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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
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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
View more database links
Last Modified
13 November 2023