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CHEBI:52350 - 3-oxoicosanoic acid

ChEBI IDCHEBI:52350
ChEBI Name3-oxoicosanoic acid
Stars
DefinitionA long-chain fatty acid that is icosanoic acid in which the hydrogens at the β-position are replaced by an oxo group.
Last Modified21 May 2012
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC20H38O3
Net Charge0
Average Mass326.521
Monoisotopic Mass326.28210
SMILESCCCCCCCCCCCCCCCCCC(=O)CC(=O)O
InChIInChI=1S/C20H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(21)18-20(22)23/h2-18H2,1H3,(H,22,23)
InChIKeyMZPZMTFDSVTILM-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-oxoicosanoic acid (CHEBI:52350) has functional parent icosanoic acid (CHEBI:28822)
3-oxoicosanoic acid (CHEBI:52350) is a 3-oxo monocarboxylic acid (CHEBI:47881)
3-oxoicosanoic acid (CHEBI:52350) is a long-chain fatty acid (CHEBI:15904)
Incoming Relation(s)
3-oxoicosanoyl-CoA (CHEBI:52327) has functional parent 3-oxoicosanoic acid (CHEBI:52350)
IUPAC Name 
3-oxoicosanoic acid
Synonyms  Source
3-oxoeicosanoic acidChEBI
3-oxoarachidic acidChEBI
β-oxoeicosanoic acidChEBI
β-oxoicosanoic acidChEBI
β-oxoarachidic acidChEBI
Manual XrefsDatabases
LMFA01060134LIPID MAPS
Registry NumbersSources
Beilstein:1796542Beilstein