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CHEBI:76318 - 22-oxodocosanoic acid

ChEBI IDCHEBI:76318
ChEBI Name22-oxodocosanoic acid
Stars
DefinitionA long-chain oxo-fatty acid that is the 22-oxo derivative of docosanoic acid.
Last Modified20 November 2013
SubmitterSteve
DownloadsMolfile
FormulaC22H42O3
Net Charge0
Average Mass354.575
Monoisotopic Mass354.31340
SMILESO=CCCCCCCCCCCCCCCCCCCCCC(=O)O
InChIInChI=1S/C22H42O3/c23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22(24)25/h21H,1-20H2,(H,24,25)
InChIKeyPYBWSGBQPKXKOQ-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)
22-oxodocosanoic acid (CHEBI:76318) has functional parent docosanoic acid (CHEBI:28941)
22-oxodocosanoic acid (CHEBI:76318) is a aldehydic acid (CHEBI:26643)
22-oxodocosanoic acid (CHEBI:76318) is a long-chain fatty acid (CHEBI:15904)
22-oxodocosanoic acid (CHEBI:76318) is a ω-oxo fatty acid (CHEBI:76328)
22-oxodocosanoic acid (CHEBI:76318) is conjugate acid of 22-oxodocosanoate (CHEBI:76298)
Incoming Relation(s)
22-oxodocosanoate (CHEBI:76298) is conjugate base of 22-oxodocosanoic acid (CHEBI:76318)
IUPAC Name 
22-oxodocosanoic acid
Synonyms  Source
22-ketobehenic acidChEBI
22-ketodocosanoic acidChEBI
22-oxobehenic acidChEBI
ω-ketobehenic acidChEBI
ω-ketodocosanoic acidChEBI
ω-oxobehenic acidChEBI
Manual XrefsDatabases
C19624KEGG COMPOUND
CPD-13098MetaCyc