4-oxopentanoic acid (CHEBI:45630)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	4-oxopentanoic acid

ChEBI ID	CHEBI:45630

Definition	An oxopentanoic acid with the oxo group in the 4-position.

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

Secondary ChEBI IDs	CHEBI:39149, CHEBI:45628

Supplier Information

Download	Molfile XML SDF

more structures >>

Wikipedia	License

Read full article at Wikipedia

Formula

C5H8O3

Net Charge

Average Mass

116.11522

Monoisotopic Mass

116.04734

InChI

InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)

InChIKey

JOOXCMJARBKPKM-UHFFFAOYSA-N

SMILES

CC(=O)CCC(O)=O

Metabolite of Species	Details
Pleione bulbocodioides (NCBI:txid141752)	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):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	4-oxopentanoic acid (CHEBI:45630) has role plant metabolite (CHEBI:76924) 4-oxopentanoic acid (CHEBI:45630) is a oxopentanoic acid (CHEBI:25799) 4-oxopentanoic acid (CHEBI:45630) is a straight-chain saturated fatty acid (CHEBI:39418) 4-oxopentanoic acid (CHEBI:45630) is conjugate acid of 4-oxopentanoate (CHEBI:39150)

Incoming	5-aminolevulinic acid (CHEBI:17549) has functional parent 4-oxopentanoic acid (CHEBI:45630) 4-oxopentanoate (CHEBI:39150) is conjugate base of 4-oxopentanoic acid (CHEBI:45630)

IUPAC Name

4-oxopentanoic acid

Last Modified

23 October 2015