2-oxodecanoic acid (CHEBI:34301)

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ChEBI Name	2-oxodecanoic acid

ChEBI ID	CHEBI:34301

Definition	A 2-oxo monocarboxylic acid that is decanoic acid carrying an oxo group at position 2.

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

Supplier Information

Download	Molfile XML SDF

Formula

C10H18O3

Net Charge

Average Mass

186.251

Monoisotopic Mass

186.12559

InChI

InChI=1S/C10H18O3/c1-2-3-4-5-6-7-8-9(11)10(12)13/h2-8H2,1H3,(H,12,13)

InChIKey

JBFDBSZCFDASAE-UHFFFAOYSA-N

SMILES

CCCCCCCCC(=O)C(O)=O

Metabolite of Species	Details
Alexandrium tamarense (NCBI:txid2926)	See: PubMed
Vitis vinifera (NCBI:txid29760)	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):	algal metabolite Any eukaryotic metabolite produced during a metabolic reaction in algae including unicellular organisms like chlorella and diatoms to multicellular organisms like giant kelps and brown algae. 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	2-oxodecanoic acid (CHEBI:34301) has functional parent decanoic acid (CHEBI:30813) 2-oxodecanoic acid (CHEBI:34301) has role algal metabolite (CHEBI:84735) 2-oxodecanoic acid (CHEBI:34301) has role plant metabolite (CHEBI:76924) 2-oxodecanoic acid (CHEBI:34301) is a 2-oxo monocarboxylic acid (CHEBI:35910) 2-oxodecanoic acid (CHEBI:34301) is conjugate acid of 2-oxodecanotate (CHEBI:176592)

Incoming	2-oxodecanotate (CHEBI:176592) is conjugate base of 2-oxodecanoic acid (CHEBI:34301)

IUPAC Name

2-oxodecanoic acid

Registry Number	Type	Source
333-60-8	CAS Registry Number	ChEBI

Last Modified

28 June 2021