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CHEBI:174729 - 3,4-Dihydroxy-9-methoxypterocarpan

Default Structure
ChEBI IDCHEBI:174729
ChEBI Name3,4-Dihydroxy-9-methoxypterocarpan
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H14O5
Net Charge0
Average Mass286.283
Monoisotopic Mass286.08412
SMILESCOc1ccc2c(c1)OC1c3ccc(O)c(O)c3OCC21
InChIInChI=1S/C16H14O5/c1-19-8-2-3-9-11-7-20-16-10(4-5-12(17)14(16)18)15(11)21-13(9)6-8/h2-6,11,15,17-18H,7H2,1H3
InChIKeyYRFDJOAWSXSLMG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3,4-Dihydroxy-9-methoxypterocarpan (CHEBI:174729) is a pterocarpans (CHEBI:26377)
IUPAC Name 
9-methoxy-6a,11a-dihydro-6H-[1]benzouro[3,2-c]chromene-3,4-diol
Manual XrefsDatabases
9711318ChemSpider
HMDB0034012HMDB
LMPK12070074LIPID MAPS