CHEBI:134195 - 16-oxohexadecanoic acid

ChEBI IDCHEBI:134195
ChEBI Name16-oxohexadecanoic acid
Stars
DefinitionAn ω-oxo fatty acid derived from hexadecanoic acid.
Last Modified14 June 2017
SubmitterKeeva
DownloadsMolfile
FormulaC16H30O3
Net Charge0
Average Mass270.413
Monoisotopic Mass270.21949
SMILES[H]C(=O)CCCCCCCCCCCCCCC(=O)O
InChIInChI=1S/C16H30O3/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(18)19/h15H,1-14H2,(H,18,19)
InChIKeyNKVUEIHJDGURIA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Solanum tuberosum (ncbitaxon:4113) - PubMed (16659915)
Apis cerana (ncbitaxon:7461) - MetaboLights (MTBLS379)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
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 Relation(s)
16-oxohexadecanoic acid (CHEBI:134195) has functional parent hexadecanoic acid (CHEBI:15756)
16-oxohexadecanoic acid (CHEBI:134195) has role plant metabolite (CHEBI:76924)
16-oxohexadecanoic acid (CHEBI:134195) is a aldehydic acid (CHEBI:26643)
16-oxohexadecanoic acid (CHEBI:134195) is a long-chain fatty acid (CHEBI:15904)
16-oxohexadecanoic acid (CHEBI:134195) is a ω-oxo fatty acid (CHEBI:76328)
16-oxohexadecanoic acid (CHEBI:134195) is conjugate acid of 16-oxohexadecanoate (CHEBI:144068)
Incoming Relation(s)
16-oxohexadecanoate (CHEBI:144068) is conjugate base of 16-oxohexadecanoic acid (CHEBI:134195)
IUPAC Name 
16-oxohexadecanoic acid
Synonyms  Source
16-OxopalmitateKEGG COMPOUND
15-formylpentadecanoic acidChEBI
16-oxopalmitic acidChEBI
Manual XrefsDatabases
C19614KEGG COMPOUND
CPD-10512MetaCyc
Registry NumbersSources
Reaxys:5428051Reaxys
Citations