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CHEBI:174863 - 8-Hydroxy-3,9-dimethoxypterocarpan

Default Structure
ChEBI IDCHEBI:174863
ChEBI Name8-Hydroxy-3,9-dimethoxypterocarpan
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H16O5
Net Charge0
Average Mass300.310
Monoisotopic Mass300.09977
SMILESCOc1ccc2c(c1)OCC1c3cc(O)c(OC)cc3OC21
InChIInChI=1S/C17H16O5/c1-19-9-3-4-10-14(5-9)21-8-12-11-6-13(18)16(20-2)7-15(11)22-17(10)12/h3-7,12,17-18H,8H2,1-2H3
InChIKeyKIKDCPYSYOMXEJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
8-Hydroxy-3,9-dimethoxypterocarpan (CHEBI:174863) is a pterocarpans (CHEBI:26377)
IUPAC Name 
3,9-dimethoxy-6a,11a-dihydro-6H-[1]benzouro[3,2-c]chromen-8-ol
Manual XrefsDatabases
400548ChemSpider
HMDB0033292HMDB
LMPK12070057LIPID MAPS