CHEBI:143856 - 4-methylpent-3-enoic acid

ChEBI IDCHEBI:143856
ChEBI Name4-methylpent-3-enoic acid
Stars
DefinitionA methyl-branched chain fatty acid that is pent-3-enoic acid substituted by a methyl group at position 4.
Last Modified18 June 2019
Submittermwilliams
DownloadsMolfile
FormulaC6H10O2
Net Charge0
Average Mass114.144
Monoisotopic Mass114.06808
SMILESCC(C)=CCC(=O)O
InChIInChI=1S/C6H10O2/c1-5(2)3-4-6(7)8/h3H,4H2,1-2H3,(H,7,8)
InChIKeyCQJHAULYLJXJNL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Salinispora tropica CNB-440 (ncbitaxon:369723) - PubMed (27490971) Identified in the headspace.
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
4-methylpent-3-enoic acid (CHEBI:143856) has role bacterial metabolite (CHEBI:76969)
4-methylpent-3-enoic acid (CHEBI:143856) is a methyl-branched fatty acid (CHEBI:62499)
4-methylpent-3-enoic acid (CHEBI:143856) is a monounsaturated fatty acid (CHEBI:25413)
4-methylpent-3-enoic acid (CHEBI:143856) is a short-chain fatty acid (CHEBI:26666)
4-methylpent-3-enoic acid (CHEBI:143856) is a volatile organic compound (CHEBI:134179)
IUPAC Name 
4-methylpent-3-enoic acid
Synonyms  Source
4-methyl-3-pentenoic acidLIPID MAPS
pyroterebic acidNIST Chemistry WebBook
Manual XrefsDatabases
LMFA01020031LIPID MAPS
Registry NumbersSources
CAS:504-85-8NIST Chemistry WebBook
CAS:504-85-8ChemIDplus
Citations