LMPK12010016
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0     0  0            999 V2000
    7.5626   12.3803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5719   11.4271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4023   10.9586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2229   11.4434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2135   12.3966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3835   12.8651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0533   10.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8740   11.4597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8647   12.4130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0345   12.8814    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6852   12.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5313   12.4202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3679   12.9140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3583   13.8856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5121   14.3630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6756   13.8690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1947   14.3795    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327   12.8486    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4117   10.0059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7449   10.9683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3762    9.8087    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1875    7.8159    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3707    6.9871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7405    9.5552    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8249    7.1498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6521    9.9741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4677    9.3943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3719    8.3956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4635    7.9813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6479    8.5610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7394    8.1466    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  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 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 11  1  0  0  0  0
 14 17  1  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
  8 20  1  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
 26 20  1  1     0  0
 27 21  1  6     0  0
 28 22  1  1     0  0
 29 23  1  6     0  0
M  CHG  1  10   1
M  END
> <LM_ID>
LMPK12010016

> <COMMON_NAME>
Callistephin

> <SYSTEMATIC_NAME>


> <FORMULA>
C21H21O10

> <MASS>
433.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Anthocyanidins [PK1201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Pelargonidin 3-O-glucoside

> <KEGG_ID>
C12137

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
31967

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL7AAAGL0002

> <PUBCHEM_COMPOUND_ID>
443648

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMPK12010016

$$$$