CHEBI:9416 - (+)-taxifolin 3-O-acetate

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name (+)-taxifolin 3-O-acetate ChEBI ID CHEBI:9416 ChEBI ASCII Name (+)-taxifolin 3-O-acetate Definition An acetate ester obtained by formal condensation between the 3-hydroxy group of (+)-taxifolin and acetic acid. Stars This entity has been manually annotated by the ChEBI Team. 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 C17H14O8 Net Charge 0 Average Mass 346.28826 Monoisotopic Mass 346.06887 InChI InChI=1S/C17H14O8/c1-7(18)24-17-15(23)14-12(22)5-9(19)6-13(14)25-16(17)8-2-3-10(20)11(21)4-8/h2-6,16-17,19-22H,1H3/t16-,17+/m1/s1 InChIKey NPWRSXJQDKRXOR-SJORKVTESA-N SMILES CC(=O)O[C@@H]1[C@H](Oc2cc(O)cc(O)c2C1=O)c1ccc(O)c(O)c1 ChEBI Ontology Outgoing (+)-taxifolin 3-O-acetate (CHEBI:9416) has functional parent (+)-taxifolin (CHEBI:17948) (+)-taxifolin 3-O-acetate (CHEBI:9416) is a 3'-hydroxyflavanones (CHEBI:48024) (+)-taxifolin 3-O-acetate (CHEBI:9416) is a 4'-hydroxyflavanones (CHEBI:140331) (+)-taxifolin 3-O-acetate (CHEBI:9416) is a acetate ester (CHEBI:47622) (+)-taxifolin 3-O-acetate (CHEBI:9416) is a tetrahydroxyflavanone (CHEBI:38742) IUPAC Name (2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-3,4-dihydro-2H-chromen-3-yl acetate Synonyms Sources (2R,3R)-dihydroquercetin 3-acetate ChEBI (2R,3R)-taxifolin-3-acetate ChEBI 3-O-acetyltaxifolin ChEBI 3β-acetoxyeriodictyol ChEBI dihydroquercetin 3-acetate ChEBI Taxifolin 3-O-acetate KEGG COMPOUND Manual Xrefs Databases C00008743 KNApSAcK C09967 KEGG COMPOUND View more database links Registry Numbers Types Sources 4209835 Reaxys Registry Number Reaxys 78834-97-6 CAS Registry Number KEGG COMPOUND Last Modified 06 April 2018