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CHEBI:41607 - crotonaldehyde

ChEBI IDCHEBI:41607
ChEBI Namecrotonaldehyde
Stars
DefinitionAn enal consisting of propene having a formyl group at the 1-position.
Last Modified25 September 2023
DownloadsMolfile
FormulaC4H6O
Net Charge0
Average Mass70.091
Monoisotopic Mass70.04186
SMILES[H]C(=O)/C=C/C
InChIInChI=1S/C4H6O/c1-2-3-4-5/h2-4H,1H3/b3-2+
InChIKeyMLUCVPSAIODCQM-NSCUHMNNSA-N
ChEBI Ontology
Outgoing Relation(s)
crotonaldehyde (CHEBI:41607) is a enal (CHEBI:51688)
Incoming Relation(s)
S-(4-oxobutan-2-yl)glutathione (CHEBI:133880) has functional parent crotonaldehyde (CHEBI:41607)
IUPAC Name 
(2E)-but-2-enal
Synonyms  Source
(2E)-BUT-2-ENALPDBeChem
crotonalChemIDplus
trans-2-butenaldehydeChemIDplus
crotonic aldehydeChemIDplus
crotylaldehydeChemIDplus
β-methylacroleinChemIDplus
UniProt Name  Source
(2E)-but-2-enalUniProt
Manual XrefsDatabases
CRDPDBeChem
C19377KEGG COMPOUND
Registry NumbersSources
Reaxys:1209254Reaxys
CAS:123-73-9ChemIDplus
CAS:4170-30-3KEGG COMPOUND
Citations