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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:87529 - myrcenol
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ChEBI Ontology
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ChEBI Name
myrcenol
ChEBI ID
CHEBI:87529
Definition
A monoterpenoid that is oct-7-en-2-ol substituted by a methyl group at position 2 and a methylidene group at position 6 respectively.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C10H18O
Net Charge
0
Average Mass
154.24930
Monoisotopic Mass
154.13577
InChI
InChI=1S/C10H18O/c1-5-9(2)7-6-8-10(3,4)11/h5,11H,1-2,6-8H2,3-4H3
InChIKey
DUNCVNHORHNONW-UHFFFAOYSA-N
SMILES
CC(C)(O)CCCC(=C)C=C
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application
(s):
fragrance
A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
myrcenol (
CHEBI:87529
)
has role
fragrance (
CHEBI:48318
)
myrcenol (
CHEBI:87529
)
has role
plant metabolite (
CHEBI:76924
)
myrcenol (
CHEBI:87529
)
is a
monoterpenoid (
CHEBI:25409
)
myrcenol (
CHEBI:87529
)
is a
tertiary alcohol (
CHEBI:26878
)
IUPAC Name
2-methyl-6-methylideneoct-7-en-2-ol
Manual Xref
Database
HMDB0036107
HMDB
View more database links
Registry Numbers
Types
Sources
1744474
Reaxys Registry Number
Reaxys
543-39-5
CAS Registry Number
NIST Chemistry WebBook
543-39-5
CAS Registry Number
ChemIDplus
Citations
Types
Sources
18640191
PubMed citation
Europe PMC
24305835
PubMed citation
Europe PMC
25221621
PubMed citation
Europe PMC
Last Modified
18 August 2015