CHEBI:60016 - 3',5'-di-O-methyltricetin(1−)

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ChEBI Name 3',5'-di-O-methyltricetin(1−)
ChEBI ID CHEBI:60016
ChEBI ASCII Name 3',5'-di-O-methyltricetin(1-)
Definition The conjugate base of 3',5'-di-O-methyltricetin arising from selective deprotonation of the 7-OH position; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C17H13O7
Net Charge -1
Average Mass 329.28090
Monoisotopic Mass 329.06668
InChI InChI=1S/C17H14O7/c1-22-14-3-8(4-15(23-2)17(14)21)12-7-11(20)16-10(19)5-9(18)6-13(16)24-12/h3-7,18-19,21H,1-2H3/p-1
InChIKey HRGUSFBJBOKSML-UHFFFAOYSA-M
SMILES COc1cc(cc(OC)c1O)-c1cc(=O)c2c(O)cc([O-])cc2o1
ChEBI Ontology
Outgoing 3',5'-di-O-methyltricetin(1−) (CHEBI:60016) is a flavonoid oxoanion (CHEBI:60038)
3',5'-di-O-methyltricetin(1−) (CHEBI:60016) is conjugate base of 3',5'-di-O-methyltricetin (CHEBI:59979)
Incoming 3',5'-di-O-methyltricetin (CHEBI:59979) is conjugate acid of 3',5'-di-O-methyltricetin(1−) (CHEBI:60016)
IUPAC Name
5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxo-4H-chromen-7-olate
Synonym Source
3',5'-di-O-methyltricetin UniProt
Last Modified
12 August 2010