LMPK12010437
  LIPID_MAPS_STRUCTURE_DATABASE

 46 51  0     0  0            999 V2000
    9.3610    9.7834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2950   10.3226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2950   11.4010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3610   11.9403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4272   11.4010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4272   10.3226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3610   13.0186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4272   13.5578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4933   13.0186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4933   11.9403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2289   11.9403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2289   13.0186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2950   13.5578    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2685   13.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1844   13.0900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1003   13.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1003   14.6764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1844   15.2051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2685   14.6764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   13.4577    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3610    8.9283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1136   11.4294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6422   14.9891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4443    8.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4443    7.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3610    6.8107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2780    7.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2780    8.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3610    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1844   15.9151    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7051   13.2696    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0598    6.8886    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8368   16.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5117   13.7352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8765    7.3603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8539   12.4178    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5803   11.4046    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5636    9.4076    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9698    9.9218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7629    8.0755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9754   10.9251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8455   11.4193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7102   10.9103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7018    9.9119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8317    9.4177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8233    8.4192    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  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  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
  3 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13  7  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 14  1  0  0  0  0
  9 20  1  0  0  0  0
  1 21  1  0  0  0  0
 11 22  1  0  0  0  0
 18 30  1  0  0  0  0
 17 23  1  0  0  0  0
 16 31  1  0  0  0  0
 21 24  2  0  0  0  0
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 25 26  2  0  0  0  0
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 27 28  2  0  0  0  0
 28 21  1  0  0  0  0
 26 29  1  0  0  0  0
 27 32  1  0  0  0  0
 30 33  1  0  0  0  0
 31 34  1  0  0  0  0
 32 35  1  0  0  0  0
 40 46  1  0     0  0
 45 39  1  0     0  0
 39 41  1  0     0  0
 41 42  1  0     0  0
 42 43  1  0     0  0
 43 44  1  0     0  0
 44 45  1  0     0  0
 45 46  1  1     0  0
 41 22  1  1     0  0
 42 36  1  6     0  0
 43 37  1  1     0  0
 44 38  1  6     0  0
M  CHG  1  13   1
M  END
> <LM_ID>
LMPK12010437

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
Malvidin 3-glucoside-4-vinylguaiacol

> <FORMULA>
C32H31O14

> <MASS>
639.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Anthocyanidins [PK1201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
HMDB0039966

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL7ARXGL0006

> <PUBCHEM_COMPOUND_ID>
44257037

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12010437

$$$$