20	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3611.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #21	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3642.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #22	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3697.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #23	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3693.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #24	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3658.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #25	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3665.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #26	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3622.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #27	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3659.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #28	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3621.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #29	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3635.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3755.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #30	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3581.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #31	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3621.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #32	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3637.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #33	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3589.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #34	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3624.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #35	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3546.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #36	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3574.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #37	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3720.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #38	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3680.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #39	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3693.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3724.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #40	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3661.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #41	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3647.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #42	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3655.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #43	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3627.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #44	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3650.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #45	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3579.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #46	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3605.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #47	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3683.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #48	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3696.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #49	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3670.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3729.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #50	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3679.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #51	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3602.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #52	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3619.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #53	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3685.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #54	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3621.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #55	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3606.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #56	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3648.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #6	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3678.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #7	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3714.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3694.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TMS,isomer #9	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3659.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3642.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #10	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3630.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #11	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3635.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #12	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3581.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #13	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3623.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #14	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3552.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #15	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3558.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #16	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3622.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3583.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #18	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3596.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #19	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	3542.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3635.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #20	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3577.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #21	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3583.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #22	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	3517.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #23	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3575.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #24	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	3480.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #25	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	3498.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #26	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3597.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #27	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3601.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #28	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3561.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #29	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3594.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3609.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #30	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3515.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #31	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3541.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #32	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3600.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #33	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3515.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #34	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3521.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #35	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3514.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #36	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3594.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #37	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3563.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #38	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3565.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #39	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3505.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3610.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #40	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3561.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #41	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3575.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #42	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3520.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #43	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3563.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #44	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3492.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #45	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3497.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #46	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3527.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #47	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3536.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #48	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3480.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #49	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3528.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #5	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C(O)C1O)O[Si](C)(C)C	3534.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #50	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3437.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #51	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3461.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #52	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3542.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #53	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3453.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #54	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3466.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #55	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3458.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #56	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3576.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #57	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3589.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #58	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3551.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #59	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3576.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3663.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #60	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3510.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #61	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3527.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #62	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3558.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #63	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3484.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #64	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3497.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #65	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3487.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #66	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3591.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #67	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)O[Si](C)(C)C	3522.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #68	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)O[Si](C)(C)C	3541.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #69	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3522.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #7	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3627.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #70	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)O[Si](C)(C)C	3526.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3636.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],4TMS,isomer #9	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O)O[Si](C)(C)C	3588.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3544.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #10	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3418.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #11	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3522.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #12	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3528.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #13	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3490.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #14	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3517.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #15	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3458.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #16	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3466.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3515.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #18	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3444.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #19	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3455.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3521.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #20	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3445.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #21	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3495.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #22	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3508.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #23	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3453.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #24	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3495.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #25	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3414.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #26	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3433.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #27	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3490.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #28	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3393.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #29	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3410.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3513.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #30	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3400.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #31	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3503.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #32	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3431.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #33	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3444.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #34	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3436.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #35	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3432.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #36	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3458.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #37	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3472.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #38	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3416.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #39	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3460.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #4	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3473.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #40	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3398.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #41	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3390.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #42	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3467.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #43	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3396.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #44	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3412.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #45	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3399.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #46	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	3439.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #47	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3358.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #48	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3375.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #49	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3364.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3502.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #50	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3382.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #51	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3475.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #52	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3413.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #53	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3431.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #54	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3418.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #55	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	3406.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #56	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3440.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3515.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #7	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3443.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	3502.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],5TMS,isomer #9	CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1(/C=C/C(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	3429.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	4122.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	4067.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4097.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4075.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4060.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4061.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #7	CC1=CC(=O)CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4118.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],1TBDMS,isomer #8	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O	4046.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4270.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #10	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4188.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #11	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4168.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #12	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4169.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #13	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	4101.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #14	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4248.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #15	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4207.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #16	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4182.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4184.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #18	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4138.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #19	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4236.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4207.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #20	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4184.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #21	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4187.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #22	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4132.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #23	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4217.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #24	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4187.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #25	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4098.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #26	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4217.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #27	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4115.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #28	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(/C=C/C(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4195.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4252.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4233.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4215.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #6	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4210.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #7	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(C)OC1OC(COC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	4147.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4226.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],2TBDMS,isomer #9	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4190.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #1	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4325.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #10	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4273.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #11	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4132.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #12	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4339.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #13	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4322.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #14	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4314.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #15	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4211.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #16	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4310.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #17	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4305.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #18	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4186.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #19	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4307.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #2	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4379.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #20	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4173.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #21	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4167.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #22	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4312.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #23	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4320.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #24	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4311.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #25	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4295.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #26	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(/C=C/C(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	4205.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #27	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4280.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #28	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4266.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #29	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4257.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #3	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4366.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #30	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4124.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #31	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4270.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #32	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4271.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #33	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4147.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #34	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4267.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #35	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4126.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #36	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4125.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #37	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4337.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #38	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4318.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #39	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4313.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #4	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4360.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #40	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(/C=C/C(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	4232.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #41	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4286.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #42	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4282.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #43	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4185.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #44	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4286.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #45	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4161.9	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #46	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4162.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #47	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4315.2	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #48	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4315.4	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #49	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(/C=C/C(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	4257.1	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #5	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4343.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #50	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4288.0	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #51	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4183.7	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #52	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4178.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #53	CC1=CC(=O)CC(C)(C)C1(/C=C/C(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	4313.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #54	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(/C=C/C(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	4228.6	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #55	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(O)/C=C/C(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	4179.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #56	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(/C=C/C(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	4236.5	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #6	CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1(/C=C/C(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	4242.3	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #7	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4321.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #8	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4294.8	Semi standard non polar	33892256
6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside],3TBDMS,isomer #9	CC1=CC(=O)CC(C)(C)C1(O)/C=C/C(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	4282.8	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 - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] GC-MS (Non-derivatized) - 70eV, Positive	splash10-0udi-7592860000-d392b5e06307a150365a	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] GC-MS (2 TMS) - 70eV, Positive	splash10-0592-9240007000-d9282fa7ac50eb7b2fa3	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 - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 10V, Positive-QTOF	splash10-0kxr-1191150000-d6ecf1ec16dbaf49ba62	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 20V, Positive-QTOF	splash10-0a6r-2391000000-4d1fe1632b5946caa429	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 40V, Positive-QTOF	splash10-0a6r-6690000000-aa30fab3ffefdc2337cd	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 10V, Negative-QTOF	splash10-01bj-0692540000-5fa7d3f657d27f809fa7	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 20V, Negative-QTOF	splash10-00di-0691200000-99442a6cb501682da69a	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 40V, Negative-QTOF	splash10-05fr-4890000000-f6e5ca40860e935b6ced	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 10V, Positive-QTOF	splash10-0pbi-0974460000-0d31362add27692bcd5a	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 20V, Positive-QTOF	splash10-0aor-1693110000-039309a98922cb613266	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 40V, Positive-QTOF	splash10-052f-9362000000-89ceaa3cc4fbf7bc8780	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 10V, Negative-QTOF	splash10-014i-0110390000-d812abb514925595ae82	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 20V, Negative-QTOF	splash10-0g4i-5913300000-0c6fe6d1e07644569a6a	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] 40V, Negative-QTOF	splash10-0pbc-7960000000-e2df906c346320f0f087	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)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-30	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Extracellular
Membrane

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

FDB000980

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

131750896

PDB ID

Not Available

ChEBI ID

168009

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 6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside] (HMDB0029773)

MOL for HMDB0029773 (6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside])

3D MOL for HMDB0029773 (6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside])

3D SDF for HMDB0029773 (6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside])

3D-SDF for HMDB0029773 (6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside])

PDB for HMDB0029773 (6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside])

3D PDB for HMDB0029773 (6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside])

SMILES for HMDB0029773 (6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside])

INCHI for HMDB0029773 (6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside])

Structure for HMDB0029773 (6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside])

3D Structure for HMDB0029773 (6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside])

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra