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CHEBI:174381 - 3'-Hydroxyequol

ChEBI IDCHEBI:174381
ChEBI Name3'-Hydroxyequol
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H14O4
Net Charge0
Average Mass258.273
Monoisotopic Mass258.08921
SMILESOc1ccc2c(c1)OC[C@H](c1ccc(O)c(O)c1)C2
InChIInChI=1S/C15H14O4/c16-12-3-1-10-5-11(8-19-15(10)7-12)9-2-4-13(17)14(18)6-9/h1-4,6-7,11,16-18H,5,8H2/t11-/m1/s1
InChIKeyBXUZHRKORIBRMQ-LLVKDONJSA-N
ChEBI Ontology
Outgoing Relation(s)
3'-Hydroxyequol (CHEBI:174381) is a hydroxyisoflavans (CHEBI:76250)
IUPAC Name 
4-[(3S)-7-hydroxy-3,4-dihydro-2H-chromen-3-yl]benzene-1,2-diol
Manual XrefsDatabases
HMDB0041657HMDB
30777590ChemSpider