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CHEBI:8224 - pinoquercetin

ChEBI IDCHEBI:8224
ChEBI Namepinoquercetin
Stars
DefinitionA pentahydroxyflavone that is quercetin substituted by a methyl group at position 6.
Last Modified28 July 2014
DownloadsMolfile
FormulaC16H12O7
Net Charge0
Average Mass316.265
Monoisotopic Mass316.05830
SMILESCc1c(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c1O
InChIInChI=1S/C16H12O7/c1-6-9(18)5-11-12(13(6)20)14(21)15(22)16(23-11)7-2-3-8(17)10(19)4-7/h2-5,17-20,22H,1H3
InChIKeyDTFXGVGIKNSCQQ-UHFFFAOYSA-N
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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)
pinoquercetin (CHEBI:8224) has functional parent quercetin (CHEBI:16243)
pinoquercetin (CHEBI:8224) has role metabolite (CHEBI:25212)
pinoquercetin (CHEBI:8224) has role plant metabolite (CHEBI:76924)
pinoquercetin (CHEBI:8224) is a 7-hydroxyflavonol (CHEBI:52267)
pinoquercetin (CHEBI:8224) is a pentahydroxyflavone (CHEBI:25883)
IUPAC Name 
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-methyl-4H-chromen-4-one
Synonym  Source
6-C-MethylquercetinKEGG COMPOUND
Manual XrefsDatabases
C10120KEGG COMPOUND
LMPK12112292LIPID MAPS
C00004895KNApSAcK
Registry NumbersSources
Reaxys:324756Reaxys
CAS:491-49-6KEGG COMPOUND