CHEBI:12154 - 5-oxohexanoate

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ChEBI Name 5-oxohexanoate
ChEBI ID CHEBI:12154
Definition An oxo fatty acid anion that is the conjugate base of 5-oxohexanoic acid, arising from deprotonation of the carboxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H9O3
Net Charge -1
Average Mass 129.13386
Monoisotopic Mass 129.05572
InChI InChI=1S/C6H10O3/c1-5(7)3-2-4-6(8)9/h2-4H2,1H3,(H,8,9)/p-1
InChIKey MGTZCLMLSSAXLD-UHFFFAOYSA-M
SMILES CC(=O)CCCC([O-])=O
ChEBI Ontology
Outgoing 5-oxohexanoate (CHEBI:12154) has functional parent hexanoate (CHEBI:17120)
5-oxohexanoate (CHEBI:12154) is a 5-oxo monocarboxylic acid anion (CHEBI:35975)
5-oxohexanoate (CHEBI:12154) is a medium-chain fatty acid anion (CHEBI:59558)
5-oxohexanoate (CHEBI:12154) is a oxo fatty acid anion (CHEBI:59836)
5-oxohexanoate (CHEBI:12154) is conjugate base of 5-oxohexanoic acid (CHEBI:15888)
Incoming 5-oxohexanoic acid (CHEBI:15888) is conjugate acid of 5-oxohexanoate (CHEBI:12154)
IUPAC Name
5-oxohexanoate
Synonyms Sources
4-acetylbutyrate ChEBI
5-ketocaproate ChEBI
5-ketohexanoate ChEBI
5-oxohexanoate UniProt
δ-ketocaproate ChEBI
δ-oxocaproate ChEBI
γ-acetylbutyrate ChEBI
Last Modified
13 November 2017