LMPK12050041
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0     0  0            999 V2000
    7.6059    9.4889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6059    8.4977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4642    8.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3226    8.4977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3226    9.4889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4642    9.9843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1810    8.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0393    8.4977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0393    9.4889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1810    9.9843    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1810    7.2292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7478    9.9842    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8335    6.8973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7380    6.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6426    6.8973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6426    7.9418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7380    8.4640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8335    7.9418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5464    8.4637    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5464    6.3754    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7256   10.9704    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7257   12.9766    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4603   13.9752    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3316   11.4723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0180   13.9588    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4615   10.9683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5929   11.4697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5943   12.4753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4616   12.9745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3301   12.4730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1975   12.9723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  1 12  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
 16 19  1  0  0  0  0
 18  8  1  0  0  0  0
 15 20  1  0  0  0  0
 25 31  1  0     0  0
 30 24  1  0     0  0
 24 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  1     0  0
 27 21  1  6     0  0
 28 22  1  1     0  0
 29 23  1  6     0  0
 26  6  1  1     0  0
M  END
> <LM_ID>
LMPK12050041

> <COMMON_NAME>
Pueraria glycoside 1

> <SYSTEMATIC_NAME>
8-(beta-D-Glucopyranosyloxy)-3',4',7-trihydroxyisoflavone

> <FORMULA>
C21H20O10

> <MASS>
432.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GARZMRVWLORUSR-VPRICQMDSA-N

> <INCHI>
InChI=1S/C21H20O10/c22-6-14-17(27)18(28)19(29)21(31-14)15-12(24)4-2-9-16(26)10(7-30-20(9)15)8-1-3-11(23)13(25)5-8/h1-5,7,14,17-19,21-25,27-29H,6H2/t14-,17-,18+,19-,21+/m1/s1

> <SMILES>
C1(O)=C([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C2OC=C(C3C=CC(O)=C(O)C=3)C(=O)C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5748205

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 3892

> <CITATION>
-

$$$$