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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:197390 - hexadecan-3-ol
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ChEBI Ontology
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ChEBI Name
hexadecan-3-ol
ChEBI ID
CHEBI:197390
Definition
A secondary fatty alcohol that is hexadecane substituted by a hydroxy group at position 3.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C16H34O
Net Charge
0
Average Mass
242.447
Monoisotopic Mass
242.26097
InChI
InChI=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
InChIKey
ACDUHTSVVVHMGU-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCCC(O)CC
Metabolite of Species
Details
Capsicum annuum
(NCBI:txid4072)
See:
PubMed
Bacillus safensis
(NCBI:txid561879)
See:
PubMed
Roles Classification
Biological Role
(s):
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
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
Sources
3-hexadecanol
NIST Chemistry WebBook
3-hydroxyhexadecane
ChEBI
ethyl
n
-tridecyl carbinol
ChEBI
Registry Number
Type
Source
593-03-3
CAS Registry Number
NIST Chemistry WebBook
Citations
Types
Sources
16952239
PubMed citation
Europe PMC
32961789
PubMed citation
Europe PMC
34076810
PubMed citation
Europe PMC
5785950
PubMed citation
Europe PMC
Last Modified
29 September 2023