LMPK12050289
  LIPID_MAPS_STRUCTURE_DATABASE

 28 30  0     0  0            999 V2000
    7.5715   12.4732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5715   11.5041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4106   11.0197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2499   11.5041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2499   12.4732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4106   12.9576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0891   11.0197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9282   11.5041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9282   12.4732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0891   12.9576    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7671   11.0198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7671    9.9837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6644    9.4658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5616    9.9837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5616   11.0198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6644   11.5379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0891   10.0509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4106   10.0509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   12.9575    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4581    9.4661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8707    9.4661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6644    8.4308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5608    7.9132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5608    6.8782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4572    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6644    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4581   11.5373    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2973   11.0527    0.0000 C   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
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 14 20  1  0  0  0  0
 12 21  1  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 15 27  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050289

> <COMMON_NAME>
Piscerythrone

> <SYSTEMATIC_NAME>
5,7,2',4'-Tetrahydroxy-5'-methoxy-3'-prenylisoflavone

> <FORMULA>
C21H20O7

> <MASS>
384.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
LNKQZQNXQQZHHW-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H20O7/c1-10(2)4-5-12-19(24)13(8-17(27-3)20(12)25)14-9-28-16-7-11(22)6-15(23)18(16)21(14)26/h4,6-9,22-25H,5H2,1-3H3

> <SMILES>
C1(O)=CC2OC=C(C3C=C(OC)C(O)=C(C/C=C(\C)/C)C=3O)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12314353

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 62113

> <CITATION>
-

$$$$