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CHEBI:16731 - (E)-cinnamaldehyde

Default Structure
ChEBI IDCHEBI:16731
ChEBI Name(E)-cinnamaldehyde
Stars
ASCII Name(E)-cinnamaldehyde
DefinitionThe E (trans) stereoisomer of cinnamaldehyde, the parent of the class of cinnamaldehydes.
Secondary ChEBI IDsCHEBI:3709, CHEBI:13994, CHEBI:23244, CHEBI:181858
Last Modified16 January 2019
DownloadsMolfile
FormulaC9H8O
Net Charge0
Average Mass132.162
Monoisotopic Mass132.05751
SMILESO=C/C=C/c1ccccc1
InChIInChI=1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+
InChIKeyKJPRLNWUNMBNBZ-QPJJXVBHSA-N
Wikipedia
Roles Classification
Chemical Role:
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
Biological Roles:
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
EC 4.3.1.24 (phenylalanine ammonia-lyase) inhibitor  An EC 4.3.* (C‒N lyase) inhibitor that interferes with the action of phenylalanine ammonia-lyase (EC 4.3.1.24).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
sensitiser  A chemical compound that causes a substantial proportion of exposed people or animals to develop an allergic reaction in normal tissue after repeated exposure to the compound.
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
Applications:
hypoglycemic agent  A drug which lowers the blood glucose level.
vasodilator agent  A drug used to cause dilation of the blood vessels.
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
ChEBI Ontology
Outgoing Relation(s)
(E)-cinnamaldehyde (CHEBI:16731) has role antifungal agent (CHEBI:35718)
(E)-cinnamaldehyde (CHEBI:16731) has role EC 4.3.1.24 (phenylalanine ammonia-lyase) inhibitor (CHEBI:62871)
(E)-cinnamaldehyde (CHEBI:16731) has role flavouring agent (CHEBI:35617)
(E)-cinnamaldehyde (CHEBI:16731) has role hypoglycemic agent (CHEBI:35526)
(E)-cinnamaldehyde (CHEBI:16731) has role plant metabolite (CHEBI:76924)
(E)-cinnamaldehyde (CHEBI:16731) has role sensitiser (CHEBI:139492)
(E)-cinnamaldehyde (CHEBI:16731) has role vasodilator agent (CHEBI:35620)
(E)-cinnamaldehyde (CHEBI:16731) is a 3-phenylprop-2-enal (CHEBI:142921)
(E)-cinnamaldehyde (CHEBI:16731) is a cinnamaldehydes (CHEBI:23245)
Incoming Relation(s)
(E)-sinapaldehyde (CHEBI:27949) has functional parent (E)-cinnamaldehyde (CHEBI:16731)
3,4-dimethoxy cinnamaldehyde (CHEBI:86548) has functional parent (E)-cinnamaldehyde (CHEBI:16731)
4-acetoxy-3-methoxy-trans-cinnamaldehyde (CHEBI:86579) has functional parent (E)-cinnamaldehyde (CHEBI:16731)
4-hydroxycinnamaldehyde (CHEBI:28353) has functional parent (E)-cinnamaldehyde (CHEBI:16731)
4-methoxymagnaldehyde B (CHEBI:66705) has functional parent (E)-cinnamaldehyde (CHEBI:16731)
coniferyl aldehyde (CHEBI:16547) has functional parent (E)-cinnamaldehyde (CHEBI:16731)
α-hexylcinnamaldehyde (CHEBI:55365) has functional parent (E)-cinnamaldehyde (CHEBI:16731)
IUPAC Name 
(3E)-3-phenylprop-2-enal
Synonyms  Source
3-phenylacrylaldehydeChEBI
CinnamaldehydeKEGG COMPOUND
(E)-3-Phenyl-2-propenalChemIDplus
(E)-3-Phenyl-propenalChEMBL
(E)-3-PhenylpropenalChemIDplus
(E)-CinnamaldehydeChemIDplus
UniProt Name  Source
(E)-cinnamaldehydeUniProt
Manual XrefsDatabases
1069BPDB
C00002725KNApSAcK
C00035187KNApSAcK
C00903KEGG COMPOUND
C00903KEGG COMPOUND
CinnamaldehydeWikipedia
HMDB0003441HMDB
Registry NumbersSources
Reaxys:1071571Reaxys
CAS:14371-10-9NIST Chemistry WebBook
CAS:14371-10-9ChemIDplus
Citations