EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:36756 - farnesane

ChEBI IDCHEBI:36756
ChEBI Namefarnesane
Stars
DefinitionA sesquiterpene that is dodecane substituted by methyl groups at positions 2, 6 and 10.
Last Modified4 March 2015
DownloadsMolfile
FormulaC15H32
Net Charge0
Average Mass212.421
Monoisotopic Mass212.25040
SMILESCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C15H32/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h13-15H,6-12H2,1-5H3
InChIKeyYFHFHLSMISYUAQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Centella asiatica (ncbitaxon:48106) - MetaboLights (MTBLS175)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
farnesane (CHEBI:36756) has role plant metabolite (CHEBI:76924)
farnesane (CHEBI:36756) is a alkane (CHEBI:18310)
farnesane (CHEBI:36756) is a sesquiterpene (CHEBI:35189)
Incoming Relation(s)
2,6,10-trimethyldodeca-2,6,10-triene (CHEBI:36534) has parent hydride farnesane (CHEBI:36756)
farnesane sesquiterpenoid (CHEBI:36757) has parent hydride farnesane (CHEBI:36756)
IUPAC Name 
2,6,10-trimethyldodecane
Synonyms  Source
farnesaneNIST Chemistry WebBook
FarnesanNIST Chemistry WebBook
Manual XrefsDatabases
LMPR0103010000LIPID MAPS
CPD-8764MetaCyc
US7399323Patent
US2008098645Patent
Registry NumbersSources
Reaxys:1719672Reaxys
CAS:3891-98-3NIST Chemistry WebBook
CAS:3891-98-3ChemIDplus