LMPK12020098
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0  0  0  0  0  0  0  0999 V2000
    6.2660    7.3025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2660    6.4803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9780    6.0692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6901    6.4803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6901    7.3025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9780    7.7136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4021    6.0692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1141    6.4803    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.1141    7.3025    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.4021    7.7136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.7133    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7897    6.0902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7482    7.6685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4684    7.2527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1885    7.6685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1885    8.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4684    8.9160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7482    8.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9795    8.9753    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9780    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7562    7.5735    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7562    8.4478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6584    8.4675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0592    7.7731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8611    7.7731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2620    8.4675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8611    9.1620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0592    9.1620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2620    9.8563    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0638    8.4675    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2620    7.0788    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4684    9.7468    0.0000 O   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  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
  8 12  1  1  0  0  0
  9 13  1  6  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
 19 16  1  0  0  0  0
  3 20  1  0  0  0  0
 22 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 23  1  0  0  0  0
 27 29  1  0  0  0  0
 26 30  1  0  0  0  0
 25 31  1  0  0  0  0
 19 22  1  0  0  0  0
 22 21  2  0  0  0  0
 17 32  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020098

> <COMMON_NAME>
Catechin 4'-O-gallate

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H18O10

> <MASS>
442.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavans, Flavanols and Leucoanthocyanidins [PK1202]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL63ACNS0014

> <PUBCHEM_COMPOUND_ID>
44257106

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMPK12020098

$$$$