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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (2) Show 2 proteins XML

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 22:40:43 UTC

Update Date

2022-03-07 02:55:19 UTC

HMDB ID

HMDB0037430

Secondary Accession Numbers

HMDB37430

Metabolite Identification

Common Name

Kaempferol 3-[apiosyl-(1->2)-galactoside]

Description

Kaempferol 3-[apiosyl-(1->2)-galactoside] belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position. Thus, kaempferol 3-[apiosyl-(1->2)-galactoside] is considered to be a flavonoid. Kaempferol 3-[apiosyl-(1->2)-galactoside] has been detected, but not quantified in, chickpeas (Cicer arietinum) and pulses. This could make kaempferol 3-[apiosyl-(1->2)-galactoside] a potential biomarker for the consumption of these foods. Based on a literature review a significant number of articles have been published on Kaempferol 3-[apiosyl-(1->2)-galactoside].

Structure

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


  Mrv0541 05061311002D          

 41 45  0  0  0  0            999 V2000
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8590   -2.5519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8945   -3.8795    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
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    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
    3.5724   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7550   -2.5519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.3070   -3.1650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6354   -2.6218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    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
    2.8579   -4.9500    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
    4.2868   -4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -2.4750    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
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 14  6  2  0  0  0  0
 15  7  1  0  0  0  0
 16 13  2  0  0  0  0
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 17 15  1  0  0  0  0
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 26  8  1  0  0  0  0
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 26 23  1  0  0  0  0
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 28  8  1  0  0  0  0
 29 11  1  0  0  0  0
 30 12  1  0  0  0  0
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 35 23  1  0  0  0  0
 36 26  1  0  0  0  0
 37  9  1  0  0  0  0
 37 25  1  0  0  0  0
 38 14  1  0  0  0  0
 38 20  1  0  0  0  0
 39 15  1  0  0  0  0
 39 24  1  0  0  0  0
 40 21  1  0  0  0  0
 40 24  1  0  0  0  0
 41 22  1  0  0  0  0
 41 25  1  0  0  0  0
M  END

HMDB0037430
     RDKit          3D
Kaempferol 3-[apiosyl-(1->2)-galactoside]
 69 73  0  0  0  0  0  0  0  0999 V2000
   -0.1091    2.0730   -0.8371 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3144    1.7623   -0.8986 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7389    0.4620   -0.4719 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7785   -0.3542   -0.0420 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0210   -0.8340    0.9355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1727   -2.2721    0.9421 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2458   -2.7594    2.1562 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0732   -4.2761    2.1432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2409   -4.6454    1.9404 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7345   -2.5251    2.4059 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5329   -3.2652    1.5671 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9922   -1.0652    2.2543 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3065   -0.3498    3.2109 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4763   -0.6840    0.8360 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9895    0.5461    0.5779 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9732    0.4049   -0.4325 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7804    1.3329   -1.4124 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9628    1.4902   -2.1078 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0814    1.1312   -1.1579 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8436    0.0770   -1.6337 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0174    2.3042   -0.9502 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9938    1.9724   -0.0400 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3363    0.7890    0.1092 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2653    1.9340    0.8961 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0625    0.1849   -0.5590 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.8265   -1.4751   -0.9035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5409   -2.5944   -0.5660 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1878   -3.3894    0.4932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9094   -4.5219    0.8335 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0817   -3.0197    1.2128 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3519   -1.8663    0.8609 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9079    1.1287   -1.0415 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5249    2.3063   -1.4304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4315    3.2491   -1.9215 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0665    4.5041   -2.3419 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0140    5.4242   -2.8306 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7370    4.8370   -2.2704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8063    3.9464   -1.7954 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4515    4.2515   -1.7096 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1984    2.6657   -1.3694 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4192   -4.6498    3.1215 H   0  0  0  0  0  0  0  0  0  0  0  0
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    6.8796    1.0835    0.3691 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8403   -0.0535    0.5882 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6687    2.5690    0.4240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1035   -0.8406   -1.7446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4123   -2.8817   -1.1345 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6994   -4.4992    1.4945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7883   -3.6327    2.0513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5443   -1.5919    1.4860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4723    2.9501   -1.9630 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1299    5.1597   -2.0053 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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 32 65  1  0
 35 66  1  0
 37 67  1  0
 38 68  1  0
 40 69  1  0
M  END


  Mrv0541 05061311002D          

 41 45  0  0  0  0            999 V2000
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.8590   -2.5519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1434   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2868   -2.4750    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  6  2  0  0  0  0
 15  7  1  0  0  0  0
 16 13  2  0  0  0  0
 16 14  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  1  0  0  0  0
 19 17  1  0  0  0  0
 20 10  1  0  0  0  0
 21 18  1  0  0  0  0
 21 20  2  0  0  0  0
 22 19  1  0  0  0  0
 24 22  1  0  0  0  0
 25 23  1  0  0  0  0
 26  8  1  0  0  0  0
 26  9  1  0  0  0  0
 26 23  1  0  0  0  0
 27  7  1  0  0  0  0
 28  8  1  0  0  0  0
 29 11  1  0  0  0  0
 30 12  1  0  0  0  0
 31 13  1  0  0  0  0
 32 17  1  0  0  0  0
 33 18  2  0  0  0  0
 34 19  1  0  0  0  0
 35 23  1  0  0  0  0
 36 26  1  0  0  0  0
 37  9  1  0  0  0  0
 37 25  1  0  0  0  0
 38 14  1  0  0  0  0
 38 20  1  0  0  0  0
 39 15  1  0  0  0  0
 39 24  1  0  0  0  0
 40 21  1  0  0  0  0
 40 24  1  0  0  0  0
 41 22  1  0  0  0  0
 41 25  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0037430

> <DATABASE_NAME>
hmdb

> <SMILES>
OCC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(OC2OCC(O)(CO)C2O)C(O)C1O

> <INCHI_IDENTIFIER>
InChI=1S/C26H28O15/c27-7-15-17(32)19(34)22(41-25-23(35)26(36,8-28)9-37-25)24(39-15)40-21-18(33)16-13(31)5-12(30)6-14(16)38-20(21)10-1-3-11(29)4-2-10/h1-6,15,17,19,22-25,27-32,34-36H,7-9H2

> <INCHI_KEY>
MNBRHJWOHPGQIW-UHFFFAOYSA-N

> <FORMULA>
C26H28O15

> <MOLECULAR_WEIGHT>
580.4915

> <EXACT_MASS>
580.142820226

> <JCHEM_ACCEPTOR_COUNT>
15

> <JCHEM_AVERAGE_POLARIZABILITY>
55.339408024877926

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

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

> <ALOGPS_LOGP>
-0.19

> <JCHEM_LOGP>
-1.117769034333333

> <ALOGPS_LOGS>
-2.38

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
8.440094159407687

> <JCHEM_PKA_STRONGEST_ACIDIC>
6.4338879644644225

> <JCHEM_PKA_STRONGEST_BASIC>
-3.1423791405643646

> <JCHEM_POLAR_SURFACE_AREA>
245.28999999999994

> <JCHEM_REFRACTIVITY>
133.96479999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
7

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.40e+00 g/l

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

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0037430
     RDKit          3D
Kaempferol 3-[apiosyl-(1->2)-galactoside]
 69 73  0  0  0  0  0  0  0  0999 V2000
   -0.1091    2.0730   -0.8371 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3144    1.7623   -0.8986 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7389    0.4620   -0.4719 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7785   -0.3542   -0.0420 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0210   -0.8340    0.9355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1727   -2.2721    0.9421 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2458   -2.7594    2.1562 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0732   -4.2761    2.1432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2409   -4.6454    1.9404 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7345   -2.5251    2.4059 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5329   -3.2652    1.5671 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9922   -1.0652    2.2543 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3065   -0.3498    3.2109 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4763   -0.6840    0.8360 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9895    0.5461    0.5779 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9732    0.4049   -0.4325 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7804    1.3329   -1.4124 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9628    1.4902   -2.1078 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0814    1.1312   -1.1579 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8436    0.0770   -1.6337 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0174    2.3042   -0.9502 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9938    1.9724   -0.0400 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3363    0.7890    0.1092 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2653    1.9340    0.8961 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0625    0.1849   -0.5590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6786   -1.0687   -0.1800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8265   -1.4751   -0.9035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5409   -2.5944   -0.5660 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1878   -3.3894    0.4932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9094   -4.5219    0.8335 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0817   -3.0197    1.2128 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3519   -1.8663    0.8609 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9079    1.1287   -1.0415 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5249    2.3063   -1.4304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4315    3.2491   -1.9215 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0665    4.5041   -2.3419 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0140    5.4242   -2.8306 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7370    4.8370   -2.2704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8063    3.9464   -1.7954 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4515    4.2515   -1.7096 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1984    2.6657   -1.3694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3388   -0.5456    1.9828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3092   -2.3776    3.0242 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4192   -4.6498    3.1215 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6957   -4.7366    1.3478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7468   -4.7329    2.7676 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9083   -2.8646    3.4611 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1592   -3.4730    0.6964 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0691   -0.8829    2.3202 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5322    0.5967    3.2449 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8919   -1.4814    0.1827 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0605   -0.6408   -0.7537 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9685    0.8596   -3.0201 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0596    2.5586   -2.3912 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6571   -0.7318   -1.1196 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4567    3.2022   -0.6094 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5099    2.5194   -1.9176 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8796    1.0835    0.3691 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8403   -0.0535    0.5882 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6687    2.5690    0.4240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1035   -0.8406   -1.7446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4123   -2.8817   -1.1345 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6994   -4.4992    1.4945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7883   -3.6327    2.0513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5443   -1.5919    1.4860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4723    2.9501   -1.9630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2732    5.4975   -3.7857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4106    5.8085   -2.5891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1299    5.1597   -2.0053 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  7 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 12 14  1  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
 19 21  1  0
 21 22  1  0
 19 23  1  0
 23 24  1  0
  3 25  2  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 29 31  1  0
 31 32  2  0
 25 33  1  0
 33 34  1  0
 34 35  2  0
 35 36  1  0
 36 37  1  0
 36 38  2  0
 38 39  1  0
 39 40  1  0
 39 41  2  0
 41  2  1  0
 14  5  1  0
 23 16  1  0
 32 26  1  0
 41 34  1  0
  5 42  1  0
  7 43  1  0
  8 44  1  0
  8 45  1  0
  9 46  1  0
 10 47  1  0
 11 48  1  0
 12 49  1  0
 13 50  1  0
 14 51  1  0
 16 52  1  0
 18 53  1  0
 18 54  1  0
 20 55  1  0
 21 56  1  0
 21 57  1  0
 22 58  1  0
 23 59  1  0
 24 60  1  0
 27 61  1  0
 28 62  1  0
 30 63  1  0
 31 64  1  0
 32 65  1  0
 35 66  1  0
 37 67  1  0
 38 68  1  0
 40 69  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       6.668  -0.770   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       5.335   1.540   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       8.002   0.000   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       6.668   2.310   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -1.334  -2.310   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       0.000   0.000   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       2.667  -7.700   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      12.803  -4.764   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      11.003  -7.242   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       8.002   1.540   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       0.000  -3.080   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       4.001  -6.930   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       5.335  -7.700   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       6.668  -6.930   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       6.668  -5.390   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      10.743  -4.764   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       5.335  -4.620   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       9.336  -5.390   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      11.773  -5.908   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       1.334  -6.930   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0      14.253  -4.894   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0       9.336   2.310   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0      -2.667   0.000   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0       0.000  -4.620   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0       5.335  -9.240   0.000  0.00  0.00           O+0
HETATM   33  O   UNK     0       2.667  -4.620   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0       8.002  -7.700   0.000  0.00  0.00           O+0
HETATM   35  O   UNK     0      11.063  -3.257   0.000  0.00  0.00           O+0
HETATM   36  O   UNK     0      13.019  -6.813   0.000  0.00  0.00           O+0
HETATM   37  O   UNK     0       9.497  -6.922   0.000  0.00  0.00           O+0
HETATM   38  O   UNK     0       2.667   0.000   0.000  0.00  0.00           O+0
HETATM   39  O   UNK     0       4.001  -5.390   0.000  0.00  0.00           O+0
HETATM   40  O   UNK     0       5.335  -3.080   0.000  0.00  0.00           O+0
HETATM   41  O   UNK     0       8.002  -4.620   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   14                                                       
CONECT    7   15   27                                                       
CONECT    8   26   28                                                       
CONECT    9   26   37                                                       
CONECT   10    1    2   20                                                  
CONECT   11    3    4   29                                                  
CONECT   12    5    6   30                                                  
CONECT   13    5   16   31                                                  
CONECT   14    6   16   38                                                  
CONECT   15    7   17   39                                                  
CONECT   16   13   14   18                                                  
CONECT   17   15   19   32                                                  
CONECT   18   16   21   33                                                  
CONECT   19   17   22   34                                                  
CONECT   20   10   21   38                                                  
CONECT   21   18   20   40                                                  
CONECT   22   19   24   41                                                  
CONECT   23   25   26   35                                                  
CONECT   24   22   39   40                                                  
CONECT   25   23   37   41                                                  
CONECT   26    8    9   23   36                                             
CONECT   27    7                                                            
CONECT   28    8                                                            
CONECT   29   11                                                            
CONECT   30   12                                                            
CONECT   31   13                                                            
CONECT   32   17                                                            
CONECT   33   18                                                            
CONECT   34   19                                                            
CONECT   35   23                                                            
CONECT   36   26                                                            
CONECT   37    9   25                                                       
CONECT   38   14   20                                                       
CONECT   39   15   24                                                       
CONECT   40   21   24                                                       
CONECT   41   22   25                                                       
MASTER        0    0    0    0    0    0    0    0   41    0   90    0
END

COMPND    HMDB0037430
HETATM    1  O1  UNL     1      -0.109   2.073  -0.837  1.00  0.00           O  
HETATM    2  C1  UNL     1      -1.314   1.762  -0.899  1.00  0.00           C  
HETATM    3  C2  UNL     1      -1.739   0.462  -0.472  1.00  0.00           C  
HETATM    4  O2  UNL     1      -0.778  -0.354  -0.042  1.00  0.00           O  
HETATM    5  C3  UNL     1      -0.021  -0.834   0.936  1.00  0.00           C  
HETATM    6  O3  UNL     1      -0.173  -2.272   0.942  1.00  0.00           O  
HETATM    7  C4  UNL     1       0.246  -2.759   2.156  1.00  0.00           C  
HETATM    8  C5  UNL     1       0.073  -4.276   2.143  1.00  0.00           C  
HETATM    9  O4  UNL     1      -1.241  -4.645   1.940  1.00  0.00           O  
HETATM   10  C6  UNL     1       1.735  -2.525   2.406  1.00  0.00           C  
HETATM   11  O5  UNL     1       2.533  -3.265   1.567  1.00  0.00           O  
HETATM   12  C7  UNL     1       1.992  -1.065   2.254  1.00  0.00           C  
HETATM   13  O6  UNL     1       1.307  -0.350   3.211  1.00  0.00           O  
HETATM   14  C8  UNL     1       1.476  -0.684   0.836  1.00  0.00           C  
HETATM   15  O7  UNL     1       1.990   0.546   0.578  1.00  0.00           O  
HETATM   16  C9  UNL     1       2.973   0.405  -0.432  1.00  0.00           C  
HETATM   17  O8  UNL     1       2.780   1.333  -1.412  1.00  0.00           O  
HETATM   18  C10 UNL     1       3.963   1.490  -2.108  1.00  0.00           C  
HETATM   19  C11 UNL     1       5.081   1.131  -1.158  1.00  0.00           C  
HETATM   20  O9  UNL     1       5.844   0.077  -1.634  1.00  0.00           O  
HETATM   21  C12 UNL     1       6.017   2.304  -0.950  1.00  0.00           C  
HETATM   22  O10 UNL     1       6.994   1.972  -0.040  1.00  0.00           O  
HETATM   23  C13 UNL     1       4.336   0.789   0.109  1.00  0.00           C  
HETATM   24  O11 UNL     1       4.265   1.934   0.896  1.00  0.00           O  
HETATM   25  C14 UNL     1      -3.063   0.185  -0.559  1.00  0.00           C  
HETATM   26  C15 UNL     1      -3.679  -1.069  -0.180  1.00  0.00           C  
HETATM   27  C16 UNL     1      -4.826  -1.475  -0.903  1.00  0.00           C  
HETATM   28  C17 UNL     1      -5.541  -2.594  -0.566  1.00  0.00           C  
HETATM   29  C18 UNL     1      -5.188  -3.389   0.493  1.00  0.00           C  
HETATM   30  O12 UNL     1      -5.909  -4.522   0.834  1.00  0.00           O  
HETATM   31  C19 UNL     1      -4.082  -3.020   1.213  1.00  0.00           C  
HETATM   32  C20 UNL     1      -3.352  -1.866   0.861  1.00  0.00           C  
HETATM   33  O13 UNL     1      -3.908   1.129  -1.042  1.00  0.00           O  
HETATM   34  C21 UNL     1      -3.525   2.306  -1.430  1.00  0.00           C  
HETATM   35  C22 UNL     1      -4.432   3.249  -1.922  1.00  0.00           C  
HETATM   36  C23 UNL     1      -4.066   4.504  -2.342  1.00  0.00           C  
HETATM   37  O14 UNL     1      -5.014   5.424  -2.831  1.00  0.00           O  
HETATM   38  C24 UNL     1      -2.737   4.837  -2.270  1.00  0.00           C  
HETATM   39  C25 UNL     1      -1.806   3.946  -1.795  1.00  0.00           C  
HETATM   40  O15 UNL     1      -0.452   4.252  -1.710  1.00  0.00           O  
HETATM   41  C26 UNL     1      -2.198   2.666  -1.369  1.00  0.00           C  
HETATM   42  H1  UNL     1      -0.339  -0.546   1.983  1.00  0.00           H  
HETATM   43  H2  UNL     1      -0.309  -2.378   3.024  1.00  0.00           H  
HETATM   44  H3  UNL     1       0.419  -4.650   3.121  1.00  0.00           H  
HETATM   45  H4  UNL     1       0.696  -4.737   1.348  1.00  0.00           H  
HETATM   46  H5  UNL     1      -1.747  -4.733   2.768  1.00  0.00           H  
HETATM   47  H6  UNL     1       1.908  -2.865   3.461  1.00  0.00           H  
HETATM   48  H7  UNL     1       2.159  -3.473   0.696  1.00  0.00           H  
HETATM   49  H8  UNL     1       3.069  -0.883   2.320  1.00  0.00           H  
HETATM   50  H9  UNL     1       1.532   0.597   3.245  1.00  0.00           H  
HETATM   51  H10 UNL     1       1.892  -1.481   0.183  1.00  0.00           H  
HETATM   52  H11 UNL     1       3.060  -0.641  -0.754  1.00  0.00           H  
HETATM   53  H12 UNL     1       3.968   0.860  -3.020  1.00  0.00           H  
HETATM   54  H13 UNL     1       4.060   2.559  -2.391  1.00  0.00           H  
HETATM   55  H14 UNL     1       5.657  -0.732  -1.120  1.00  0.00           H  
HETATM   56  H15 UNL     1       5.457   3.202  -0.609  1.00  0.00           H  
HETATM   57  H16 UNL     1       6.510   2.519  -1.918  1.00  0.00           H  
HETATM   58  H17 UNL     1       6.880   1.083   0.369  1.00  0.00           H  
HETATM   59  H18 UNL     1       4.840  -0.053   0.588  1.00  0.00           H  
HETATM   60  H19 UNL     1       3.669   2.569   0.424  1.00  0.00           H  
HETATM   61  H20 UNL     1      -5.103  -0.841  -1.745  1.00  0.00           H  
HETATM   62  H21 UNL     1      -6.412  -2.882  -1.134  1.00  0.00           H  
HETATM   63  H22 UNL     1      -6.699  -4.499   1.494  1.00  0.00           H  
HETATM   64  H23 UNL     1      -3.788  -3.633   2.051  1.00  0.00           H  
HETATM   65  H24 UNL     1      -2.544  -1.592   1.486  1.00  0.00           H  
HETATM   66  H25 UNL     1      -5.472   2.950  -1.963  1.00  0.00           H  
HETATM   67  H26 UNL     1      -5.273   5.498  -3.786  1.00  0.00           H  
HETATM   68  H27 UNL     1      -2.411   5.808  -2.589  1.00  0.00           H  
HETATM   69  H28 UNL     1      -0.130   5.160  -2.005  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   41
CONECT    3    4   25   25
CONECT    4    5
CONECT    5    6   14   42
CONECT    6    7
CONECT    7    8   10   43
CONECT    8    9   44   45
CONECT    9   46
CONECT   10   11   12   47
CONECT   11   48
CONECT   12   13   14   49
CONECT   13   50
CONECT   14   15   51
CONECT   15   16
CONECT   16   17   23   52
CONECT   17   18
CONECT   18   19   53   54
CONECT   19   20   21   23
CONECT   20   55
CONECT   21   22   56   57
CONECT   22   58
CONECT   23   24   59
CONECT   24   60
CONECT   25   26   33
CONECT   26   27   27   32
CONECT   27   28   61
CONECT   28   29   29   62
CONECT   29   30   31
CONECT   30   63
CONECT   31   32   32   64
CONECT   32   65
CONECT   33   34
CONECT   34   35   35   41
CONECT   35   36   66
CONECT   36   37   38   38
CONECT   37   67
CONECT   38   39   68
CONECT   39   40   41   41
CONECT   40   69
END

HMDB0037430
     RDKit          3D
Kaempferol 3-[apiosyl-(1->2)-galactoside]
 69 73  0  0  0  0  0  0  0  0999 V2000
   -0.1091    2.0730   -0.8371 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3144    1.7623   -0.8986 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7389    0.4620   -0.4719 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7785   -0.3542   -0.0420 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0210   -0.8340    0.9355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1727   -2.2721    0.9421 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2458   -2.7594    2.1562 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0732   -4.2761    2.1432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2409   -4.6454    1.9404 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7345   -2.5251    2.4059 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5329   -3.2652    1.5671 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9922   -1.0652    2.2543 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3065   -0.3498    3.2109 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4763   -0.6840    0.8360 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9895    0.5461    0.5779 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9732    0.4049   -0.4325 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7804    1.3329   -1.4124 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9628    1.4902   -2.1078 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0814    1.1312   -1.1579 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8436    0.0770   -1.6337 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0174    2.3042   -0.9502 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9938    1.9724   -0.0400 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3363    0.7890    0.1092 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2653    1.9340    0.8961 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0625    0.1849   -0.5590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6786   -1.0687   -0.1800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8265   -1.4751   -0.9035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5409   -2.5944   -0.5660 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1878   -3.3894    0.4932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9094   -4.5219    0.8335 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0817   -3.0197    1.2128 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3519   -1.8663    0.8609 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9079    1.1287   -1.0415 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5249    2.3063   -1.4304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4315    3.2491   -1.9215 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0665    4.5041   -2.3419 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0140    5.4242   -2.8306 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7370    4.8370   -2.2704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8063    3.9464   -1.7954 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4515    4.2515   -1.7096 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1984    2.6657   -1.3694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3388   -0.5456    1.9828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3092   -2.3776    3.0242 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4192   -4.6498    3.1215 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6957   -4.7366    1.3478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7468   -4.7329    2.7676 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9083   -2.8646    3.4611 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1592   -3.4730    0.6964 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0691   -0.8829    2.3202 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5322    0.5967    3.2449 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8919   -1.4814    0.1827 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0605   -0.6408   -0.7537 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9685    0.8596   -3.0201 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0596    2.5586   -2.3912 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6571   -0.7318   -1.1196 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4567    3.2022   -0.6094 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5099    2.5194   -1.9176 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8796    1.0835    0.3691 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8403   -0.0535    0.5882 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6687    2.5690    0.4240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1035   -0.8406   -1.7446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4123   -2.8817   -1.1345 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6994   -4.4992    1.4945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7883   -3.6327    2.0513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5443   -1.5919    1.4860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4723    2.9501   -1.9630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2732    5.4975   -3.7857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4106    5.8085   -2.5891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1299    5.1597   -2.0053 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  7 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 12 14  1  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
 19 21  1  0
 21 22  1  0
 19 23  1  0
 23 24  1  0
  3 25  2  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 29 31  1  0
 31 32  2  0
 25 33  1  0
 33 34  1  0
 34 35  2  0
 35 36  1  0
 36 37  1  0
 36 38  2  0
 38 39  1  0
 39 40  1  0
 39 41  2  0
 41  2  1  0
 14  5  1  0
 23 16  1  0
 32 26  1  0
 41 34  1  0
  5 42  1  0
  7 43  1  0
  8 44  1  0
  8 45  1  0
  9 46  1  0
 10 47  1  0
 11 48  1  0
 12 49  1  0
 13 50  1  0
 14 51  1  0
 16 52  1  0
 18 53  1  0
 18 54  1  0
 20 55  1  0
 21 56  1  0
 21 57  1  0
 22 58  1  0
 23 59  1  0
 24 60  1  0
 27 61  1  0
 28 62  1  0
 30 63  1  0
 31 64  1  0
 32 65  1  0
 35 66  1  0
 37 67  1  0
 38 68  1  0
 40 69  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
Kaempferol 3-apiosyl-(1->2)-galactoside	HMDB
Kaempferol 3-apiosyl-(1->2)-glucoside	HMDB

Chemical Formula

C₂₆H₂₈O₁₅

Average Molecular Weight

580.4915

Monoisotopic Molecular Weight

580.142820226

IUPAC Name

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

Traditional Name

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

CAS Registry Number

99816-59-8

SMILES

OCC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(OC2OCC(O)(CO)C2O)C(O)C1O

InChI Identifier

InChI=1S/C26H28O15/c27-7-15-17(32)19(34)22(41-25-23(35)26(36,8-28)9-37-25)24(39-15)40-21-18(33)16-13(31)5-12(30)6-14(16)38-20(21)10-1-3-11(29)4-2-10/h1-6,15,17,19,22-25,27-32,34-36H,7-9H2

InChI Key

MNBRHJWOHPGQIW-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Flavonoid-3-O-glycosides

Alternative Parents

Substituents

Flavonoid-3-o-glycoside
4'-hydroxyflavonoid
5-hydroxyflavonoid
7-hydroxyflavonoid
Flavone
Hydroxyflavonoid
Chromone
Disaccharide
Glycosyl compound
O-glycosyl compound
Benzopyran
1-benzopyran
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Phenol
Pyranone
Monocyclic benzene moiety
Benzenoid
Oxane
Pyran
Tertiary alcohol
Tetrahydrofuran
Vinylogous acid
Heteroaromatic compound
Secondary alcohol
Organoheterocyclic compound
Oxacycle
Acetal
Organooxygen compound
Organic oxide
Organic oxygen compound
Alcohol
Hydrocarbon derivative
Primary alcohol
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Flavones and Flavonols (LMPK12111664 )

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cytoplasm (FooDB: )
Extracellular (FooDB: )

Route of exposure

Enteral

Ingestion (FooDB: )

Source

Exogenous

Food

Food (FooDB: )

Pulse

Pea

Chickpea (FooDB: FOOD00047)

Pulses (FooDB: FOOD00867)

Endogenous

Plant

Poaceae (FooDB: )
Plant (FooDB: )

Not Available

Nutrient (FooDB: )

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	165 - 170 °C	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	2.4 g/L	ALOGPS
logP	-0.19	ALOGPS
logP	-1.1	ChemAxon
logS	-2.4	ALOGPS
pKa (Strongest Acidic)	6.43	ChemAxon
pKa (Strongest Basic)	-3.1	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	15	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	245.29 Å²	ChemAxon
Rotatable Bond Count	7	ChemAxon
Refractivity	133.96 m³·mol⁻¹	ChemAxon
Polarizability	55.34 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]+	219.487	30932474
DeepCCS	[M-H]-	217.091	30932474
DeepCCS	[M-2H]-	250.071	30932474
DeepCCS	[M+Na]+	225.399	30932474
AllCCS	[M+H]+	226.2	32859911
AllCCS	[M+H-H2O]+	224.7	32859911
AllCCS	[M+NH4]+	227.5	32859911
AllCCS	[M+Na]+	227.9	32859911
AllCCS	[M-H]-	222.7	32859911
AllCCS	[M+Na-2H]-	224.5	32859911
AllCCS	[M+HCOO]-	226.5	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Kaempferol 3-[apiosyl-(1->2)-galactoside]	OCC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(OC2OCC(O)(CO)C2O)C(O)C1O	5276.5	Standard polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside]	OCC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(OC2OCC(O)(CO)C2O)C(O)C1O	4864.0	Standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside]	OCC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(OC2OCC(O)(CO)C2O)C(O)C1O	5424.7	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	5194.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TMS,isomer #2	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5207.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1OC1OCC(O)(CO)C1O)=C(C1=CC=C(O)C=C1)O2	5201.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TMS,isomer #4	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5202.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TMS,isomer #5	C[Si](C)(C)OC1(CO)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5267.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TMS,isomer #6	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5190.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TMS,isomer #7	C[Si](C)(C)OC1C(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)OCC1(O)CO	5238.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TMS,isomer #8	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C1OC1OCC(O)(CO)C1O	5196.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TMS,isomer #9	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C1O	5181.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	5099.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #10	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5091.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #11	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5100.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #12	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5140.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #13	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5074.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	5131.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #15	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	5108.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #16	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	5100.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #17	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1OC1OCC(O)(CO)C1O)=C(C1=CC=C(O)C=C1)O2	5082.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1OC1OCC(O)(CO)C1O)=C(C1=CC=C(O)C=C1)O2	5088.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #19	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1OC1OCC(CO)(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C=C1)O2	5131.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	5108.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #20	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O	5064.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #21	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1OC1OCC(O)(CO)C1O[Si](C)(C)C)=C(C1=CC=C(O)C=C1)O2	5122.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #22	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5082.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #23	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5093.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #24	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5121.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #25	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5057.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #26	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5124.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #27	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5141.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #28	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C1O	5120.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #29	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C1OC1OCC(CO)(O[Si](C)(C)C)C1O	5130.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	5096.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #30	C[Si](C)(C)OC1C(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)OCC1(CO)O[Si](C)(C)C	5147.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #31	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	5050.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #32	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	5060.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #33	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	5106.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #34	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C1O	5111.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #35	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C1OC1OCC(O)(CO)C1O[Si](C)(C)C	5119.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #36	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C1O[Si](C)(C)C	5091.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O	5133.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O	5069.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O	5125.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O	5102.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O[Si](C)(C)C	5105.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TMS,isomer #9	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5101.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	5016.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O	4968.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O	5012.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O	5001.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O[Si](C)(C)C	5013.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O	5003.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O	4942.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O	4990.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O	4978.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O[Si](C)(C)C	4991.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C1O	5017.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	4997.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	5022.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	5017.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C	5041.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	4979.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	4954.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C	4973.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5007.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5028.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5023.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #29	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	4969.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O	5013.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #30	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	4962.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #31	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	4995.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #32	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O	4929.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #33	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	4984.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #34	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4986.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #35	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	4991.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #36	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5008.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #37	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	4949.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #38	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	4998.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #39	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4999.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O	4959.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #40	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5007.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #41	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	4944.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #42	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	4995.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #43	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4993.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #44	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5021.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #45	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	5029.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #46	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	5028.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #47	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	4962.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #48	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	4973.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #49	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	5021.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O	5010.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #50	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	4983.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #51	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	4976.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #52	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	5006.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #53	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O	4937.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #54	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	5003.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #55	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC1OCC(O)(CO)C1O)=C(C1=CC=C(O)C=C1)O2	4971.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #56	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1OC1OCC(CO)(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C=C1)O2	4987.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #57	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	4924.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #58	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1OC1OCC(O)(CO)C1O[Si](C)(C)C)=C(C1=CC=C(O)C=C1)O2	4977.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #59	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1OC1OCC(CO)(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C=C1)O2	4984.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O	4996.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #60	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	4917.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #61	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1OC1OCC(O)(CO)C1O[Si](C)(C)C)=C(C1=CC=C(O)C=C1)O2	4974.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #62	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O	4996.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #63	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1OC1OCC(CO)(O[Si](C)(C)C)C1O[Si](C)(C)C)=C(C1=CC=C(O)C=C1)O2	5006.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #64	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	4950.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #65	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	4989.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #66	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5002.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #67	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	4944.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #68	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5001.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #69	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	4999.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O[Si](C)(C)C	5004.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #70	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	4937.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #71	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	4998.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #72	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5010.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #73	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5024.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #74	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	4974.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #75	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	5001.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #76	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	5000.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #77	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	5004.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #78	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	5000.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #79	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C1O[Si](C)(C)C	5001.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	4990.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #80	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C1OC1OCC(CO)(O[Si](C)(C)C)C1O[Si](C)(C)C	5001.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #81	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	4927.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #82	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O[Si](C)(C)C	4961.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #83	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O[Si](C)(C)C	4957.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #84	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C1O[Si](C)(C)C	4987.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],3TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O	5023.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	4875.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O	4866.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #100	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	4899.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #101	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	4820.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #102	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC1OCC(CO)(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C=C1)O2	4852.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #103	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	4791.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #104	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC1OCC(O)(CO)C1O[Si](C)(C)C)=C(C1=CC=C(O)C=C1)O2	4844.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #105	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	4842.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #106	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1OC1OCC(CO)(O[Si](C)(C)C)C1O[Si](C)(C)C)=C(C1=CC=C(O)C=C1)O2	4855.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #107	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O[Si](C)(C)C	4787.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #108	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	4832.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #109	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1OC1OCC(CO)(O[Si](C)(C)C)C1O[Si](C)(C)C)=C(C1=CC=C(O)C=C1)O2	4851.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O[Si](C)(C)C	4887.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #110	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O[Si](C)(C)C	4775.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #111	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	4879.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #112	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	4885.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #113	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	4827.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #114	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	4886.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #115	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	4877.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #116	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	4893.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #117	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O[Si](C)(C)C	4835.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #118	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	4867.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #119	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(CO)(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	4889.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C1O	4920.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #120	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O[Si](C)(C)C	4822.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #121	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	4911.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #122	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	4885.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #123	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O[Si](C)(C)C	4879.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #124	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O[Si](C)(C)C	4876.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #125	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O[Si](C)(C)C	4885.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #126	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O[Si](C)(C)C	4831.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	4938.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	4904.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C	4927.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	4882.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	4855.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C	4876.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4905.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O	4918.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4930.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4928.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O	4858.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O	4809.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O	4846.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O	4841.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O[Si](C)(C)C	4862.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C1O	4924.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	4936.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #29	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	4905.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O	4869.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #30	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C	4934.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	4874.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #32	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	4852.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #33	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C	4879.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #34	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4896.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4924.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #36	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4929.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #37	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C1O	4889.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #38	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	4903.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #39	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	4867.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O	4922.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #40	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C	4898.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #41	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	4838.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #42	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	4817.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #43	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C	4846.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #44	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4861.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #45	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4890.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #46	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4896.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #47	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	4937.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #48	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	4924.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #49	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO[Si](C)(C)C)(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C	4950.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C)C1O	4899.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #50	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4928.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #51	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4952.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #52	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4958.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #53	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4869.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #54	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4899.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #55	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4889.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #56	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4941.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #57	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	4828.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #58	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	4832.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #59	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	4778.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O[Si](C)(C)C	4918.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #60	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	4806.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #61	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4841.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #62	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	4822.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #63	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	4768.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #64	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	4797.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #65	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4836.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #66	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O	4834.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #67	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	4870.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #68	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4871.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #69	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O	4808.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C)C2O)C(O)C1O	4882.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #70	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	4778.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #71	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4854.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #72	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	4888.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #73	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	4824.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #74	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	4875.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #75	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4886.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #76	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	4878.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #77	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	4892.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #78	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4893.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #79	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	4834.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C)C2O)C(O)C1O	4830.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #80	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O[Si](C)(C)C	4824.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #81	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4884.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #82	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	4868.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #83	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(CO)(O[Si](C)(C)C)C3O[Si](C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	4888.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #84	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4885.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #85	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	4827.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #86	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O[Si](C)(C)C	4810.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #87	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4876.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #88	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	4897.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #89	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	4913.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C)C(O)C1O	4886.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #90	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3O2)C=C1	4934.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #91	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O[Si](C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C	4854.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #92	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	4853.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #93	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	4859.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #94	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O[Si](C)(C)C)C2O)C1O	4800.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #95	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	4847.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #96	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(CO)(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	4852.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #97	C[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C)C1O	4792.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #98	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3OC3OCC(O)(CO)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1	4840.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],4TMS,isomer #99	C[Si](C)(C)OCC1(O[Si](C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O	4863.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	5414.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5409.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1OC1OCC(O)(CO)C1O)=C(C1=CC=C(O)C=C1)O2	5401.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5402.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1(CO)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5474.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5401.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)OCC1(O)CO	5472.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C1OC1OCC(O)(CO)C1O	5444.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],1TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C1O	5431.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	5480.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5475.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5478.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C(C)(C)C)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5496.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5460.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C(C)(C)C)=C(C3=CC=C(O)C=C3)OC2=C1	5504.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3O2)C=C1	5495.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1	5476.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1OC1OCC(O)(CO)C1O)=C(C1=CC=C(O)C=C1)O2	5461.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1OC1OCC(O)(CO)C1O)=C(C1=CC=C(O)C=C1)O2	5461.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1OC1OCC(CO)(O[Si](C)(C)C(C)(C)C)C1O)=C(C1=CC=C(O)C=C1)O2	5483.6	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	5485.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C4C3=O)OC(CO)C(O)C2O)C1O	5437.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1OC1OCC(O)(CO)C1O[Si](C)(C)C(C)(C)C)=C(C1=CC=C(O)C=C1)O2	5489.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5465.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3OC3OCC(O)(CO)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5469.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(CO)(O[Si](C)(C)C(C)(C)C)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5487.0	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5451.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1	5497.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OCC1(O[Si](C)(C)C(C)(C)C)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O	5493.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C1O	5484.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C1OC1OCC(CO)(O[Si](C)(C)C(C)(C)C)C1O	5488.9	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O	5465.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1C(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)OCC1(CO)O[Si](C)(C)C(C)(C)C	5509.8	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)C1O	5437.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)C1O	5439.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OCC1(O)COC(OC2C(OC3=C(C4=CC=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)OC(CO)C(O)C2O)C1O[Si](C)(C)C(C)(C)C	5476.2	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C1O	5488.4	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C1OC1OCC(O)(CO)C1O[Si](C)(C)C(C)(C)C	5493.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C1O[Si](C)(C)C(C)(C)C	5464.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(CO)(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O	5494.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO[Si](C)(C)C(C)(C)C)C2O)C(O)C1O	5452.7	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O[Si](C)(C)C(C)(C)C)C(O)C1O	5503.1	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O[Si](C)(C)C(C)(C)C)C1O	5488.5	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C=C3)OC3=CC(O)=CC(O)=C3C2=O)C(OC2OCC(O)(CO)C2O)C(O)C1O[Si](C)(C)C(C)(C)C	5489.3	Semi standard non polar	33892256
Kaempferol 3-[apiosyl-(1->2)-galactoside],2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)=C(C3=CC=C(O)C=C3)OC2=C1	5462.8	Semi standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (Non-derivatized) - 70eV, Positive	splash10-01vk-7320390000-5124fc6f6b1f10c10abf	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (1 TMS) - 70eV, Positive	splash10-00dr-9201005000-0a58b41c8c94d7c7f191	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS ("Kaempferol 3-[apiosyl-(1->2)-galactoside],1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 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 - Kaempferol 3-[apiosyl-(1->2)-galactoside] 10V, Positive-QTOF	splash10-0019-0290850000-b582d2b58ed4a171e483	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 20V, Positive-QTOF	splash10-000i-0190300000-1fd5ce3f66620167db53	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 40V, Positive-QTOF	splash10-000i-1590100000-ec3946e7f6730ffdc91d	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 10V, Positive-QTOF	splash10-0019-0290850000-b582d2b58ed4a171e483	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 20V, Positive-QTOF	splash10-000i-0190300000-1fd5ce3f66620167db53	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 40V, Positive-QTOF	splash10-000i-1590100000-ec3946e7f6730ffdc91d	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 10V, Negative-QTOF	splash10-004s-0451690000-e93c976a4d619b8e8a02	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 20V, Negative-QTOF	splash10-00ks-1791420000-42b32d9849f728963442	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 40V, Negative-QTOF	splash10-000i-2970000000-64cea9690b88c1d97bf7	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 10V, Negative-QTOF	splash10-004s-0451690000-e93c976a4d619b8e8a02	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 20V, Negative-QTOF	splash10-00ks-1791420000-42b32d9849f728963442	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 40V, Negative-QTOF	splash10-000i-2970000000-64cea9690b88c1d97bf7	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 10V, Negative-QTOF	splash10-004i-0000090000-f4bc41162d556bcc9cac	2021-09-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 20V, Negative-QTOF	splash10-004i-0050090000-b0eb934209dae4af96c3	2021-09-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 40V, Negative-QTOF	splash10-001i-0090000000-0be0139a76575f242d1d	2021-09-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 10V, Positive-QTOF	splash10-000i-0090020000-e2b11701562d857b4481	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 20V, Positive-QTOF	splash10-0020-0090090000-cb544898cf215edf9ac1	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-[apiosyl-(1->2)-galactoside] 40V, Positive-QTOF	splash10-000i-0090000000-03ec6f5113b2bb58d5cf	2021-09-25	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB016481

KNApSAcK ID

C00005155

Chemspider ID

4577008

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

5465153

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

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

Enzymes

Enzyme Details

1. Sulfotransferase family cytosolic 2B member 1

General function:: Involved in sulfotransferase activity
Specific function:: Sulfotransferase that utilizes 3'-phospho-5'-adenylyl sulfate (PAPS) as sulfonate donor to catalyze the sulfate conjugation of many hormones, neurotransmitters, drugs and xenobiotic compounds. Sulfonation increases the water solubility of most compounds, and therefore their renal excretion, but it can also result in bioactivation to form active metabolites. Sulfates hydroxysteroids like DHEA. Isoform 1 preferentially sulfonates cholesterol, and isoform 2 avidly sulfonates pregnenolone but not cholesterol.
Gene Name:: SULT2B1
Uniprot ID:: O00204
Molecular weight:: 39598.595

Reactions

Kaempferol 3-[apiosyl-(1->2)-galactoside] → ({5-[(2-{[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4-dihydroxyoxolan-3-yl}methoxy)sulfonic acid	details
Kaempferol 3-[apiosyl-(1->2)-galactoside] → {2-[(2-{[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-4-hydroxy-4-(hydroxymethyl)oxolan-3-yl}oxidanesulfonic acid	details

Enzyme Details

2. UDP-glucuronosyltransferase 1-1

General function:: Involved in transferase activity, transferring hexosyl groups
Specific function:: UDPGT is of major importance in the conjugation and subsequent elimination of potentially toxic xenobiotics and endogenous compounds. This isoform glucuronidates bilirubin IX-alpha to form both the IX-alpha-C8 and IX-alpha-C12 monoconjugates and diconjugate. Is also able to catalyze the glucuronidation of 17beta-estradiol, 17alpha-ethinylestradiol, 1-hydroxypyrene, 4-methylumbelliferone, 1-naphthol, paranitrophenol, scopoletin, and umbelliferone.
Gene Name:: UGT1A1
Uniprot ID:: P22309
Molecular weight:: 59590.91

Reactions

Kaempferol 3-[apiosyl-(1->2)-galactoside] → 6-(4-{3-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-5,7-dihydroxy-4-oxo-4H-chromen-2-yl}phenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid	details
Kaempferol 3-[apiosyl-(1->2)-galactoside] → 6-({3-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-7-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid	details
Kaempferol 3-[apiosyl-(1->2)-galactoside] → 6-({3-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid	details

Showing metabocard for Kaempferol 3-[apiosyl-(1->2)-galactoside] (HMDB0037430)

MOL for HMDB0037430 (Kaempferol 3-[apiosyl-(1->2)-galactoside])

3D MOL for HMDB0037430 (Kaempferol 3-[apiosyl-(1->2)-galactoside])

3D SDF for HMDB0037430 (Kaempferol 3-[apiosyl-(1->2)-galactoside])

3D-SDF for HMDB0037430 (Kaempferol 3-[apiosyl-(1->2)-galactoside])

PDB for HMDB0037430 (Kaempferol 3-[apiosyl-(1->2)-galactoside])

3D PDB for HMDB0037430 (Kaempferol 3-[apiosyl-(1->2)-galactoside])

SMILES for HMDB0037430 (Kaempferol 3-[apiosyl-(1->2)-galactoside])

INCHI for HMDB0037430 (Kaempferol 3-[apiosyl-(1->2)-galactoside])

Structure for HMDB0037430 (Kaempferol 3-[apiosyl-(1->2)-galactoside])

3D Structure for HMDB0037430 (Kaempferol 3-[apiosyl-(1->2)-galactoside])

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

Enzymes

Reactions

Reactions