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CHEBI:165436 - 6-Keto-n-caprylic acid

ChEBI IDCHEBI:165436
ChEBI Name6-Keto-n-caprylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H14O3
Net Charge0
Average Mass158.197
Monoisotopic Mass158.09429
SMILESCCC(=O)CCCCC(=O)O
InChIInChI=1S/C8H14O3/c1-2-7(9)5-3-4-6-8(10)11/h2-6H2,1H3,(H,10,11)
InChIKeyPUOYTVHCFIDKJM-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)
6-Keto-n-caprylic acid (CHEBI:165436) is a oxo carboxylic acid (CHEBI:25754)
IUPAC Name 
6-oxooctanoic acid
Manual XrefsDatabases
70305ChemSpider
LMFA01060020LIPID MAPS
Registry NumbersSources
CAS:4233-57-2ChemIDplus