CHEBI:78465 - pentacos-1-ene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name pentacos-1-ene
ChEBI ID CHEBI:78465
Definition An alkene that is pentacosane which has been dehydrogenated to introduce a double bond at the 1-2 position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C25H50
Net Charge 0
Average Mass 350.66450
Monoisotopic Mass 350.39125
InChI InChI=1S/C25H50/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-25H2,2H3
InChIKey BDWBGSCECOPTTH-UHFFFAOYSA-N
SMILES CCCCCCCCCCCCCCCCCCCCCCCC=C
Roles Classification
Biological Role(s): animal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pentacos-1-ene (CHEBI:78465) has parent hydride pentacosane (CHEBI:32938)
pentacos-1-ene (CHEBI:78465) has role animal metabolite (CHEBI:75767)
pentacos-1-ene (CHEBI:78465) is a alkene (CHEBI:32878)
IUPAC Name
pentacos-1-ene
Synonyms Sources
1-pentacosene ChemIDplus
n-C13H27CH=CH2 ChEBI
Manual Xref Database
LMFA11000326 LIPID MAPS
View more database links
Registry Numbers Types Sources
16980-85-1 CAS Registry Number NIST Chemistry WebBook
16980-85-1 CAS Registry Number ChemIDplus
8449362 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
12564805 PubMed citation Europe PMC
Last Modified
08 May 2014