CHEBI:32938 - pentacosane

ChEBI IDCHEBI:32938
ChEBI Namepentacosane
Stars
DefinitionAn alkane consisting of an unbranched chain of 25 carbon atoms.
Last Modified8 November 2023
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC25H52
Net Charge0
Average Mass352.691
Monoisotopic Mass352.40690
SMILESCCCCCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C25H52/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/h3-25H2,1-2H3
InChIKeyYKNWIILGEFFOPE-UHFFFAOYSA-N
Roles Classification
Biological Roles:
semiochemical  A molecular messenger released by an organism that affects the behaviour within or between species.
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)
pentacosane (CHEBI:32938) has role plant metabolite (CHEBI:76924)
pentacosane (CHEBI:32938) has role semiochemical (CHEBI:26645)
pentacosane (CHEBI:32938) is a long-chain alkane (CHEBI:83563)
Incoming Relation(s)
24-methylpentacosan-1-ol (CHEBI:84917) has parent hydride pentacosane (CHEBI:32938)
pentacos-1-ene (CHEBI:78465) has parent hydride pentacosane (CHEBI:32938)
pentacosanol (CHEBI:228171) has parent hydride pentacosane (CHEBI:32938)
pentacosyl group (CHEBI:32939) is substituent group from pentacosane (CHEBI:32938)
IUPAC Name 
pentacosane
Synonyms  Source
n-pentacosaneNIST Chemistry WebBook
CH3‒[CH2]23‒CH3ChEBI
Manual XrefsDatabases
CPD-7944MetaCyc
LMFA11000582LIPID MAPS
1383BPDB
Registry NumbersSources
Reaxys:1763638Reaxys
CAS:629-99-2ChemIDplus
CAS:629-99-2NIST Chemistry WebBook
Citations