CHEBI:15777 - 4-oxocyclohexanecarboxylate

ChEBI IDCHEBI:15777
ChEBI Name4-oxocyclohexanecarboxylate
Stars
Secondary ChEBI IDsCHEBI:12039, CHEBI:20464
Last Modified14 March 2024
DownloadsMolfile
FormulaC7H9O3
Net Charge-1
Average Mass141.146
Monoisotopic Mass141.05572
SMILESO=C1CCC(C(=O)[O-])CC1
InChIInChI=1S/C7H10O3/c8-6-3-1-5(2-4-6)7(9)10/h5H,1-4H2,(H,9,10)/p-1
InChIKeyOWLXUYGCLDGHJJ-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
4-oxocyclohexanecarboxylate (CHEBI:15777) has functional parent cyclohexanecarboxylate (CHEBI:27804)
4-oxocyclohexanecarboxylate (CHEBI:15777) is a 4-oxo monocarboxylic acid anion (CHEBI:35974)
4-oxocyclohexanecarboxylate (CHEBI:15777) is conjugate base of 4-oxocyclohexanecarboxylic acid (CHEBI:1921)
Incoming Relation(s)
4-oxocyclohex-2-ene-1-carboxylate (CHEBI:229702) has functional parent 4-oxocyclohexanecarboxylate (CHEBI:15777)
4-oxocyclohexanecarboxylic acid (CHEBI:1921) is conjugate acid of 4-oxocyclohexanecarboxylate (CHEBI:15777)
IUPAC Name 
4-oxocyclohexanecarboxylate
Synonyms  Source
4-ketocyclohexanecarboxylateChEBI
4-OxocyclohexanecarboxylateKEGG COMPOUND
UniProt Name  Source
4-oxocyclohexane-1-carboxylateUniProt
Manual XrefsDatabases
C03767KEGG COMPOUND