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CHEBI:165433 - 3-Butyrl propionic acid

ChEBI IDCHEBI:165433
ChEBI Name3-Butyrl propionic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H12O3
Net Charge0
Average Mass144.170
Monoisotopic Mass144.07864
SMILESCCCC(=O)CCC(=O)O
InChIInChI=1S/C7H12O3/c1-2-3-6(8)4-5-7(9)10/h2-5H2,1H3,(H,9,10)
InChIKeyACHSNZNVVUIPJX-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-Butyrl propionic acid (CHEBI:165433) is a oxo carboxylic acid (CHEBI:25754)
IUPAC Name 
4-oxoheptanoic acid
Manual XrefsDatabases
LMFA01060013LIPID MAPS
4446105ChemSpider