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CHEBI:70031 - 2'-hydroxygenistein

ChEBI IDCHEBI:70031
ChEBI Name2'-hydroxygenistein
Stars
DefinitionA hydroxyisoflavone that is genistein substituted by an additional hydroxy group at position 2'. It has been isolated from Crotalaria lachnophora.
Secondary ChEBI IDCHEBI:31065
Last Modified23 June 2015
DownloadsMolfile
FormulaC15H10O6
Net Charge0
Average Mass286.239
Monoisotopic Mass286.04774
SMILESO=c1c(-c2ccc(O)cc2O)coc2cc(O)cc(O)c12
InChIInChI=1S/C15H10O6/c16-7-1-2-9(11(18)3-7)10-6-21-13-5-8(17)4-12(19)14(13)15(10)20/h1-6,16-19H
InChIKeyGSSOWCUOWLMMRJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Crotalaria lachnophora (IPNI:488342-1) whole plant (BTO:0001461) PubMed (21265557) Chloroform soluble fraction of CH2Cl2/MeOH (1:1) crude extract of dried and powdered whole plant
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
2'-hydroxygenistein (CHEBI:70031) has functional parent genistein (CHEBI:28088)
2'-hydroxygenistein (CHEBI:70031) has role plant metabolite (CHEBI:76924)
2'-hydroxygenistein (CHEBI:70031) is a hydroxyisoflavone (CHEBI:38755)
2'-hydroxygenistein (CHEBI:70031) is conjugate acid of 2'-hydroxygenistein(1−) (CHEBI:140306)
Incoming Relation(s)
2'-hydroxygenistein(1−) (CHEBI:140306) is conjugate base of 2'-hydroxygenistein (CHEBI:70031)
IUPAC Name 
3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-4-1H-benzopyran-4-one
Synonyms  Source
3-(2,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-oneChEBI
2',4',5,7-TetrahydroxyisoflavoneKEGG COMPOUND
Manual XrefsDatabases
C12134KEGG COMPOUND
C00009453KNApSAcK
LMPK12050327LIPID MAPS
HMDB0034014HMDB
Registry NumbersSources
Reaxys:299569Reaxys
CAS:1156-78-1KEGG COMPOUND
CAS:1156-78-1ChemIDplus
Citations