LMPK12010031
  LIPID_MAPS_STRUCTURE_DATABASE

 42 46  0     0  0            999 V2000
    7.6189   12.3076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6189   11.2838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5056   10.7719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3923   11.2838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3923   12.3076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5056   12.8194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2790   10.7719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1656   11.2838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1656   12.3076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2790   12.8194    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0519   12.8193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9554   12.2975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8592   12.8193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8592   13.8628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9554   14.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0519   13.8628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   12.8193    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7625   14.3843    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5056    9.7483    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8288   10.1352    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3790    7.3545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9075    6.5378    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1551    7.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6484    6.6044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7048    6.6044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1776    5.7855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1234    5.7855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5961    6.6044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1234    7.4233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1776    7.4233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5406    6.6044    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1261   11.6592    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0948   11.2976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7622    9.4154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1489    9.0114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4653    7.8897    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8111    9.9561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4597   10.7181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4463   10.5355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7799    9.5945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1313    8.8325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4649    7.8914    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
  1 17  1  0  0  0  0
 14 18  1  0  0  0  0
  3 19  1  0  0  0  0
 20  8  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 25  1  0  0  0  0
 28 31  1  0  0  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 20  1  1     0  0
 38 32  1  6     0  0
 39 33  1  1     0  0
 40 34  1  6     0  0
 36 21  1  0  0  0  0
M  CHG  1  10   1
M  END
> <LM_ID>
LMPK12010031

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
Pelargonidin 3-p-coumarylglucoside

> <FORMULA>
C30H27O12

> <MASS>
579.15

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Anthocyanidins [PK1201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
C16368

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
80475

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL7AAAGL0017

> <PUBCHEM_COMPOUND_ID>
23724733

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMPK12010031

$$$$