LMPK12020103
  LIPID_MAPS_STRUCTURE_DATABASE

 43 47  0  0  0  0  0  0  0  0999 V2000
    8.5379    8.4908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5379    7.6858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2351    7.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9323    7.6858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9323    8.4908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2351    8.8933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6295    7.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3267    7.6858    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.3267    8.4908    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.6295    8.8933    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8327    8.8980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0320    7.2787    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0320    8.8980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7372    8.4907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4425    8.8980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4425    9.7123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7372   10.1193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0320    9.7123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2351    6.4690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5299    6.0618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5299    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8247    6.4690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8247    7.3724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0422    7.8242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2597    7.3725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2597    6.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0422    6.0172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0422    8.6385    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.7797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5545    6.0617    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1477   10.1195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7372   10.9337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8529    9.7123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5581   10.1195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8529    8.8980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2732    9.7065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9882   10.1195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9882   10.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2731   11.3581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5581   10.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2731   12.1724    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.6936   11.3524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.6936    9.7123    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
  3 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 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 22  1  0  0  0  0
 24 28  1  0  0  0  0
 25 29  1  0  0  0  0
 26 30  1  0  0  0  0
 16 31  1  0  0  0  0
 17 32  1  0  0  0  0
 31 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 35  2  0  0  0  0
 34 36  2  0  0  0  0
 36 37  1  0  0  0  0
 37 38  2  0  0  0  0
 38 39  1  0  0  0  0
 39 40  2  0  0  0  0
 40 34  1  0  0  0  0
 39 41  1  0  0  0  0
 38 42  1  0  0  0  0
 37 43  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020103

> <COMMON_NAME>
Catechin 5,4'-di-O-gallate

> <SYSTEMATIC_NAME>


> <FORMULA>
C29H22O14

> <MASS>
594.10

> <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>
FL63ACNS0019

> <PUBCHEM_COMPOUND_ID>
15689620

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12020103

$$$$