LMPK12050159
  LIPID_MAPS_STRUCTURE_DATABASE

 21 23  0     0  0            999 V2000
    7.1157    9.0398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1157    8.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9369    7.6177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7582    8.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7582    9.0398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9369    9.5140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5792    7.6177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4005    8.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4005    9.0398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5792    9.5140    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2217    7.6177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2217    6.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0996    6.0969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9777    6.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9777    7.6177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0996    8.1246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5792    6.6693    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9369    6.6693    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9915    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945    9.5140    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945   10.9901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  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 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050159

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,7-Dimethoxyisoflavone

> <FORMULA>
C17H14O4

> <MASS>
282.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
CDSSYLTXYXEANW-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O4/c1-19-12-8-14(20-2)16-15(9-12)21-10-13(17(16)18)11-6-4-3-5-7-11/h3-10H,1-2H3

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0030698

> <CHEBI_ID>
174686

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6710704

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 3818

> <CITATION>
-

$$$$