LMPK12050045
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0     0  0            999 V2000
   10.6195    9.9936    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5363    9.4642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4531    9.9936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3696    9.4644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3696    8.3669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3200    7.8182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2706    8.3669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2706    9.4644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3200   10.0131    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5366    8.4062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4531    7.8770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3200    6.7214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2203    7.8184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2203    6.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1290    6.2447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0376    6.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0376    7.8184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1290    8.3431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9464    8.3431    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.7341    6.3672    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.4359    6.7725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6054    7.9923    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8648    7.0038    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1437    8.0166    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8859   10.0059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3904    9.3762    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7519    9.4994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7448    8.4987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8717    8.0044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0113    8.5109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0184    9.5115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1579   10.0180    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  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  4  1  0  0  0  0
  2 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11  5  1  0  0  0  0
  6 12  2  0  0  0  0
  7 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
 17 19  1  0  0  0  0
 16 20  1  0  0  0  0
 20 21  1  0  0  0  0
 26 32  1  0     0  0
 31 25  1  0     0  0
 25 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  0     0  0
 31 32  1  1     0  0
 27  1  1  1     0  0
 28 22  1  6     0  0
 29 23  1  1     0  0
 30 24  1  6     0  0
M  END
> <LM_ID>
LMPK12050045

> <COMMON_NAME>
Calycosin 7-O-glucoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H22O10

> <MASS>
446.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
86512

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FLIA1CGS0003

> <PUBCHEM_COMPOUND_ID>
5318267

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12050045

$$$$