CHEBI:77504 - 1,3,5-octatriene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1,3,5-octatriene
ChEBI ID CHEBI:77504
Definition An unbranched eight-carbon alkatriene with the three double bonds located at positions 1, 3 and 5.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Jen Hammock
Supplier Information
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Formula C8H12
Net Charge 0
Average Mass 108.18090
Monoisotopic Mass 108.09390
InChI InChI=1S/C8H12/c1-3-5-7-8-6-4-2/h3,5-8H,1,4H2,2H3
InChIKey HOXGZVUCAYFWGR-UHFFFAOYSA-N
SMILES CCC=CC=CC=C
ChEBI Ontology
Outgoing 1,3,5-octatriene (CHEBI:77504) is a alkatriene (CHEBI:33647)
IUPAC Name
octa-1,3,5-triene
Registry Number Type Source
1733441 Reaxys Registry Number Reaxys
Last Modified
11 March 2014