LMPK12050138
  LIPID_MAPS_STRUCTURE_DATABASE

 28 31  0     0  0            999 V2000
    9.3908    9.0442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3908    8.0830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2233    7.6023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0559    8.0830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0559    9.0442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2233    9.5248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8884    7.6023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7207    8.0830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7207    9.0442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8882    9.5248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5533    7.6023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5533    6.5745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4435    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3333    6.5745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3333    7.6023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4435    8.1162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5582    9.5247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8884    6.6410    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3109    6.2570    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9150    7.0884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3109    7.9199    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7256    9.0442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7256    8.0829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8931    7.6022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8931    6.6408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.0829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2233   10.4860    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5193   11.2344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 27 28  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
  1 17  1  0  0  0  0
  7 18  2  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 15  1  0  0  0  0
 17 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
  6 27  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050138

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
7-Prenyloxy-8-methoxy-3',4'-methylenedioxyisoflavone

> <FORMULA>
C22H20O6

> <MASS>
380.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ALIAPFPESXJZKP-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C22H20O6/c1-13(2)8-9-25-18-7-5-15-20(23)16(11-26-21(15)22(18)24-3)14-4-6-17-19(10-14)28-12-27-17/h4-8,10-11H,9,12H2,1-3H3

> <SMILES>
C1(OC/C=C(\C)/C)C=CC2C(=O)C(C3=CC4OCOC=4C=C3)=COC=2C=1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257261

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 132433

> <CITATION>
-

$$$$