LMPK12050386
  LIPID_MAPS_STRUCTURE_DATABASE

 21 23  0     0  0            999 V2000
    7.5808    9.4005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5808    8.4211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4291    7.9312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2773    8.4211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2773    9.4005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4291    9.8903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1257    7.9312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9739    8.4211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9739    9.4005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1257    9.8903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8218    7.9315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8218    6.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7288    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6357    6.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6357    7.9315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7288    8.4551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1257    6.9522    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.8903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4291    6.9522    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5418    6.3611    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7329    7.9315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  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 11  1  0  0  0  0
  7 17  2  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 14 20  1  0  0  0  0
  2 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050386

> <COMMON_NAME>
6-Hydroxygenistein

> <SYSTEMATIC_NAME>
5,6,7,4'-Tetrahydroxyisoflavone

> <FORMULA>
C15H10O6

> <MASS>
286.05

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HDXSEWOOSVMREY-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)9-6-21-11-5-10(17)14(19)15(20)12(11)13(9)18/h1-6,16-17,19-20H

> <SMILES>
C1(O)=CC2OC=C(C3C=CC(O)=CC=3)C(=O)C=2C(O)=C1O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0041688

> <CHEBI_ID>
174718

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6063386

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 49796

> <CITATION>
-

$$$$