LMPK12050117
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0     0  0            999 V2000
    7.8421    9.9344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8495    9.0064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6565    8.5489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4565    9.0192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4492    9.9469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6421   10.4046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2638    8.5615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0636    9.0315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0564    9.9596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2492   10.4170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8709    8.5739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8787    7.5819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7418    7.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5970    7.5955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5892    8.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7261    9.0767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2710    7.6336    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9200    9.8292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   10.9904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4421    7.9790    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6169    7.1384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6698    7.0927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2657    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0457    8.5424    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0457    7.3507    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
 22 23  1  0  0  0  0
 24 25  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
  1 18  1  0  0  0  0
 14 20  1  0  0  0  0
 13 22  1  0  0  0  0
  2 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050117

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
6,7,3',4'-Tetramethoxyisoflavone

> <FORMULA>
C19H18O6

> <MASS>
342.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OYSKBZHHLYECLU-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H18O6/c1-21-14-6-5-11(7-16(14)22-2)13-10-25-15-9-18(24-4)17(23-3)8-12(15)19(13)20/h5-10H,1-4H3

> <SMILES>
C1(OC)=CC2OC=C(C3C=CC(OC)=C(OC)C=3)C(=O)C=2C=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
631176

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 104318

> <CITATION>
-

$$$$