LMPK12070083
  LIPID_MAPS_STRUCTURE_DATABASE

 24 28  0  0  0  0  0  0  0  0999 V2000
    8.9455   -6.1849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9455   -7.0957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7343   -7.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5231   -7.0957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5231   -6.1849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7343   -5.7295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3118   -7.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1005   -7.0957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1005   -6.1849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3118   -5.7295    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8890   -7.5508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8890   -8.5247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7324   -9.0114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5756   -8.5247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5756   -7.5508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7324   -7.0641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3118   -8.5244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5017   -8.8256    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0742   -8.0378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5017   -7.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1023   -5.6980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7343   -4.7558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1024   -4.6980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6004   -4.2558    0.0000 C   0  0  0  0  0  0  0  0  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  1  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  1  0  0  0  0
  1  2  1  0  0  0  0
 12 17  1  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 15  1  0  0  0  0
  1 21  1  0  0  0  0
  6 22  1  0  0  0  0
 21 23  1  0     0  0
 22 24  1  0     0  0
M  END
> <LM_ID>
LMPK12070083

> <COMMON_NAME>
4-Methoxypterocarpin

> <SYSTEMATIC_NAME>
3,4-Dimethoxy-8,9-methylenedioxypterocarpan

> <FORMULA>
C18H16O6

> <MASS>
328.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Pterocarpans [PK1207]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FNOOADLKGGWRGC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H16O6/c1-19-12-4-3-9-16-11(7-21-17(9)18(12)20-2)10-5-14-15(23-8-22-14)6-13(10)24-16/h3-6,11,16H,7-8H2,1-2H3

> <SMILES>
C1(OC)C=CC2C3OC4=CC5OCOC=5C=C4C3COC=2C=1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
630068

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 149635

> <CITATION>
-

$$$$