EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:87529 - myrcenol

ChEBI IDCHEBI:87529
ChEBI Namemyrcenol
Stars
DefinitionA monoterpenoid that is oct-7-en-2-ol substituted by a methyl group at position 2 and a methylidene group at position 6 respectively.
Last Modified18 August 2015
Submitternamrata
DownloadsMolfile
FormulaC10H18O
Net Charge0
Average Mass154.253
Monoisotopic Mass154.13577
SMILESC=CC(=C)CCCC(C)(C)O
InChIInChI=1S/C10H18O/c1-5-9(2)7-6-8-10(3,4)11/h5,11H,1-2,6-8H2,3-4H3
InChIKeyDUNCVNHORHNONW-UHFFFAOYSA-N
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.
Application:
fragrance  A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.
ChEBI Ontology
Outgoing Relation(s)
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 XrefsDatabases
HMDB0036107HMDB
Registry NumbersSources
Reaxys:1744474Reaxys
CAS:543-39-5ChemIDplus
CAS:543-39-5NIST Chemistry WebBook
Citations