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CHEBI:179477 - 2-isopropyl trans-crotonic acid

ChEBI IDCHEBI:179477
ChEBI Name2-isopropyl trans-crotonic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC7H12O2
Net Charge0
Average Mass128.171
Monoisotopic Mass128.08373
SMILESC/C=C(/C(=O)O)C(C)C
InChIInChI=1S/C7H12O2/c1-4-6(5(2)3)7(8)9/h4-5H,1-3H3,(H,8,9)/b6-4+
InChIKeyKPEWEFZCRAOPHV-GQCTYLIASA-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-isopropyl trans-crotonic acid (CHEBI:179477) is a methyl-branched fatty acid (CHEBI:62499)
IUPAC Name 
(E)-2-propan-2-ylbut-2-enoic acid
Manual XrefsDatabases
4445789ChemSpider
LMFA01020122LIPID MAPS