LMPK12020002
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0     0  0            999 V2000
    7.4595    8.8315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4595    7.7610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3867    7.2258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3138    7.7610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3138    8.8315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3867    9.3669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2410    7.2258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1680    7.7610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1680    8.8315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2410    9.3669    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0882   10.3950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0882    9.3646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9807    8.8495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8731    9.3646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8731   10.3950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9807   10.9103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.2513    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3867    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6194   10.8259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9807   11.7121    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0089    7.2160    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6262    8.9298    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
  5  6  2  0     0  0
  6  1  1  0     0  0
  4  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  5  1  0     0  0
 11 12  1  0     0  0
 12 13  2  0     0  0
 13 14  1  0     0  0
 14 15  2  0     0  0
 15 16  1  0     0  0
 16 11  2  0     0  0
  9 12  1  6     0  0
  1 17  1  0     0  0
  3 18  1  0     0  0
 15 19  1  0     0  0
 16 20  1  0     0  0
  8 21  1  1     0  0
 14 22  1  0     0  0
M  END
> <LM_ID>
LMPK12020002

> <COMMON_NAME>
(+)-Gallocatechin

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H14O7

> <MASS>
306.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XMOCLSLCDHWDHP-SWLSCSKDSA-N

> <INCHI>
InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15+/m0/s1

> <SMILES>
C1(O)C=C2O[C@H](C3=CC(O)=C(O)C(O)=C3)[C@@H](O)CC2=C(O)C=1

> <KEGG_ID>
C12127

> <HMDB_ID>
HMDB0038365

> <CHEBI_ID>
31018

> <ABBREVIATION>
-

> <CAYMAN_ID>
25125

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
65084

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$