LMPK12050049
  LIPID_MAPS_STRUCTURE_DATABASE

 26 29  0     0  0            999 V2000
   10.2238   10.5436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2238    9.5620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0740    9.0711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9242    9.5620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9242   10.5436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0740   11.0345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7742    9.0711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6244    9.5620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6244   10.5436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7742   11.0345    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4742    9.0713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4742    8.0218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3832    7.4969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2922    8.0218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2922    9.0713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3832    9.5961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7742    8.0898    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3728   10.9849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6015    6.4703    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.6452    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0721    7.3194    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5656   10.4687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7149   10.9098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9093   10.3947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   10.8348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9526    9.4397    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
  1 18  1  0  0  0  0
 13 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 14  1  0  0  0  0
 18 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
M  END
> <LM_ID>
LMPK12050049

> <COMMON_NAME>
Maximaisoflavone B

> <SYSTEMATIC_NAME>
3',4'-Methylenedioxy-7-prenyloxyisoflavone

> <FORMULA>
C21H18O5

> <MASS>
350.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FNMKZDDKPDBYJM-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H18O5/c1-13(2)7-8-23-15-4-5-16-19(10-15)24-11-17(21(16)22)14-3-6-18-20(9-14)26-12-25-18/h3-7,9-11H,8,12H2,1-2H3

> <SMILES>
C1(OC/C=C(\C)/C)=CC2OC=C(C3C=CC4OCOC=4C=3)C(=O)C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257236

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 2785040

> <CITATION>
-

$$$$