LMPK12050344
  LIPID_MAPS_STRUCTURE_DATABASE

 27 29  0     0  0            999 V2000
    7.5783   12.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5783   11.3443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4240   10.8562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2696   11.3443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2696   12.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4240   12.8090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1151   10.8560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9608   11.3443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9608   12.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1152   12.8090    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8065   10.8560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8065    9.8120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7106    9.2901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6147    9.8120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6147   10.8560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7106   11.3780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1151    9.8796    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   12.8090    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4603    9.3238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7106    8.3136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5562    7.8254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5562    6.8489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4019    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7106    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4603   11.3443    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4240    9.8797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5101    9.2526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 26 27  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  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
  7 17  2  0  0  0  0
  1 18  1  0  0  0  0
 14 19  1  0  0  0  0
 13 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 15 25  1  0  0  0  0
  3 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050344

> <COMMON_NAME>
Glisoflavone

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

> <FORMULA>
C21H20O6

> <MASS>
368.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PYVPKOSKOWDDSV-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H20O6/c1-11(2)4-5-12-6-13(7-16(23)20(12)24)15-10-27-18-9-14(22)8-17(26-3)19(18)21(15)25/h4,6-10,22-24H,5H2,1-3H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5487298

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 74613

> <CITATION>
-

$$$$