CHEBI:142578 - 2-oxododecanoic acid

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ChEBI Name 2-oxododecanoic acid ChEBI ID CHEBI:142578 Definition An oxo fatty acid that is dodecanoic acid (lauric acid) which is substituted at position 2 by an oxo group. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C12H22O3 Net Charge 0 Average Mass 214.302 Monoisotopic Mass 214.15689 InChI InChI=1S/C12H22O3/c1-2-3-4-5-6-7-8-9-10-11(13)12(14)15/h2-10H2,1H3,(H,14,15) InChIKey MIMUDKBBERJQHQ-UHFFFAOYSA-N SMILES C(CCCCCCCC(C(=O)O)=O)CC Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 2-oxododecanoic acid (CHEBI:142578) is a 2-oxo monocarboxylic acid (CHEBI:35910) 2-oxododecanoic acid (CHEBI:142578) is a ketone (CHEBI:17087) 2-oxododecanoic acid (CHEBI:142578) is a medium-chain fatty acid (CHEBI:59554) 2-oxododecanoic acid (CHEBI:142578) is a oxo fatty acid (CHEBI:59644) 2-oxododecanoic acid (CHEBI:142578) is conjugate acid of 2-oxododecanoate (CHEBI:142579) 2-oxododecanoic acid (CHEBI:142578) is tautomer of 2-hydroxydodec-2-enoic acid (CHEBI:142577) Incoming 2-oxododecanoate (CHEBI:142579) is conjugate base of 2-oxododecanoic acid (CHEBI:142578) 2-hydroxydodec-2-enoic acid (CHEBI:142577) is tautomer of 2-oxododecanoic acid (CHEBI:142578) IUPAC Name 2-oxododecanoic acid Synonyms Sources 2-ketododecanoic acid ChEBI 2-Oxo-dodecansaeure ChEBI 2-oxolauric acid ChEBI α-keto-dodecanoic acid ChEBI α-keto-lauric acid ChEBI Manual Xref Database LMFA01060090 LIPID MAPS View more database links Registry Number Type Source 1772378 Reaxys Registry Number Reaxys Citation Type Source 28481114 PubMed citation Europe PMC Last Modified 14 November 2018