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CHEBI:89267 - 2-Methyl-4-pentenoic acid

ChEBI IDCHEBI:89267
ChEBI Name2-Methyl-4-pentenoic acid
Stars
DownloadsMolfile
FormulaC6H10O2
Net Charge0
Average Mass114.144
Monoisotopic Mass114.06808
SMILESC=CCC(C)C(=O)O
InChIInChI=1S/C6H10O2/c1-3-4-5(2)6(7)8/h3,5H,1,4H2,2H3,(H,7,8)
InChIKeyHVRZYSHVZOELOH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) saliva (UBERON:0001836) Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation))
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-Methyl-4-pentenoic acid (CHEBI:89267) is a branched-chain fatty acid (CHEBI:35819)
Synonyms  Source
FEMA 3511HMDB
2-methylpent-4-enoic acidHMDB
2-Methylpent-4-enoic acidHMDB
Methylallylacetic acidHMDB
2-Methylpent-4-en-1-oic acidHMDB
Manual XrefsDatabases
HMDB0031158HMDB
Registry NumbersSources
CAS:1575-74-2KEGG COMPOUND