LMPK12020094
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    6.2600    9.9586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2600    9.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9661    8.7358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6721    9.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6721    9.9586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9661   10.3663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3780    8.7358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0840    9.1434    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0840    9.9586    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.3780   10.3663    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544   10.3660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7539    8.7567    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7128   10.3216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4269    9.9093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1410   10.3216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1410   11.1462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4269   11.5585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7128   11.1462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9252   11.4010    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9661    7.9210    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7539    7.6061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2150    7.2950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3886    7.2397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3886    6.4427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0788    6.0442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7691    6.4427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7691    7.2397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0788    7.6382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4592    7.6381    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0788    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4269   12.3822    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9044    5.7872    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6104    6.1948    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  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  6  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
 12 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 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
 25 30  1  0  0  0  0
 17 31  1  0  0  0  0
 26 32  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020094

> <COMMON_NAME>
Epicatechin 3-O-(4-O-methylgallate)

> <SYSTEMATIC_NAME>


> <FORMULA>
C23H20O10

> <MASS>
456.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
HMDB0039328

> <YMDB_ID>
-

> <CHEBI_ID>
176148

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL63ACNS0010

> <PUBCHEM_COMPOUND_ID>
467297

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12020094

$$$$