LMPK12050136
  LIPID_MAPS_STRUCTURE_DATABASE

 22 25  0     0  0            999 V2000
    7.0099    9.2477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0099    8.2853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8436    7.8039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6771    8.2853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6771    9.2477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8436    9.7290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5108    7.8039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3444    8.2853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3444    9.2477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5108    9.7289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1781    7.8039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1781    6.7747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0694    6.2600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9607    6.7747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9607    7.8039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0694    8.3183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5108    6.8412    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6434   10.6706    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6861   10.7711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2946    9.8918    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7944    6.2934    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0922    7.0426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 21 22  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
  7 17  2  0  0  0  0
  1  2  1  0  0  0  0
  6 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20  1  1  0  0  0  0
 14 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050136

> <COMMON_NAME>
Maximaisoflavone H

> <SYSTEMATIC_NAME>
4'-Methoxy-7,8-methylenedioxyisoflavone

> <FORMULA>
C17H12O5

> <MASS>
296.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ODNPGUYDUGIBPN-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H12O5/c1-19-11-4-2-10(3-5-11)13-8-20-16-12(15(13)18)6-7-14-17(16)22-9-21-14/h2-8H,9H2,1H3

> <SMILES>
C12OCOC=1C1OC=C(C3=CC=C(OC)C=C3)C(=O)C=1C=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
13873188

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 2785040

> <CITATION>
-

$$$$