CHEBI:187684 - 2,4-Dimethyl-2E,4E-hexadienal

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2,4-Dimethyl-2E,4E-hexadienal
ChEBI ID CHEBI:187684
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C8H12O
Net Charge 0
Average Mass 124.183
Monoisotopic Mass 124.08882
InChI InChI=1S/C8H12O/c1-4-7(2)5-8(3)6-9/h4-6H,1-3H3/b7-4+,8-5+
InChIKey JLRXGFYYIORWGF-NSLJXJERSA-N
SMILES O=C\C(=C\C(\C)=C\C)\C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing 2,4-Dimethyl-2E,4E-hexadienal (CHEBI:187684) is a polyunsaturated fatty aldehyde (CHEBI:72692)
IUPAC Name
(2E,4E)-2,4-dimethylhexa-2,4-dienal
Manual Xrefs Databases
9507405 ChemSpider
LMFA06000121 LIPID MAPS
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Last Modified
07 June 2024