EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:80634 - 2-n-Propyl-4-pentenoic acid

ChEBI IDCHEBI:80634
ChEBI Name2-n-Propyl-4-pentenoic acid
Stars
DownloadsMolfile
FormulaC8H14O2
Net Charge0
Average Mass142.198
Monoisotopic Mass142.09938
SMILESC=CCC(CCC)C(=O)O
InChIInChI=1S/C8H14O2/c1-3-5-7(6-4-2)8(9)10/h3,7H,1,4-6H2,2H3,(H,9,10)
InChIKeyUMYDNZXEHYSVFY-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)
2-n-Propyl-4-pentenoic acid (CHEBI:80634) is a methyl-branched fatty acid (CHEBI:62499)
Synonyms  Source
4-En-valproic acidKEGG COMPOUND
4-Ene-VPAKEGG COMPOUND
Manual XrefsDatabases
C16648KEGG COMPOUND
HMDB0013897HMDB
Registry NumbersSources
CAS:1575-72-0KEGG COMPOUND