CHEBI:18322 - 6-oxohexanoate

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ChEBI Name 6-oxohexanoate
ChEBI ID CHEBI:18322
Definition A straight-chain fatty acid anion and the conjugate base of 6-oxohexanoic acid, formed by deprotonation of the carboxylic acid group.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:22265, CHEBI:12226, CHEBI:20749
Supplier Information
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Formula C6H9O3
Net Charge -1
Average Mass 129.13386
Monoisotopic Mass 129.05572
InChI InChI=1S/C6H10O3/c7-5-3-1-2-4-6(8)9/h5H,1-4H2,(H,8,9)/p-1
InChIKey PNPPVRALIYXJBW-UHFFFAOYSA-M
SMILES [O-]C(=O)CCCCC=O
ChEBI Ontology
Outgoing 6-oxohexanoate (CHEBI:18322) has functional parent hexanoate (CHEBI:17120)
6-oxohexanoate (CHEBI:18322) is a ω-oxo fatty acid anion (CHEBI:76309)
6-oxohexanoate (CHEBI:18322) is a 6-oxo monocarboxylic acid anion (CHEBI:35976)
6-oxohexanoate (CHEBI:18322) is a aldehydic acid anion (CHEBI:71944)
6-oxohexanoate (CHEBI:18322) is a straight-chain fatty acid anion (CHEBI:59203)
6-oxohexanoate (CHEBI:18322) is conjugate base of 6-oxohexanoic acid (CHEBI:2490)
Incoming 6-oxohexanoic acid (CHEBI:2490) is conjugate acid of 6-oxohexanoate (CHEBI:18322)
IUPAC Name
6-oxohexanoate
Synonyms Sources
6-oxohexanoate UniProt
adipate semialdehyde UM-BBD
Manual Xrefs Databases
6-OXO-HEXANOATE MetaCyc
c0112 UM-BBD
c0112 UM-BBD
C06102 KEGG COMPOUND
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Last Modified
13 November 2023