2-oxoadipic acid (CHEBI:15753)

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ChEBI Name	2-oxoadipic acid

ChEBI ID	CHEBI:15753

Definition	An oxo dicarboxylic acid that is adipic acid substituted by an oxo group at position 2.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:11635, CHEBI:1247, CHEBI:19737

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Formula

C6H8O5

Net Charge

Average Mass

160.125

Monoisotopic Mass

160.03717

InChI

InChI=1S/C6H8O5/c7-4(6(10)11)2-1-3-5(8)9/h1-3H2,(H,8,9)(H,10,11)

InChIKey

FGSBNBBHOZHUBO-UHFFFAOYSA-N

SMILES

OC(=O)CCCC(=O)C(O)=O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Source: BioModels - MODEL1507180067 See: PubMed
Glycine max (NCBI:txid3847)	From MetaboLights See: MetaboLights Study
Homo sapiens (NCBI:txid9606)	Found in urine (BTO:0001419). See: PubMed

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples.

ChEBI Ontology
Outgoing	2-oxoadipic acid (CHEBI:15753) has functional parent adipic acid (CHEBI:30832) 2-oxoadipic acid (CHEBI:15753) has role human urinary metabolite (CHEBI:84087) 2-oxoadipic acid (CHEBI:15753) has role mouse metabolite (CHEBI:75771) 2-oxoadipic acid (CHEBI:15753) is a oxo dicarboxylic acid (CHEBI:36145) 2-oxoadipic acid (CHEBI:15753) is conjugate acid of 2-oxoadipate(2−) (CHEBI:57499)

Incoming	2-oxoadipate(2−) (CHEBI:57499) is conjugate base of 2-oxoadipic acid (CHEBI:15753)

IUPAC Name

2-oxohexanedioic acid

Last Modified

12 June 2021