EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:194068 - 7,4'-O-dimethylquercetin 3-olate

ChEBI IDCHEBI:194068
ChEBI Name7,4'-O-dimethylquercetin 3-olate
Stars
ASCII Name7,4'-O-dimethylquercetin 3-olate
DefinitionMajor microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC17H13O7
Net Charge-1
Average Mass329.284
Monoisotopic Mass329.06668
SMILESCOc1cc(O)c2c(=O)c([O-])c(-c3ccc(OC)c(O)c3)oc2c1
InChIInChI=1S/C17H14O7/c1-22-9-6-11(19)14-13(7-9)24-17(16(21)15(14)20)8-3-4-12(23-2)10(18)5-8/h3-7,18-19,21H,1-2H3/p-1
InChIKeyBWORNNDZQGOKBY-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
7,4'-O-dimethylquercetin 3-olate (CHEBI:194068) is a flavonoid oxoanion (CHEBI:60038)
7,4'-O-dimethylquercetin 3-olate (CHEBI:194068) is conjugate base of ombuin (CHEBI:67493)
Incoming Relation(s)
ombuin (CHEBI:67493) is conjugate acid of 7,4'-O-dimethylquercetin 3-olate (CHEBI:194068)
Synonym  Source
ombuin 3-olateSUBMITTER
UniProt Name  Source
7,4'-O-dimethylquercetinUniProt
Citations