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CHEBI:180337 - 5-Keto-n-caprylic acid

ChEBI IDCHEBI:180337
ChEBI Name5-Keto-n-caprylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H14O3
Net Charge0
Average Mass158.197
Monoisotopic Mass158.09429
SMILESCCCC(=O)CCCC(=O)O
InChIInChI=1S/C8H14O3/c1-2-4-7(9)5-3-6-8(10)11/h2-6H2,1H3,(H,10,11)
InChIKeyOHGVWVVPDOAZSH-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)
5-Keto-n-caprylic acid (CHEBI:180337) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
5-oxooctanoic acid
Manual XrefsDatabases
246737ChemSpider
LMFA01060019LIPID MAPS
Registry NumbersSources
CAS:3637-14-7ChemIDplus