LMPK12070149
  LIPID_MAPS_STRUCTURE_DATABASE

 19 22  0  0  0  0  0  0  0  0999 V2000
    6.8289   10.0233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8289    9.0216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6962    8.5209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5637    9.0216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5637   10.0233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6962   10.5240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4310    8.5209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2985    9.0216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2985   10.0233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4310   10.5240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6393    7.5412    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6354    7.4365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0428    8.3516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2241    6.6262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2202    6.7309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6277    7.6459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0388    8.4562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9647    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   10.6097    0.0000 O   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  2  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
  7 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13  8  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 13  1  0  0  0  0
 15 18  1  0  0  0  0
 19  1  1  0  0  0  0
M  END
> <LM_ID>
LMPK12070149

> <COMMON_NAME>
Anhydroglycinol

> <SYSTEMATIC_NAME>
3,9-Dihydroxypterocarpene

> <FORMULA>
C15H10O4

> <MASS>
254.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Pterocarpans [PK1207]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WYIDBNAGSMCMET-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H10O4/c16-8-2-4-11-13(5-8)18-7-12-10-3-1-9(17)6-14(10)19-15(11)12/h1-6,16-17H,7H2

> <SMILES>
C1(O)=CC2OCC3C4C=CC(O)=CC=4OC=3C=2C=C1

> <KEGG_ID>
C10200

> <HMDB_ID>
-

> <CHEBI_ID>
2727

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
442667

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 118937

> <CITATION>
-

$$$$