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CHEBI:89713 - 1-dodecene

Default Structure
ChEBI IDCHEBI:89713
ChEBI Name1-dodecene
Stars
DefinitionAn alkene that is dodecane containing one double bond at position 1. It is an intermediate used in the production of lubricants and surfactants.
Last Modified23 February 2021
DownloadsMolfile
FormulaC12H24
Net Charge0
Average Mass168.324
Monoisotopic Mass168.18780
SMILESC=CCCCCCCCCCC
InChIInChI=1S/C12H24/c1-3-5-7-9-11-12-10-8-6-4-2/h3H,1,4-12H2,2H3
InChIKeyCRSBERNSMYQZNG-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Capra hircus (ncbitaxon:9925) urine (BTO:0001419) PubMed (30659685)
Homo sapiens (ncbitaxon:9606) saliva (UBERON:0001836) PubMed (24421258)
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mammalian metabolite  Any animal metabolite produced during a metabolic reaction in mammals.
ChEBI Ontology
Outgoing Relation(s)
1-dodecene (CHEBI:89713) has role human metabolite (CHEBI:77746)
1-dodecene (CHEBI:89713) has role mammalian metabolite (CHEBI:75768)
1-dodecene (CHEBI:89713) is a dodecene (CHEBI:167550)
1-dodecene (CHEBI:89713) is a volatile organic compound (CHEBI:134179)
IUPAC Name 
dodec-1-ene
Synonyms  Source
1-dodeceneChemIDplus
adacene 12ChemIDplus
alpha-dodeceneChemIDplus
alpha-dodecyleneChemIDplus
dodecene-1NIST Chemistry WebBook
n-dodec-1-eneChemIDplus
Manual XrefsDatabases
1-DodeceneWikipedia
7891ChemSpider
FDB005520FooDB
HMDB0059874HMDB
LMFA11000313LIPID MAPS
Registry NumbersSources
Reaxys:1699848Reaxys
CAS:112-41-4ChemIDplus
CAS:112-41-4NIST Chemistry WebBook
Citations