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CHEBI:15648 - (6aR,11aR)-3,9-dihydroxypterocarpan

ChEBI IDCHEBI:15648
ChEBI Name(6aR,11aR)-3,9-dihydroxypterocarpan
Stars
ASCII Name(6aR,11aR)-3,9-dihydroxypterocarpan
Secondary ChEBI IDsCHEBI:259, CHEBI:10934, CHEBI:18599
Last Modified17 August 2016
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC15H12O4
Net Charge0
Average Mass256.257
Monoisotopic Mass256.07356
SMILES[H][C@@]12COc3cc(O)ccc3[C@]1([H])Oc1cc(O)ccc12
InChIInChI=1S/C15H12O4/c16-8-2-4-11-13(5-8)18-7-12-10-3-1-9(17)6-14(10)19-15(11)12/h1-6,12,15-17H,7H2/t12-,15-/m0/s1
InChIKeyODMIEGVTNZNSLD-WFASDCNBSA-N
ChEBI Ontology
Outgoing Relation(s)
(6aR,11aR)-3,9-dihydroxypterocarpan (CHEBI:15648) is a pterocarpans (CHEBI:26377)
Incoming Relation(s)
erybraedin A (CHEBI:65862) has functional parent (6aR,11aR)-3,9-dihydroxypterocarpan (CHEBI:15648)
lespedezol D1 (CHEBI:132852) has functional parent (6aR,11aR)-3,9-dihydroxypterocarpan (CHEBI:15648)
IUPAC Name 
(6aR,11aR)-6a,11a-dihydro-6H-benzo[4,5]furo[3,2-c]chromene-3,9-diol
Synonyms  Source
(6aR,11aR)-3,9-DihydroxypterocarpanKEGG COMPOUND
(6AR,11AR)-3,9-dihydroxypterocarpanChEBI
(6aR-cis)-6a,11a-Dihydro-6H-benzofuro(3,2-c)(1)benzopyran-3,9-diolChemIDplus
UniProt Name  Source
(6aR,11aR)-3,9-dihydroxypterocarpanUniProt
Manual XrefsDatabases
C04271KEGG COMPOUND
C04271KEGG COMPOUND
Registry NumbersSources
CAS:61135-91-9ChemIDplus