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CHEBI:71292 - feruloylacetate(1−)

ChEBI IDCHEBI:71292
ChEBI Nameferuloylacetate(1−)
Stars
ASCII Nameferuloylacetate(1-)
DefinitionA 3-oxo monocarboxylic acid anion that is the conjugate base of feruloylacetic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified30 November 2012
SubmitterKAX
DownloadsMolfile
FormulaC12H11O5
Net Charge-1
Average Mass235.215
Monoisotopic Mass235.06120
SMILESCOc1cc(C=CC(=O)CC(=O)[O-])ccc1O
InChIInChI=1S/C12H12O5/c1-17-11-6-8(3-5-10(11)14)2-4-9(13)7-12(15)16/h2-6,14H,7H2,1H3,(H,15,16)/p-1
InChIKeyCXMRDTYDEINMSY-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
feruloylacetate(1−) (CHEBI:71292) is a 3-oxo monocarboxylic acid anion (CHEBI:35973)
IUPAC Name 
5-(4-hydroxy-3-methoxyphenyl)-3-oxopent-4-enoate
Synonym  Source
(4-hydroxy-3-methoxycinnamoyl)acetateChEBI
UniProt Name  Source
feruloyl-β-keto acidUniProt
Citations