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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:30833 - adipate(1−)
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ChEBI Name
adipate(1−)
ChEBI ID
CHEBI:30833
ChEBI ASCII Name
adipate(1-)
Definition
A dicarboxylic acid monoanion that is the conjugate base of adipic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C6H9O4
Net Charge
-1
Average Mass
145.13326
Monoisotopic Mass
145.05063
InChI
InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)/p-1
InChIKey
WNLRTRBMVRJNCN-UHFFFAOYSA-M
SMILES
OC(=O)CCCCC([O-])=O
Roles Classification
Biological Role
(s):
human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
adipate(1−) (
CHEBI:30833
)
has role
human xenobiotic metabolite (
CHEBI:76967
)
adipate(1−) (
CHEBI:30833
)
is a
dicarboxylic acid monoanion (
CHEBI:35695
)
adipate(1−) (
CHEBI:30833
)
is conjugate acid of
adipate(2−) (
CHEBI:17128
)
adipate(1−) (
CHEBI:30833
)
is conjugate base of
adipic acid (
CHEBI:30832
)
Incoming
adipic acid (
CHEBI:30832
)
is conjugate acid of
adipate(1−) (
CHEBI:30833
)
adipate(2−) (
CHEBI:17128
)
is conjugate base of
adipate(1−) (
CHEBI:30833
)
IUPAC Name
5-carboxypentanoate
Synonyms
Sources
hexanedioic acid, conjugate base
NIST Chemistry WebBook
hydrogen adipate
ChEBI
Registry Numbers
Types
Sources
326744
Gmelin Registry Number
Gmelin
3904589
Reaxys Registry Number
Reaxys
3904589
Beilstein Registry Number
Beilstein
Last Modified
01 September 2014