LMPK12020097
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0  0  0  0  0  0  0  0999 V2000
    6.2715    7.3737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2715    6.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9889    6.1310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7063    6.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7063    7.3737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9889    7.7878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4236    6.1310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1412    6.5452    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.1412    7.3737    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.4236    7.7878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.7876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8218    6.1522    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7799    7.7424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5056    7.3234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2312    7.7424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2312    8.5803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5056    8.9993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7799    8.5803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0281    8.8393    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9889    5.3031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9562    7.3238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2887    6.4668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7365    5.9147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1978    6.4868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6017    5.7870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4097    5.7870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8136    6.4868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4097    7.1865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6017    7.1865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8136    7.8860    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6214    6.4868    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8136    5.0875    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
 15 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 24  1  0  0  0  0
 28 30  1  0  0  0  0
 27 31  1  0  0  0  0
 26 32  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020097

> <COMMON_NAME>
Catechin 3'-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>
FL63ACNS0013

> <PUBCHEM_COMPOUND_ID>
44257105

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12020097

$$$$