CHEBI:179236 - 4-keto stearic acid

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ChEBI Name 4-keto stearic acid
ChEBI ID CHEBI:179236
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C18H34O3
Net Charge 0
Average Mass 298.467
Monoisotopic Mass 298.25079
InChI InChI=1S/C18H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19)15-16-18(20)21/h2-16H2,1H3,(H,20,21)
InChIKey NARNRJNUUFXXBI-UHFFFAOYSA-N
SMILES O=C(CCCCCCCCCCCCCC)CCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 4-keto stearic acid (CHEBI:179236) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name
4-oxooctadecanoic acid
Manual Xrefs Databases
77152 ChemSpider
LMFA01060061 LIPID MAPS
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Registry Number Type Source
16694-30-7 CAS Registry Number ChemIDplus