CHEBI:197390 - hexadecan-3-ol

ChEBI IDCHEBI:197390
ChEBI Namehexadecan-3-ol
Stars
DefinitionA secondary fatty alcohol that is hexadecane substituted by a hydroxy group at position 3.
Last Modified29 September 2023
SubmitterAdnan
DownloadsMolfile
FormulaC16H34O
Net Charge0
Average Mass242.447
Monoisotopic Mass242.26097
SMILESCCCCCCCCCCCCCC(O)CC
InChIInChI=1S/C16H34O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16(17)4-2/h16-17H,3-15H2,1-2H3
InChIKeyACDUHTSVVVHMGU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bacillus safensis (ncbitaxon:561879) - PubMed (34076810)
Capsicum annuum (ncbitaxon:4072) - PubMed (32961789)
Roles Classification
Biological Roles:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
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)
hexadecan-3-ol (CHEBI:197390) has role bacterial metabolite (CHEBI:76969)
hexadecan-3-ol (CHEBI:197390) has role plant metabolite (CHEBI:76924)
hexadecan-3-ol (CHEBI:197390) is a hexadecanol (CHEBI:197387)
hexadecan-3-ol (CHEBI:197390) is a secondary fatty alcohol (CHEBI:167095)
IUPAC Name 
hexadecan-3-ol
Synonyms  Source
3-hexadecanolNIST Chemistry WebBook
3-hydroxyhexadecaneChEBI
ethyl n-tridecyl carbinolChEBI
Registry NumbersSources
CAS:593-03-3NIST Chemistry WebBook
Citations