LMPK12020093
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    6.2724   10.0416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2724    9.2120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9908    8.7973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7094    9.2120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7094   10.0416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9908   10.4565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4278    8.7973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1462    9.2120    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.1462   10.0416    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.4278   10.4565    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544   10.4562    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8279    8.8185    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7860   10.4110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5127    9.9914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2394   10.4110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2394   11.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5127   11.6697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7860   11.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0374   11.5093    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9908    7.9681    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8279    7.6477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2795    7.3311    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4737    7.2748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4737    6.4638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1761    6.0582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8785    6.4638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8785    7.2748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1761    7.6804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5808    6.0584    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1761    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5127   12.5079    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5808    7.6802    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2992    7.2655    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
 26 29  1  0  0  0  0
 25 30  1  0  0  0  0
 17 31  1  0  0  0  0
 27 32  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020093

> <COMMON_NAME>
Epicatechin 3-O-(3-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>
HMDB0037945

> <YMDB_ID>
-

> <CHEBI_ID>
136553

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL63ACNS0009

> <PUBCHEM_COMPOUND_ID>
467296

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12020093

$$$$