Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:28913 - (2
E
)-hexenal
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
(2
E
)-hexenal
ChEBI ID
CHEBI:28913
ChEBI ASCII Name
(2E)-hexenal
Definition
A 2-hexenal in which the olefinic double bond has
E
configuration. It occurs naturally in a wide range of fruits, vegetables, and spices.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:18539, CHEBI:6399
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C6H10O
Net Charge
0
Average Mass
98.143
Monoisotopic Mass
98.07316
InChI
InChI=1S/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3/b5-4+
InChIKey
MBDOYVRWFFCFHM-SNAWJCMRSA-N
SMILES
C(\CCC)=C/C=O
Roles Classification
Biological Role
(s):
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
antibacterial agent
A substance (or active part thereof) that kills or slows the growth of bacteria.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application
(s):
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(2
E
)-hexenal (
CHEBI:28913
)
has role
antibacterial agent (
CHEBI:33282
)
(2
E
)-hexenal (
CHEBI:28913
)
has role
flavouring agent (
CHEBI:35617
)
(2
E
)-hexenal (
CHEBI:28913
)
has role
plant metabolite (
CHEBI:76924
)
(2
E
)-hexenal (
CHEBI:28913
)
is a
2-hexenal (
CHEBI:19591
)
IUPAC Name
(2
E
)-hex-2-enal
Synonyms
Sources
(
E
)-2-hexenal
ChEBI
(E)-2-Hexenal
KEGG COMPOUND
(
E
)-hex-2-enal
UniProt
(
E
)-hex-2-enal
ChEBI
2-Hexenal, (2E)-
KEGG COMPOUND
2-
trans
-hexenal
ChemIDplus
3-Propylacrolein
HMDB
β-propyl acrolein
ChemIDplus
β-propylacrolein
ChemIDplus
Leaf aldehyde
KEGG COMPOUND
trans
-2-hexenal
ChemIDplus
Manual Xref
Database
C08497
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
1699684
Reaxys Registry Number
Reaxys
6728-26-3
CAS Registry Number
KEGG COMPOUND
6728-26-3
CAS Registry Number
ChemIDplus
Citations
Types
Sources
21548650
PubMed citation
Europe PMC
22177713
PubMed citation
Europe PMC
22417509
PubMed citation
Europe PMC
22420267
PubMed citation
Europe PMC
22978292
PubMed citation
Europe PMC
23047086
PubMed citation
Europe PMC
23865451
PubMed citation
Europe PMC
25842326
PubMed citation
Europe PMC
26170398
PubMed citation
Europe PMC
26475511
PubMed citation
Europe PMC
26711914
PubMed citation
Europe PMC
27031425
PubMed citation
Europe PMC
27129773
PubMed citation
Europe PMC
27414986
PubMed citation
Europe PMC
27434044
PubMed citation
Europe PMC
IND500593635
Agricola citation
Europe PMC
Last Modified
23 March 2022