CHEBI:78589 - 2-O,3-dimethylflaviolin-7-olate

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ChEBI Name 2-O,3-dimethylflaviolin-7-olate ChEBI ID CHEBI:78589 ChEBI ASCII Name 2-O,3-dimethylflaviolin-7-olate Definition An organic anion that is the conjugate base of 2-O,3-dimethylflaviolin, obtained by deprotonation of the 7-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C12H9O5 Net Charge -1 Average Mass 233.19740 Monoisotopic Mass 233.04555 InChI InChI=1S/C12H10O5/c1-5-10(15)9-7(11(16)12(5)17-2)3-6(13)4-8(9)14/h3-4,13-14H,1-2H3/p-1 InChIKey MMVQTVRCJUHCSV-UHFFFAOYSA-M SMILES COC1=C(C)C(=O)c2c(O)cc([O-])cc2C1=O ChEBI Ontology Outgoing 2-O,3-dimethylflaviolin-7-olate (CHEBI:78589) is a organic anion (CHEBI:25696) 2-O,3-dimethylflaviolin-7-olate (CHEBI:78589) is conjugate base of 2-O,3-dimethylflaviolin (CHEBI:82611) Incoming 2-O,3-dimethylflaviolin (CHEBI:82611) is conjugate acid of 2-O,3-dimethylflaviolin-7-olate (CHEBI:78589) IUPAC Name 4-hydroxy-7-methoxy-6-methyl-5,8-dioxo-5,8-dihydronaphthalen-2-olate Synonyms Sources 2-methoxy-3-methylflaviolin-7-olate ChEBI 2-O,3-dimethylflaviolin UniProt Manual Xref Database CPD-16658 MetaCyc View more database links Citation Type Source 20937800 PubMed citation Europe PMC Last Modified 04 August 2014