CHEBI:43619 - icosane

ChEBI IDCHEBI:43619
ChEBI Nameicosane
Stars
DefinitionA straight chain alkane composed of 20 carbon atoms. It has been isolated from the leaves of Agave attenuata.
Secondary ChEBI IDsCHEBI:32929, CHEBI:43618
Last Modified23 October 2023
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC20H42
Net Charge0
Average Mass282.556
Monoisotopic Mass282.32865
SMILESCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C20H42/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3
InChIKeyCBFCDTFDPHXCNY-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Agave attenuata (ncbitaxon:39511) - PubMed (22754375)
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)
icosane (CHEBI:43619) has role plant metabolite (CHEBI:76924)
icosane (CHEBI:43619) is a long-chain alkane (CHEBI:83563)
Incoming Relation(s)
2-aminoicosane-1,3-diol (CHEBI:64907) has functional parent icosane (CHEBI:43619)
1,2-icosanediol (CHEBI:84957) has parent hydride icosane (CHEBI:43619)
2-amino-1,3,4,5-icosanetetrol (CHEBI:131749) has parent hydride icosane (CHEBI:43619)
5,7-icosanedione (CHEBI:134475) has parent hydride icosane (CHEBI:43619)
6,8-icosanedione (CHEBI:134474) has parent hydride icosane (CHEBI:43619)
fumonisin (CHEBI:38224) has parent hydride icosane (CHEBI:43619)
icosanedioic acid (CHEBI:73728) has parent hydride icosane (CHEBI:43619)
icosanol (CHEBI:197480) has parent hydride icosane (CHEBI:43619)
arachidyl group (CHEBI:32930) is substituent group from icosane (CHEBI:43619)
IUPAC Name 
icosane
Synonyms  Source
CH3‒[CH2]18‒CH3IUPAC
eicosaneNIST Chemistry WebBook
EICOSANEPDBeChem
n-eicosaneNIST Chemistry WebBook
octyldodecaneChEBI
Manual XrefsDatabases
HMDB0059909HMDB
IcosaneWikipedia
LFAPDBeChem
Registry NumbersSources
Reaxys:1700722Reaxys
Beilstein:1700722Beilstein
CAS:112-95-8NIST Chemistry WebBook
CAS:112-95-8ChemIDplus
Citations