LMPK12010015
  LIPID_MAPS_STRUCTURE_DATABASE

 42 46  0     0  0            999 V2000
   10.9430   10.1759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9430    9.2690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7286    8.8154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5139    9.2690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5139   10.1759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7286   10.6297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2995    8.8154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0850    9.2690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0850   10.1759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2995   10.6297    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8700   10.6293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6659   10.1697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4618   10.6293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4618   11.5484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6659   12.0077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8700   11.5484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7305    8.3308    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1580   10.6293    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7286    7.9090    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2561   12.0068    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5400    5.9165    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7199    5.0835    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0936    6.2425    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026    8.0723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4617    7.6625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8212    7.4922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7269    6.4960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8140    6.0797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0011    6.6592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0953    7.6554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2822    8.2350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3618    7.1712    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1731    5.1785    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3563    4.3496    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7261    6.9177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8105    4.5123    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6377    7.3366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4533    6.7568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3575    5.7581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4491    5.3438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6335    5.9235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7250    5.5091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  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
  8 17  1  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 14 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
 26 19  1  1     0  0
 27 21  1  6     0  0
 28 22  1  1     0  0
 29 23  1  6     0  0
 36 42  1  0     0  0
 41 35  1  0     0  0
 35 37  1  0     0  0
 37 38  1  0     0  0
 38 39  1  0     0  0
 39 40  1  0     0  0
 40 41  1  0     0  0
 41 42  1  1     0  0
 37 17  1  1     0  0
 38 32  1  6     0  0
 39 33  1  1     0  0
 40 34  1  6     0  0
M  CHG  1  10   1
M  END
> <LM_ID>
LMPK12010015

> <COMMON_NAME>
Pelargonin

> <SYSTEMATIC_NAME>


> <FORMULA>
C27H31O15

> <MASS>
595.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Anthocyanidins [PK1201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
C08725

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
133365

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL7AAAGL0001

> <PUBCHEM_COMPOUND_ID>
441772

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12010015

$$$$