LMPK12070065
  LIPID_MAPS_STRUCTURE_DATABASE

 25 29  0  0  0  0            999 V2000
    9.1531   -6.1543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1531   -7.0937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9665   -7.5633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7801   -7.0937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7801   -6.1543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9665   -5.6846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5935   -7.5633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4071   -7.0937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4071   -6.1543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5935   -5.6846    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2203   -7.5632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2203   -8.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0901   -9.0697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9598   -8.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9598   -7.5632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0901   -7.0610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5935   -8.5673    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2836   -7.5955    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9150   -8.8778    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.5054   -8.0654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9150   -7.2529    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2836   -5.6523    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4042   -6.1600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1157   -7.9660    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9389   -6.6612    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  1  2  0     0  0
  4  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  5  1  0     0  0
  8 11  1  0     0  0
 11 12  1  0     0  0
 12 13  2  0     0  0
 13 14  1  0     0  0
 14 15  2  0     0  0
 15 16  1  0     0  0
 16 11  2  0     0  0
  7 17  1  0     0  0
  1  2  1  0     0  0
 12 17  1  0     0  0
  2 18  1  0     0  0
 14 19  1  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 21 15  1  0     0  0
  1 22  1  0     0  0
 22 23  1  0     0  0
  7 24  1  6     0  0
  8 25  1  6     0  0
M  END
> <LM_ID>
LMPK12070065

> <COMMON_NAME>
2-Hydroxyhomopterocarpin

> <SYSTEMATIC_NAME>
6aR,11aR-2-hydroxy-3-methoxy-8,9-methylenedioxypterocarpan

> <FORMULA>
C17H14O6

> <MASS>
314.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Pterocarpans [PK1207]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GDUBLLYLIZLLNX-BTDLBPIBSA-N

> <INCHI>
InChI=1S/C17H14O6/c1-19-14-4-12-9(2-11(14)18)17-10(6-20-12)8-3-15-16(22-7-21-15)5-13(8)23-17/h2-5,10,17-18H,6-7H2,1H3/t10-,17-/m0/s1

> <SMILES>
C1(OC)C(O)=CC2[C@]3([H])OC4=CC5OCOC=5C=C4[C@]3([H])COC=2C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
22296124

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 167619

> <CITATION>
-

$$$$