LMPK12050160
  LIPID_MAPS_STRUCTURE_DATABASE

 19 21  0     0  0            999 V2000
    7.5815    9.4035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5815    8.4232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4306    7.9329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2797    8.4232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2797    9.4035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4306    9.8937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1288    7.9329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9779    8.4232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9779    9.4035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1288    9.8937    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8266    7.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8266    6.8848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7345    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6424    6.8848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6424    7.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7345    8.4572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.8936    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1288    6.9478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4306    6.9529    0.0000 O   0  0  0  0  0  0  0  0  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  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 11  2  0  0  0  0
  1  2  1  0  0  0  0
  1 17  1  0  0  0  0
  7 18  2  0  0  0  0
  3 19  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050160

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,7-Dihydroxyisoflavone

> <FORMULA>
C15H10O4

> <MASS>
254.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PJJGZPJJTHBVMX-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H10O4/c16-10-6-12(17)14-13(7-10)19-8-11(15(14)18)9-4-2-1-3-5-9/h1-8,16-17H

> <SMILES>
C1(O)C=C(O)C2C(=O)C(C3=CC=CC=C3)=COC=2C=1

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0030699

> <CHEBI_ID>
174348

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5377381

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 3818

> <CITATION>
-

$$$$