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CHEBI:82334 - (E,E)-2,4-hexadienal

ChEBI IDCHEBI:82334
ChEBI Name(E,E)-2,4-hexadienal
Stars
ASCII Name(E,E)-2,4-hexadienal
DefinitionA hexadienal that is hexanal with trans double bonds at positions 2 and 4. It is found in tomatoes, kiwi fruit, mangoes, potato chips, herbs and spices.
Last Modified28 November 2018
DownloadsMolfile
FormulaC6H8O
Net Charge0
Average Mass96.129
Monoisotopic Mass96.05751
SMILES[H]C(=O)/C=C/C=C/C
InChIInChI=1S/C6H8O/c1-2-3-4-5-6-7/h2-6H,1H3/b3-2+,5-4+
InChIKeyBATOPAZDIZEVQF-MQQKCMAXSA-N
Species of MetaboliteComponentSourceComments
Solanum lycopersicum (ncbitaxon:4081) leaf (BTO:0000713) PubMed (14732275)
Cucumis sativus (ncbitaxon:3659) leaf (BTO:0000713) PubMed (27827841)
Camellia sinensis (ncbitaxon:4442) - Article (Wang et al (2011) Comparison of catechins and volatile compounds among different types of tea using high performance liquid chromatograph and gas chromatograph mass spectrometer International journal of food science & technology. 46, 1406-1412.) Detected in black tea.
Fagopyrum esculentum (ncbitaxon:3617) - Article (Damjan, J. et al (2010) Aroma Compounds in Buckwheat (Fagopyrum esculentum Moench) Groats, Flour, Bran, and Husk. Cereal chemistry. 87, 141-143.)
Roles Classification
Biological Roles:
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application:
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
ChEBI Ontology
Outgoing Relation(s)
(E,E)-2,4-hexadienal (CHEBI:82334) has role flavouring agent (CHEBI:35617)
(E,E)-2,4-hexadienal (CHEBI:82334) has role plant metabolite (CHEBI:76924)
(E,E)-2,4-hexadienal (CHEBI:82334) is a hexadienal (CHEBI:24551)
(E,E)-2,4-hexadienal (CHEBI:82334) is a polyunsaturated fatty aldehyde (CHEBI:72692)
(E,E)-2,4-hexadienal (CHEBI:82334) is a volatile organic compound (CHEBI:134179)
IUPAC Name 
(2E,4E)-hexa-2,4-dienal
Synonyms  Source
trans,trans-2,4-hexadienalChEBI
sorbic aldehydeChemIDplus
sorbaldehydeChemIDplus
(2E,4E)-hexa-2,4-dienalChEBI
trans,trans-hexa-2,4-dienalChEBI
(E,E)-2,4-hexadien-1-alChEBI
UniProt Name  Source
(E,E)-2,4-hexadienalUniProt
Manual XrefsDatabases
C19249KEGG COMPOUND
FDB013267FooDB
LMFA06000006LIPID MAPS
C00035881KNApSAcK
HMDB0034729HMDB
Registry NumbersSources
Beilstein:1698401Beilstein
CAS:142-83-6KEGG COMPOUND
CAS:142-83-6NIST Chemistry WebBook
CAS:142-83-6ChemIDplus
Citations