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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 23:06:40 UTC

Update Date

2022-03-07 02:55:32 UTC

HMDB ID

HMDB0037852

Secondary Accession Numbers

HMDB37852

Metabolite Identification

Common Name

Apigenin 7-[galactosyl-(1->4)-mannoside]

Description

Apigenin 7-[galactosyl-(1->4)-mannoside] is found in root vegetables. Apigenin 7-[galactosyl-(1->4)-mannoside] is isolated from seeds of carrot (Daucus carota) Apigenin is a flavone that is the aglycone of several glycosides. It is a yellow crystalline solid that has been used to dye wool. Apigenin is a plant-derived flavonoid that has significant promise as a skin cancer chemopreventive agent. Apigenin inhibits the expression of involucrin (hINV), a marker of keratinocyte differentiation, is increased by differentiating agents via a protein kinase Cdelta (PKCdelta), Ras, MEKK1, MEK3 cascade that increases AP1 factor level and AP1 factor binding to DNA elements in the hINV promoter. Apigenin suppresses the 12-O-tetradeconylphorbol-13-acetate-dependent increase in AP1 factor expression and binding to the hINV promoter and the increase in hINV promoter activity. Apigenin also inhibits the increase in promoter activity observed following overexpression of PKCdelta, constitutively active Ras, or MEKK1. The suppression of PKCdelta activity is associated with reduced phosphorylation of PKCdelta-Y311. Activation of hINV promoter activity by the green tea polyphenol, (-)-epigellocathecin-3-gallate, is also inhibited by apigenin, suggesting that the two chemopreventive agents can produce opposing actions in keratinocytes. (PMID: 16982614 ); Apigenin, a flavone abundantly found in fruits and vegetables, exhibits antiproliferative, anti-inflammatory, and antimetastatic activities through poorly defined mechanisms. This flavonoid provides selective activity to promote caspase-dependent-apoptosis of leukemia cells and uncover an essential role of PKCdelta during the induction of apoptosis by apigenin. (PMID: 16844095 ); Apigenin markedly induces the expression of death receptor 5 (DR5) and synergistically acts with exogenous soluble recombinant human tumor necrosis factor-related apoptosis-inducing ligand (TRAIL) to induce apoptosis in malignant tumor cells. On the other hand, apigenin-mediated induction of DR5 expression is not observed in normal human peripheral blood mononuclear cells. Moreover, apigenin does not sensitize normal human peripheral blood mononuclear cells to TRAIL-induced apoptosis. (PMID: 16648565 ).

Structure

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

  Mrv0541 05061310022D          

 42 46  0  0  0  0            999 V2000
    5.0013   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.4302   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0013   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1434    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
 10  1  2  0  0  0  0
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 11  3  2  0  0  0  0
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 41 26  1  0  0  0  0
 42 25  1  0  0  0  0
 42 27  1  0  0  0  0
M  END

HMDB0037852
     RDKit          3D
Apigenin 7-[galactosyl-(1->4)-mannoside]
 72 76  0  0  0  0  0  0  0  0999 V2000
   -5.7414    0.4135    3.9084 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5924    0.2996    2.6726 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6845    0.1881    1.8248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5107    0.0641    0.4744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6473   -0.0574   -0.4654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3989   -0.1780   -1.8068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4193   -0.2960   -2.7441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7321   -0.2924   -2.3174 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7861   -0.4094   -3.2340 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9788   -0.1711   -0.9696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9482   -0.0532   -0.0360 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7873    0.2370    0.9023 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5187    0.2197    0.3501 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2352    0.0982   -0.9974 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4583    1.1650   -1.5305 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7761    1.2408   -1.2399 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5544    1.2851   -2.5562 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9159    1.3628   -2.3394 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3219    0.2386   -0.2928 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7013    0.1623   -0.4738 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4336    0.5165    0.6590 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1889    1.6299    0.4746 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5425    1.5159    0.5375 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2012    0.9307   -0.6882 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9494    1.7084   -1.8176 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9600    0.8545    1.8030 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3602    0.8211    1.8506 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3523   -0.5006    1.9394 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3125   -1.4359    1.5264 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1178   -0.7105    1.1433 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2262   -1.4501    1.9589 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7860   -1.1567   -0.4959 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7198   -1.9689   -1.1696 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4802   -1.2222   -1.2036 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5648   -1.5834   -2.5395 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9488    0.3628    2.2667 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1744    0.3887    2.8971 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2072    0.5166    4.2463 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3251    0.2827    2.1238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6555    0.2028    2.2638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3929   -0.1833   -2.1604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1578   -0.3866   -3.7739 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1679    0.4334   -3.6284 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0100   -0.1697   -0.6496 H   0  0  0  0  0  0  0  0  0  0  0  0
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    6.9050   -0.0910   -0.9230 H   0  0  0  0  0  0  0  0  0  0  0  0
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    8.7229   -0.0736    1.6411 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1991   -0.7185    3.0371 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0183   -1.8859    0.6745 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3117   -1.4120    0.2791 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4725   -1.3557    2.9160 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6788   -1.6076    0.5123 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2720   -2.4919   -0.5276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1648   -1.9955   -0.7161 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.8717    0.5634    4.9322 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
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  4  5  1  0
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  6  7  1  0
  7  8  2  0
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 37 69  1  0
 38 70  1  0
 39 71  1  0
 41 72  1  0
M  END

  Mrv0541 05061310022D          

 42 46  0  0  0  0            999 V2000
    5.0013   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7145    4.5375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1447   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    4.5375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724    3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
 10  1  2  0  0  0  0
 10  2  1  0  0  0  0
 11  3  2  0  0  0  0
 11  4  1  0  0  0  0
 12  5  2  0  0  0  0
 12  6  1  0  0  0  0
 13  5  1  0  0  0  0
 14  7  1  0  0  0  0
 15  7  2  0  0  0  0
 15 10  1  0  0  0  0
 16  6  2  0  0  0  0
 17  8  1  0  0  0  0
 18  9  1  0  0  0  0
 19 13  2  0  0  0  0
 19 14  1  0  0  0  0
 19 16  1  0  0  0  0
 20 17  1  0  0  0  0
 21 20  1  0  0  0  0
 23 21  1  0  0  0  0
 24 22  1  0  0  0  0
 25 18  1  0  0  0  0
 25 22  1  0  0  0  0
 26 24  1  0  0  0  0
 27 23  1  0  0  0  0
 28  8  1  0  0  0  0
 29  9  1  0  0  0  0
 30 11  1  0  0  0  0
 31 13  1  0  0  0  0
 32 14  2  0  0  0  0
 33 20  1  0  0  0  0
 34 21  1  0  0  0  0
 35 22  1  0  0  0  0
 36 23  1  0  0  0  0
 37 24  1  0  0  0  0
 38 12  1  0  0  0  0
 38 26  1  0  0  0  0
 39 15  1  0  0  0  0
 39 16  1  0  0  0  0
 40 17  1  0  0  0  0
 40 27  1  0  0  0  0
 41 18  1  0  0  0  0
 41 26  1  0  0  0  0
 42 25  1  0  0  0  0
 42 27  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0037852

> <DATABASE_NAME>
hmdb

> <SMILES>
OCC1OC(OC2C(O)C(O)C(OC3=CC(O)=C4C(=O)C=C(OC4=C3)C3=CC=C(O)C=C3)OC2CO)C(O)C(O)C1O

> <INCHI_IDENTIFIER>
InChI=1S/C27H30O15/c28-8-17-20(33)21(34)23(36)27(40-17)42-25-18(9-29)41-26(24(37)22(25)35)38-12-5-13(31)19-14(32)7-15(39-16(19)6-12)10-1-3-11(30)4-2-10/h1-7,17-18,20-31,33-37H,8-9H2

> <INCHI_KEY>
YONLJLRPNAUKHY-UHFFFAOYSA-N

> <FORMULA>
C27H30O15

> <MOLECULAR_WEIGHT>
594.5181

> <EXACT_MASS>
594.15847029

> <JCHEM_ACCEPTOR_COUNT>
15

> <JCHEM_AVERAGE_POLARIZABILITY>
58.10539596868989

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
7-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one

> <ALOGPS_LOGP>
-0.54

> <JCHEM_LOGP>
-1.3322146053333341

> <ALOGPS_LOGS>
-2.26

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
8.933224400441443

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.305474723176097

> <JCHEM_PKA_STRONGEST_BASIC>
-2.981386860063827

> <JCHEM_POLAR_SURFACE_AREA>
245.28999999999994

> <JCHEM_REFRACTIVITY>
137.47159999999994

> <JCHEM_ROTATABLE_BOND_COUNT>
7

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.25e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
7-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0037852
     RDKit          3D
Apigenin 7-[galactosyl-(1->4)-mannoside]
 72 76  0  0  0  0  0  0  0  0999 V2000
   -5.7414    0.4135    3.9084 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5924    0.2996    2.6726 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6845    0.1881    1.8248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5107    0.0641    0.4744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6473   -0.0574   -0.4654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3989   -0.1780   -1.8068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4193   -0.2960   -2.7441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7321   -0.2924   -2.3174 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7861   -0.4094   -3.2340 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9788   -0.1711   -0.9696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9482   -0.0532   -0.0360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2818    0.0554    0.0234 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2052    0.1545    0.7465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9374    0.1341    0.1614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7873    0.2370    0.9023 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5187    0.2197    0.3501 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2352    0.0982   -0.9974 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4583    1.1650   -1.5305 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7761    1.2408   -1.2399 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5544    1.2851   -2.5562 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9159    1.3628   -2.3394 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3219    0.2386   -0.2928 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7013    0.1623   -0.4738 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4336    0.5165    0.6590 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1889    1.6299    0.4746 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5425    1.5159    0.5375 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2012    0.9307   -0.6882 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9494    1.7084   -1.8176 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9600    0.8545    1.8030 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3602    0.8211    1.8506 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3523   -0.5006    1.9394 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3125   -1.4359    1.5264 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1178   -0.7105    1.1433 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2262   -1.4501    1.9589 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7860   -1.1567   -0.4959 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7198   -1.9689   -1.1696 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4802   -1.2222   -1.2036 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5648   -1.5834   -2.5395 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9488    0.3628    2.2667 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1744    0.3887    2.8971 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2072    0.5166    4.2463 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3251    0.2827    2.1238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6555    0.2028    2.2638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3929   -0.1833   -2.1604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1578   -0.3866   -3.7739 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1679    0.4334   -3.6284 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0100   -0.1697   -0.6496 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1982    0.0391    1.0098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9495    0.0320   -0.9044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1648    0.0180   -1.5810 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9562    2.2595   -0.7798 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3619    0.3929   -3.1825 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2667    2.1623   -3.1618 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4579    0.9227   -3.0385 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1622    0.5794    0.7572 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6656    0.7825    1.4462 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9423    2.5744    0.5978 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3121    1.0236   -0.5086 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9050   -0.0910   -0.9230 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8366    1.1501   -2.6419 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6409    1.5045    2.6571 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7229   -0.0736    1.6411 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1991   -0.7185    3.0371 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0183   -1.8859    0.6745 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3117   -1.4120    0.2791 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4725   -1.3557    2.9160 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6788   -1.6076    0.5123 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2720   -2.4919   -0.5276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1648   -1.9955   -0.7161 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2703   -1.2691   -2.9801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0418    0.4447    2.8602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8717    0.5634    4.9322 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  8 10  1  0
 10 11  2  0
  4 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 19 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 26 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 22 35  1  0
 35 36  1  0
 35 37  1  0
 37 38  1  0
 15 39  2  0
 39 40  1  0
 40 41  1  0
 40 42  2  0
 42  2  1  0
 11  5  1  0
 42 13  1  0
 37 17  1  0
 33 24  1  0
  3 43  1  0
  6 44  1  0
  7 45  1  0
  9 46  1  0
 10 47  1  0
 11 48  1  0
 14 49  1  0
 17 50  1  0
 19 51  1  0
 20 52  1  0
 20 53  1  0
 21 54  1  0
 22 55  1  0
 24 56  1  0
 26 57  1  0
 27 58  1  0
 27 59  1  0
 28 60  1  0
 29 61  1  0
 30 62  1  0
 31 63  1  0
 32 64  1  0
 33 65  1  0
 34 66  1  0
 35 67  1  0
 36 68  1  0
 37 69  1  0
 38 70  1  0
 39 71  1  0
 41 72  1  0
M  END

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0       9.336  -2.310   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      10.669   0.000   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      10.669  -3.080   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      12.003  -0.770   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       2.667   1.540   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       8.002   1.540   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -1.334   6.930   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -1.334   3.850   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       9.336  -0.770   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      12.003  -2.310   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       4.001   2.310   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       6.668   2.310   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       8.002   0.000   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -2.667   6.160   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -1.334   2.310   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       5.335   1.540   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -4.001   6.930   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -5.335   6.160   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -2.667   0.000   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -5.335   4.620   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -2.667   1.540   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       0.000   0.000   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -4.001   3.850   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0      -1.334   8.470   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0       0.000   4.620   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0      13.337  -3.080   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0       4.001   3.850   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0       6.668   3.850   0.000  0.00  0.00           O+0
HETATM   33  O   UNK     0      -4.001   8.470   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0      -6.668   6.930   0.000  0.00  0.00           O+0
HETATM   35  O   UNK     0      -4.001  -0.770   0.000  0.00  0.00           O+0
HETATM   36  O   UNK     0      -6.668   3.850   0.000  0.00  0.00           O+0
HETATM   37  O   UNK     0      -1.334  -2.310   0.000  0.00  0.00           O+0
HETATM   38  O   UNK     0       1.334  -0.770   0.000  0.00  0.00           O+0
HETATM   39  O   UNK     0       6.668  -0.770   0.000  0.00  0.00           O+0
HETATM   40  O   UNK     0      -2.667   4.620   0.000  0.00  0.00           O+0
HETATM   41  O   UNK     0       0.000   1.540   0.000  0.00  0.00           O+0
HETATM   42  O   UNK     0      -4.001   2.310   0.000  0.00  0.00           O+0
CONECT    1    3   10                                                       
CONECT    2    4   10                                                       
CONECT    3    1   11                                                       
CONECT    4    2   11                                                       
CONECT    5   12   13                                                       
CONECT    6   12   16                                                       
CONECT    7   14   15                                                       
CONECT    8   17   28                                                       
CONECT    9   18   29                                                       
CONECT   10    1    2   15                                                  
CONECT   11    3    4   30                                                  
CONECT   12    5    6   38                                                  
CONECT   13    5   19   31                                                  
CONECT   14    7   19   32                                                  
CONECT   15    7   10   39                                                  
CONECT   16    6   19   39                                                  
CONECT   17    8   20   40                                                  
CONECT   18    9   25   41                                                  
CONECT   19   13   14   16                                                  
CONECT   20   17   21   33                                                  
CONECT   21   20   23   34                                                  
CONECT   22   24   25   35                                                  
CONECT   23   21   27   36                                                  
CONECT   24   22   26   37                                                  
CONECT   25   18   22   42                                                  
CONECT   26   24   38   41                                                  
CONECT   27   23   40   42                                                  
CONECT   28    8                                                            
CONECT   29    9                                                            
CONECT   30   11                                                            
CONECT   31   13                                                            
CONECT   32   14                                                            
CONECT   33   20                                                            
CONECT   34   21                                                            
CONECT   35   22                                                            
CONECT   36   23                                                            
CONECT   37   24                                                            
CONECT   38   12   26                                                       
CONECT   39   15   16                                                       
CONECT   40   17   27                                                       
CONECT   41   18   26                                                       
CONECT   42   25   27                                                       
MASTER        0    0    0    0    0    0    0    0   42    0   92    0
END

COMPND    HMDB0037852
HETATM    1  O1  UNL     1      -5.741   0.414   3.908  1.00  0.00           O  
HETATM    2  C1  UNL     1      -5.592   0.300   2.673  1.00  0.00           C  
HETATM    3  C2  UNL     1      -6.684   0.188   1.825  1.00  0.00           C  
HETATM    4  C3  UNL     1      -6.511   0.064   0.474  1.00  0.00           C  
HETATM    5  C4  UNL     1      -7.647  -0.057  -0.465  1.00  0.00           C  
HETATM    6  C5  UNL     1      -7.399  -0.178  -1.807  1.00  0.00           C  
HETATM    7  C6  UNL     1      -8.419  -0.296  -2.744  1.00  0.00           C  
HETATM    8  C7  UNL     1      -9.732  -0.292  -2.317  1.00  0.00           C  
HETATM    9  O2  UNL     1     -10.786  -0.409  -3.234  1.00  0.00           O  
HETATM   10  C8  UNL     1      -9.979  -0.171  -0.970  1.00  0.00           C  
HETATM   11  C9  UNL     1      -8.948  -0.053  -0.036  1.00  0.00           C  
HETATM   12  O3  UNL     1      -5.282   0.055   0.023  1.00  0.00           O  
HETATM   13  C10 UNL     1      -4.205   0.155   0.747  1.00  0.00           C  
HETATM   14  C11 UNL     1      -2.937   0.134   0.161  1.00  0.00           C  
HETATM   15  C12 UNL     1      -1.787   0.237   0.902  1.00  0.00           C  
HETATM   16  O4  UNL     1      -0.519   0.220   0.350  1.00  0.00           O  
HETATM   17  C13 UNL     1      -0.235   0.098  -0.997  1.00  0.00           C  
HETATM   18  O5  UNL     1       0.458   1.165  -1.530  1.00  0.00           O  
HETATM   19  C14 UNL     1       1.776   1.241  -1.240  1.00  0.00           C  
HETATM   20  C15 UNL     1       2.554   1.285  -2.556  1.00  0.00           C  
HETATM   21  O6  UNL     1       3.916   1.363  -2.339  1.00  0.00           O  
HETATM   22  C16 UNL     1       2.322   0.239  -0.293  1.00  0.00           C  
HETATM   23  O7  UNL     1       3.701   0.162  -0.474  1.00  0.00           O  
HETATM   24  C17 UNL     1       4.434   0.517   0.659  1.00  0.00           C  
HETATM   25  O8  UNL     1       5.189   1.630   0.475  1.00  0.00           O  
HETATM   26  C18 UNL     1       6.543   1.516   0.538  1.00  0.00           C  
HETATM   27  C19 UNL     1       7.201   0.931  -0.688  1.00  0.00           C  
HETATM   28  O9  UNL     1       6.949   1.708  -1.818  1.00  0.00           O  
HETATM   29  C20 UNL     1       6.960   0.855   1.803  1.00  0.00           C  
HETATM   30  O10 UNL     1       8.360   0.821   1.851  1.00  0.00           O  
HETATM   31  C21 UNL     1       6.352  -0.501   1.939  1.00  0.00           C  
HETATM   32  O11 UNL     1       7.313  -1.436   1.526  1.00  0.00           O  
HETATM   33  C22 UNL     1       5.118  -0.711   1.143  1.00  0.00           C  
HETATM   34  O12 UNL     1       4.226  -1.450   1.959  1.00  0.00           O  
HETATM   35  C23 UNL     1       1.786  -1.157  -0.496  1.00  0.00           C  
HETATM   36  O13 UNL     1       2.720  -1.969  -1.170  1.00  0.00           O  
HETATM   37  C24 UNL     1       0.480  -1.222  -1.204  1.00  0.00           C  
HETATM   38  O14 UNL     1       0.565  -1.583  -2.539  1.00  0.00           O  
HETATM   39  C25 UNL     1      -1.949   0.363   2.267  1.00  0.00           C  
HETATM   40  C26 UNL     1      -3.174   0.389   2.897  1.00  0.00           C  
HETATM   41  O15 UNL     1      -3.207   0.517   4.246  1.00  0.00           O  
HETATM   42  C27 UNL     1      -4.325   0.283   2.124  1.00  0.00           C  
HETATM   43  H1  UNL     1      -7.656   0.203   2.264  1.00  0.00           H  
HETATM   44  H2  UNL     1      -6.393  -0.183  -2.160  1.00  0.00           H  
HETATM   45  H3  UNL     1      -8.158  -0.387  -3.774  1.00  0.00           H  
HETATM   46  H4  UNL     1     -11.168   0.433  -3.628  1.00  0.00           H  
HETATM   47  H5  UNL     1     -11.010  -0.170  -0.650  1.00  0.00           H  
HETATM   48  H6  UNL     1      -9.198   0.039   1.010  1.00  0.00           H  
HETATM   49  H7  UNL     1      -2.949   0.032  -0.904  1.00  0.00           H  
HETATM   50  H8  UNL     1      -1.165   0.018  -1.581  1.00  0.00           H  
HETATM   51  H9  UNL     1       1.956   2.259  -0.780  1.00  0.00           H  
HETATM   52  H10 UNL     1       2.362   0.393  -3.182  1.00  0.00           H  
HETATM   53  H11 UNL     1       2.267   2.162  -3.162  1.00  0.00           H  
HETATM   54  H12 UNL     1       4.458   0.923  -3.038  1.00  0.00           H  
HETATM   55  H13 UNL     1       2.162   0.579   0.757  1.00  0.00           H  
HETATM   56  H14 UNL     1       3.666   0.782   1.446  1.00  0.00           H  
HETATM   57  H15 UNL     1       6.942   2.574   0.598  1.00  0.00           H  
HETATM   58  H16 UNL     1       8.312   1.024  -0.509  1.00  0.00           H  
HETATM   59  H17 UNL     1       6.905  -0.091  -0.923  1.00  0.00           H  
HETATM   60  H18 UNL     1       6.837   1.150  -2.642  1.00  0.00           H  
HETATM   61  H19 UNL     1       6.641   1.505   2.657  1.00  0.00           H  
HETATM   62  H20 UNL     1       8.723  -0.074   1.641  1.00  0.00           H  
HETATM   63  H21 UNL     1       6.199  -0.718   3.037  1.00  0.00           H  
HETATM   64  H22 UNL     1       7.018  -1.886   0.675  1.00  0.00           H  
HETATM   65  H23 UNL     1       5.312  -1.412   0.279  1.00  0.00           H  
HETATM   66  H24 UNL     1       4.472  -1.356   2.916  1.00  0.00           H  
HETATM   67  H25 UNL     1       1.679  -1.608   0.512  1.00  0.00           H  
HETATM   68  H26 UNL     1       3.272  -2.492  -0.528  1.00  0.00           H  
HETATM   69  H27 UNL     1      -0.165  -1.995  -0.716  1.00  0.00           H  
HETATM   70  H28 UNL     1      -0.270  -1.269  -2.980  1.00  0.00           H  
HETATM   71  H29 UNL     1      -1.042   0.445   2.860  1.00  0.00           H  
HETATM   72  H30 UNL     1      -3.872   0.563   4.932  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   42
CONECT    3    4    4   43
CONECT    4    5   12
CONECT    5    6    6   11
CONECT    6    7   44
CONECT    7    8    8   45
CONECT    8    9   10
CONECT    9   46
CONECT   10   11   11   47
CONECT   11   48
CONECT   12   13
CONECT   13   14   14   42
CONECT   14   15   49
CONECT   15   16   39   39
CONECT   16   17
CONECT   17   18   37   50
CONECT   18   19
CONECT   19   20   22   51
CONECT   20   21   52   53
CONECT   21   54
CONECT   22   23   35   55
CONECT   23   24
CONECT   24   25   33   56
CONECT   25   26
CONECT   26   27   29   57
CONECT   27   28   58   59
CONECT   28   60
CONECT   29   30   31   61
CONECT   30   62
CONECT   31   32   33   63
CONECT   32   64
CONECT   33   34   65
CONECT   34   66
CONECT   35   36   37   67
CONECT   36   68
CONECT   37   38   69
CONECT   38   70
CONECT   39   40   71
CONECT   40   41   42   42
CONECT   41   72
END

HMDB0037852
     RDKit          3D
Apigenin 7-[galactosyl-(1->4)-mannoside]
 72 76  0  0  0  0  0  0  0  0999 V2000
   -5.7414    0.4135    3.9084 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5924    0.2996    2.6726 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6845    0.1881    1.8248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5107    0.0641    0.4744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6473   -0.0574   -0.4654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3989   -0.1780   -1.8068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4193   -0.2960   -2.7441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7321   -0.2924   -2.3174 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7861   -0.4094   -3.2340 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9788   -0.1711   -0.9696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9482   -0.0532   -0.0360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2818    0.0554    0.0234 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2052    0.1545    0.7465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9374    0.1341    0.1614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7873    0.2370    0.9023 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5187    0.2197    0.3501 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2352    0.0982   -0.9974 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4583    1.1650   -1.5305 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7761    1.2408   -1.2399 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5544    1.2851   -2.5562 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9159    1.3628   -2.3394 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3219    0.2386   -0.2928 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7013    0.1623   -0.4738 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4336    0.5165    0.6590 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1889    1.6299    0.4746 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5425    1.5159    0.5375 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2012    0.9307   -0.6882 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9494    1.7084   -1.8176 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9600    0.8545    1.8030 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3602    0.8211    1.8506 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3523   -0.5006    1.9394 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3125   -1.4359    1.5264 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1178   -0.7105    1.1433 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2262   -1.4501    1.9589 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7860   -1.1567   -0.4959 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7198   -1.9689   -1.1696 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4802   -1.2222   -1.2036 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5648   -1.5834   -2.5395 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9488    0.3628    2.2667 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1744    0.3887    2.8971 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2072    0.5166    4.2463 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3251    0.2827    2.1238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6555    0.2028    2.2638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3929   -0.1833   -2.1604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1578   -0.3866   -3.7739 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1679    0.4334   -3.6284 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0100   -0.1697   -0.6496 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1982    0.0391    1.0098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9495    0.0320   -0.9044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1648    0.0180   -1.5810 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9562    2.2595   -0.7798 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3619    0.3929   -3.1825 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2667    2.1623   -3.1618 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4579    0.9227   -3.0385 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1622    0.5794    0.7572 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6656    0.7825    1.4462 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9423    2.5744    0.5978 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3121    1.0236   -0.5086 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9050   -0.0910   -0.9230 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8366    1.1501   -2.6419 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6409    1.5045    2.6571 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7229   -0.0736    1.6411 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1991   -0.7185    3.0371 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0183   -1.8859    0.6745 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3117   -1.4120    0.2791 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4725   -1.3557    2.9160 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6788   -1.6076    0.5123 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2720   -2.4919   -0.5276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1648   -1.9955   -0.7161 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2703   -1.2691   -2.9801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0418    0.4447    2.8602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8717    0.5634    4.9322 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  8 10  1  0
 10 11  2  0
  4 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 19 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 26 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 22 35  1  0
 35 36  1  0
 35 37  1  0
 37 38  1  0
 15 39  2  0
 39 40  1  0
 40 41  1  0
 40 42  2  0
 42  2  1  0
 11  5  1  0
 42 13  1  0
 37 17  1  0
 33 24  1  0
  3 43  1  0
  6 44  1  0
  7 45  1  0
  9 46  1  0
 10 47  1  0
 11 48  1  0
 14 49  1  0
 17 50  1  0
 19 51  1  0
 20 52  1  0
 20 53  1  0
 21 54  1  0
 22 55  1  0
 24 56  1  0
 26 57  1  0
 27 58  1  0
 27 59  1  0
 28 60  1  0
 29 61  1  0
 30 62  1  0
 31 63  1  0
 32 64  1  0
 33 65  1  0
 34 66  1  0
 35 67  1  0
 36 68  1  0
 37 69  1  0
 38 70  1  0
 39 71  1  0
 41 72  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Not Available

Chemical Formula

C₂₇H₃₀O₁₅

Average Molecular Weight

594.5181

Monoisotopic Molecular Weight

594.15847029

IUPAC Name

7-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one

Traditional Name

7-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one

CAS Registry Number

84638-36-8

SMILES

OCC1OC(OC2C(O)C(O)C(OC3=CC(O)=C4C(=O)C=C(OC4=C3)C3=CC=C(O)C=C3)OC2CO)C(O)C(O)C1O

InChI Identifier

InChI=1S/C27H30O15/c28-8-17-20(33)21(34)23(36)27(40-17)42-25-18(9-29)41-26(24(37)22(25)35)38-12-5-13(31)19-14(32)7-15(39-16(19)6-12)10-1-3-11(30)4-2-10/h1-7,17-18,20-31,33-37H,8-9H2

InChI Key

YONLJLRPNAUKHY-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group).

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Carboxylic acid derivatives

Direct Parent

Carboxylic acid esters

Alternative Parents

Substituents

Carboxylic acid ester
Monocarboxylic acid or derivatives
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Carbonyl group
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Membrane (HMDB: HMDB0037852)
Cell membrane (HMDB: HMDB0037852)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0037852)

Source

Exogenous

Exogenous (HMDB: HMDB0037852)

Food

Food (HMDB: HMDB0037852)

Vegetable

Root vegetable

Root vegetables (FooDB: FOOD00873)

Endogenous

Plant

Plant (HMDB: HMDB0037852)

Process

Not Available

Role

Biological role

Nutrient (HMDB: HMDB0037852)

Industrial application

Manufacturing industry

Material processing agent

Coloring agent

Dye (HMDB: HMDB0037852)

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	268 - 270 °C	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	3.02	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	3.25 g/L	ALOGPS
logP	-0.54	ALOGPS
logP	-1.3	ChemAxon
logS	-2.3	ALOGPS
pKa (Strongest Acidic)	8.31	ChemAxon
pKa (Strongest Basic)	-3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	15	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	245.29 Å²	ChemAxon
Rotatable Bond Count	7	ChemAxon
Refractivity	137.47 m³·mol⁻¹	ChemAxon
Polarizability	58.11 Å³	ChemAxon
Number of Rings	5	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	226.678	30932474
DeepCCS	[M-H]-	224.282	30932474
DeepCCS	[M-2H]-	257.452	30932474
DeepCCS	[M+Na]+	232.549	30932474
AllCCS	[M+H]+	229.4	32859911
AllCCS	[M+H-H2O]+	228.1	32859911
AllCCS	[M+NH4]+	230.5	32859911
AllCCS	[M+Na]+	230.8	32859911
AllCCS	[M-H]-	223.5	32859911
AllCCS	[M+Na-2H]-	225.6	32859911
AllCCS	[M+HCOO]-	228.1	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Apigenin 7-[galactosyl-(1->4)-mannoside]	OCC1OC(OC2C(O)C(O)C(OC3=CC(O)=C4C(=O)C=C(OC4=C3)C3=CC=C(O)C=C3)OC2CO)C(O)C(O)C1O	5589.3	Standard polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside]	OCC1OC(OC2C(O)C(O)C(OC3=CC(O)=C4C(=O)C=C(OC4=C3)C3=CC=C(O)C=C3)OC2CO)C(O)C(O)C1O	5215.6	Standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside]	OCC1OC(OC2C(O)C(O)C(OC3=CC(O)=C4C(=O)C=C(OC4=C3)C3=CC=C(O)C=C3)OC2CO)C(O)C(O)C1O	5797.7	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Apigenin 7-[galactosyl-(1->4)-mannoside],1TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5531.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TMS,isomer #2	C[Si](C)(C)OC1C(O)C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C1OC1OC(CO)C(O)C(O)C1O	5561.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TMS,isomer #3	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O	5571.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TMS,isomer #4	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5530.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TMS,isomer #5	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4O)C=C3O2)C=C1	5598.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O	5531.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TMS,isomer #7	C[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)OC(CO)C(O)C1O	5566.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TMS,isomer #8	C[Si](C)(C)OC1C(O)C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C1O	5566.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TMS,isomer #9	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C1O	5572.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5446.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #10	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5439.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #11	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5491.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O	5482.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #13	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C1O	5481.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #14	C[Si](C)(C)OC1C(O)C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C1O	5466.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #15	C[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)OC(CO)C(O)C1O	5476.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #16	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5449.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #17	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5504.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O)C1O	5499.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #19	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C1O	5488.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5415.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #20	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C1O	5476.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #21	C[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)OC(CO)C(O)C1O	5486.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O	5434.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #23	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5417.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #24	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5394.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #25	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5420.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #26	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4O)C=C3O2)C=C1	5439.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O	5475.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #28	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O)C(O)C4O)C=C3O2)C=C1	5473.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #29	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O)C(O)C4O)C=C3O2)C=C1	5455.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5462.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #30	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1	5469.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5461.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #32	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5455.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #33	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5453.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #34	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C1O	5459.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #35	C[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)OC(CO)C(O)C1O[Si](C)(C)C	5477.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #36	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C1O[Si](C)(C)C	5474.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5469.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5467.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5441.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5444.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5453.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TMS,isomer #9	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O[Si](C)(C)C	5523.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5279.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5265.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5270.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5251.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5280.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5361.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5337.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5335.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5321.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5342.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	5361.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5345.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	5342.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	5331.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	5356.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5311.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	5299.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5321.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5305.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5323.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5319.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #29	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5351.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5369.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #30	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1	5400.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O	5417.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #32	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	5396.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #33	C[Si](C)(C)OC1C(O)C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	5377.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #34	C[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(O)C1O	5392.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O	5296.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #36	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5288.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #37	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5256.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #38	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5276.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #39	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5311.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5315.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #40	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O	5359.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #41	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5345.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #42	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5328.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #43	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5345.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #44	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5340.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #45	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5318.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #46	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5333.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #47	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5323.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #48	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5330.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #49	C[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)OC(CO)C(O)C1O[Si](C)(C)C	5330.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5316.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #50	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O)C1O	5351.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #51	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5322.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #52	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5294.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #53	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5315.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #54	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5341.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #55	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O)C1O	5403.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #56	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5378.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #57	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5360.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #58	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5380.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #59	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5404.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5309.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #60	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5385.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #61	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5398.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #62	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	5357.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #63	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C1O	5372.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #64	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	5372.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #65	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O	5319.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #66	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5297.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #67	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5269.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #68	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5289.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #69	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5290.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5330.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #70	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5283.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #71	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O)C(O)C4O)C=C3O2)C=C1	5308.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #72	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5288.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #73	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O)C(O)C4O)C=C3O2)C=C1	5275.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #74	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1	5297.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #75	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5349.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #76	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5333.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #77	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5348.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #78	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C5O)C(O)C4O)C=C3O2)C=C1	5344.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #79	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1	5344.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5292.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #80	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1	5348.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #81	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5340.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #82	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5333.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #83	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5341.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #84	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5358.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],3TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5293.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5173.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5177.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #100	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5157.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #101	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5177.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #102	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5252.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #103	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5216.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #104	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5243.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #105	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C5O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5212.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #106	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5212.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #107	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5211.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #108	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5220.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #109	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5217.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5211.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #110	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5217.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #111	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	5192.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #112	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5187.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #113	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5149.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #114	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5167.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #115	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5141.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #116	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5130.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #117	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5127.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #118	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5135.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #119	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C5O)C(O)C4O)C=C3O2)C=C1	5168.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	5225.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #120	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1	5161.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #121	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1	5162.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #122	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5195.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #123	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5196.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #124	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5195.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #125	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C5O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1	5200.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #126	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5182.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	5209.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	5200.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	5231.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5174.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	5160.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5194.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5167.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5178.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5180.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5182.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5177.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5152.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5154.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5141.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5172.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	5158.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	5130.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #29	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	5123.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5140.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #30	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	5162.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5118.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #32	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	5105.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #33	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5142.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #34	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5115.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5126.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #36	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5132.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #37	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	5224.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #38	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	5212.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #39	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	5189.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5124.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #40	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	5223.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #41	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5186.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #42	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	5164.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #43	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5196.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #44	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5174.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #45	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5188.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #46	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5188.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #47	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5192.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #48	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	5178.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #49	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5207.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O[Si](C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5120.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #50	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5171.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #51	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5185.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #52	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5189.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #53	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5158.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #54	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5170.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #55	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5173.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #56	C[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5180.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #57	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O	5208.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #58	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5186.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #59	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5140.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5154.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #60	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5168.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #61	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1	5216.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #62	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O	5253.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #63	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1	5244.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #64	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1	5210.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #65	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1	5240.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #66	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5246.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #67	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5216.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #68	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5231.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #69	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5204.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5241.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #70	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5202.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #71	C[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(O)C1O[Si](C)(C)C	5200.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #72	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O	5181.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #73	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5166.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #74	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5123.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #75	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5137.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #76	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5123.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #77	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5118.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #78	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5168.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #79	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5115.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5203.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #80	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5133.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #81	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5155.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #82	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5212.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #83	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5181.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #84	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5201.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #85	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C5O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5186.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #86	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5187.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #87	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C)C5O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1	5186.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #88	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5184.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #89	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5183.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5196.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #90	C[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5181.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #91	C[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5175.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #92	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O)C1O	5215.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #93	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5204.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #94	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5160.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #95	C[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C(O)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5174.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #96	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5145.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #97	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5136.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #98	C[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C)C(O)C5O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1	5196.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],4TMS,isomer #99	C[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5131.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5740.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1C(O)C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C1OC1OC(CO)C(O)C(O)C1O	5797.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O	5807.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5731.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4O)C=C3O2)C=C1	5783.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O	5737.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)OC(CO)C(O)C1O	5799.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C1O	5805.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],1TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C1O	5809.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(CO[Si](C)(C)C(C)(C)C)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5838.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5839.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O[Si](C)(C)C(C)(C)C)C4O)C=C3O2)C=C1	5889.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1OC1OC(CO)C(O)C(O)C1O	5872.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1O	5875.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C(C)(C)C)C1O	5859.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(O)C1O	5846.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5853.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4O[Si](C)(C)C(C)(C)C)C=C3O2)C=C1	5903.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1OC1OC(CO)C(O)C(O)C1O	5886.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O	5894.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O[Si](C)(C)C(C)(C)C)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5810.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C1O	5876.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C(C)(C)C)C2O)OC(CO)C(O)C1O	5866.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O	5826.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5826.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5817.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=CC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC2=C1C(=O)C=C(C1=CC=C(O)C=C1)O2	5801.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4O)C=C3O2)C=C1	5855.2	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O	5869.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C5O)C(O)C4O)C=C3O2)C=C1	5865.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C5O)C(O)C4O)C=C3O2)C=C1	5859.5	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O[Si](C)(C)C(C)(C)C)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O	5859.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=CC(=O)C3=C(O)C=C(OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O[Si](C)(C)C(C)(C)C)C(O)C4O)C=C3O2)C=C1	5839.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5854.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5841.3	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5828.4	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1O	5845.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1C(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)OC(CO)C(O)C1O[Si](C)(C)C(C)(C)C	5850.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C1O[Si](C)(C)C(C)(C)C	5855.1	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	5868.9	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5858.0	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5826.6	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5845.8	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OCC1OC(OC2C(CO)OC(OC3=CC(O)=C4C(=O)C=C(C5=CC=C(O)C=C5)OC4=C3)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5846.7	Semi standard non polar	33892256
Apigenin 7-[galactosyl-(1->4)-mannoside],2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C=C(C4=CC=C(O)C=C4)OC3=C2)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O[Si](C)(C)C(C)(C)C	5915.4	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 - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (Non-derivatized) - 70eV, Positive	splash10-01t9-3431090000-ee791b2e1a76ebd79424	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (1 TMS) - 70eV, Positive	splash10-0fdt-5237109000-0e365ea1773d94bb1320	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS ("Apigenin 7-[galactosyl-(1->4)-mannoside],1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] GC-MS (TMS_2_14) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 10V, Positive-QTOF	splash10-00di-0190660000-b2e5d36605b6788ead5a	2016-08-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 20V, Positive-QTOF	splash10-00di-0190300000-df20acb097fc7492b4ae	2016-08-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 40V, Positive-QTOF	splash10-00di-1390100000-be36fab71293491aa589	2016-08-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 10V, Negative-QTOF	splash10-016u-1380590000-8439828c43f9fc5c7382	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 20V, Negative-QTOF	splash10-014i-1390410000-8a97cc01b67c915e136d	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 40V, Negative-QTOF	splash10-014i-2490000000-0ef5ea409ebe0071b0dd	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 10V, Positive-QTOF	splash10-00dj-0090040000-808b01a776e99d1f7915	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 20V, Positive-QTOF	splash10-00f0-0090910000-e1c23fa9af533910b302	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 40V, Positive-QTOF	splash10-00di-0090000000-60b322ff74af8a765580	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 10V, Negative-QTOF	splash10-0006-0000190000-1537481d80c63cf5aec4	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 20V, Negative-QTOF	splash10-00l6-0050790000-e9df163670519de4bbe9	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Apigenin 7-[galactosyl-(1->4)-mannoside] 40V, Negative-QTOF	splash10-014i-0090010000-65d0010f671179eeb3ca	2021-09-22	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

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

FDB017005

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

73840313

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Balasubramanian S, Zhu L, Eckert RL: Apigenin inhibition of involucrin gene expression is associated with a specific reduction in phosphorylation of protein kinase Cdelta Tyr311. J Biol Chem. 2006 Nov 24;281(47):36162-72. Epub 2006 Sep 18. [PubMed:16982614 ]
Vargo MA, Voss OH, Poustka F, Cardounel AJ, Grotewold E, Doseff AI: Apigenin-induced-apoptosis is mediated by the activation of PKCdelta and caspases in leukemia cells. Biochem Pharmacol. 2006 Sep 14;72(6):681-92. Epub 2006 Jul 17. [PubMed:16844095 ]
Horinaka M, Yoshida T, Shiraishi T, Nakata S, Wakada M, Sakai T: The dietary flavonoid apigenin sensitizes malignant tumor cells to tumor necrosis factor-related apoptosis-inducing ligand. Mol Cancer Ther. 2006 Apr;5(4):945-51. [PubMed:16648565 ]
(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Showing metabocard for Apigenin 7-[galactosyl-(1->4)-mannoside] (HMDB0037852)

MOL for HMDB0037852 (Apigenin 7-[galactosyl-(1->4)-mannoside])

3D MOL for HMDB0037852 (Apigenin 7-[galactosyl-(1->4)-mannoside])

3D SDF for HMDB0037852 (Apigenin 7-[galactosyl-(1->4)-mannoside])

3D-SDF for HMDB0037852 (Apigenin 7-[galactosyl-(1->4)-mannoside])

PDB for HMDB0037852 (Apigenin 7-[galactosyl-(1->4)-mannoside])

3D PDB for HMDB0037852 (Apigenin 7-[galactosyl-(1->4)-mannoside])

SMILES for HMDB0037852 (Apigenin 7-[galactosyl-(1->4)-mannoside])

INCHI for HMDB0037852 (Apigenin 7-[galactosyl-(1->4)-mannoside])

Structure for HMDB0037852 (Apigenin 7-[galactosyl-(1->4)-mannoside])

3D Structure for HMDB0037852 (Apigenin 7-[galactosyl-(1->4)-mannoside])

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra