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CHEBI:174588 - 6-O-Methylequol

ChEBI IDCHEBI:174588
ChEBI Name6-O-Methylequol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O4
Net Charge0
Average Mass272.300
Monoisotopic Mass272.10486
SMILESCOc1cc2c(cc1O)OC[C@H](c1ccc(O)cc1)C2
InChIInChI=1S/C16H16O4/c1-19-16-7-11-6-12(9-20-15(11)8-14(16)18)10-2-4-13(17)5-3-10/h2-5,7-8,12,17-18H,6,9H2,1H3/t12-/m1/s1
InChIKeyUIGOOLXQMJUBBW-GFCCVEGCSA-N
ChEBI Ontology
Outgoing Relation(s)
6-O-Methylequol (CHEBI:174588) is a ether (CHEBI:25698)
6-O-Methylequol (CHEBI:174588) is a flavonoids (CHEBI:72544)
IUPAC Name 
(3S)-3-(4-hydroxyphenyl)-6-methoxy-3,4-dihydro-2H-chromen-7-ol
Manual XrefsDatabases
HMDB0041701HMDB
30777603ChemSpider