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:76721 - (
E
)-4-oxohex-2-enal
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
(
E
)-4-oxohex-2-enal
ChEBI ID
CHEBI:76721
ChEBI ASCII Name
(E)-4-oxohex-2-enal
Definition
The enal that is (
E
)-hex-2-enal substituted with an oxo group at C-4.
Stars
This entity has been manually annotated by the ChEBI Team.
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
C6H8O2
Net Charge
0
Average Mass
112.12650
Monoisotopic Mass
112.05243
InChI
InChI=1S/C6H8O2/c1-2-6(8)4-3-5-7/h3-5H,2H2,1H3/b4-3+
InChIKey
GVKYFODEMNCLGS-ONEGZZNKSA-N
SMILES
CCC(=O)\C=C\C=O
ChEBI Ontology
Outgoing
(
E
)-4-oxohex-2-enal (
CHEBI:76721
)
is a
enal (
CHEBI:51688
)
(
E
)-4-oxohex-2-enal (
CHEBI:76721
)
is a
enone (
CHEBI:51689
)
IUPAC Name
(2
E
)-4-oxohex-2-enal
Synonyms
Sources
(E)-4-Oxo-2-hexenal
ChemIDplus
OHE
ChEBI
Registry Numbers
Types
Sources
1902532
Reaxys Registry Number
Reaxys
2492-43-5
CAS Registry Number
ChemIDplus
Citation
Type
Source
23543734
PubMed citation
Europe PMC
Last Modified
16 December 2013