LMPK12020095
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0  0  0  0  0  0  0  0999 V2000
    8.3454    8.5778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3454    7.7453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0664    7.3289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7874    7.7453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7874    8.5778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0664    8.9941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5086    7.3290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2296    7.7453    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.2296    8.5778    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.5084    8.9941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6244    8.9941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9506    7.3290    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9506    8.9941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6799    8.5730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4092    8.9941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4092    9.8361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6799   10.2572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9506    9.8361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1302   10.2524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0664    6.4963    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6799   11.0898    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3454    6.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6244    6.4963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6245    7.2752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9500    7.6647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2754    7.2752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2754    6.4963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9500    6.1068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9500    8.4972    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.6914    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    6.0800    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3454    5.2475    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
 17 21  1  0  0  0  0
 20 22  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
 25 29  1  0  0  0  0
 26 30  1  0  0  0  0
 27 31  1  0  0  0  0
 22 32  2  0  0  0  0
M  END
> <LM_ID>
LMPK12020095

> <COMMON_NAME>
Catechin 5-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>
FL63ACNS0011

> <PUBCHEM_COMPOUND_ID>
15689618

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12020095

$$$$