LMPK12050005
  LIPID_MAPS_STRUCTURE_DATABASE

 30 33  0     0  0            999 V2000
    5.9841   10.0620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9841   11.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8434   11.5504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7026   11.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7026   10.0620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8434    9.5661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5618   11.5504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4209   11.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4209   10.0620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5618    9.5661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5618   12.3239    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1251    9.5664    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2799   11.5502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2799   12.6106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1982   13.1410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1166   12.6106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1166   11.5502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1982   11.0200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0345   13.1406    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9887    8.7921    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8147    6.8029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4480    5.6623    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5291    8.0684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9940    5.5435    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7101    8.6437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8054    8.2218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7195    7.2246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5361    6.6545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4408    7.0763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2575    6.5060    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
  8 13  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
 24 30  1  0     0  0
 29 23  1  0     0  0
 23 25  1  0     0  0
 25 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  6     0  0
 26 20  1  1     0  0
 27 21  1  6     0  0
 28 22  1  1     0  0
 25  6  1  6     0  0
M  END
> <LM_ID>
LMPK12050005

> <COMMON_NAME>
Puerarin

> <SYSTEMATIC_NAME>
8-beta-D-glucopyranosyl-7-hydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

> <FORMULA>
C21H20O9

> <MASS>
416.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Kakonein

> <KEGG_ID>
C10524

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
8633

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FLIA1ACS0001

> <PUBCHEM_COMPOUND_ID>
5281807

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMPK12050005

$$$$