EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:62898 - isopentenyl alcohol

ChEBI IDCHEBI:62898
ChEBI Nameisopentenyl alcohol
Stars
DefinitionA primary alcohol having the structure of isopentyl alcohol but with a double bond between C-3 and one of the C-4 atoms.
Last Modified1 March 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC5H10O
Net Charge0
Average Mass86.134
Monoisotopic Mass86.07316
SMILESC=C(C)CCO
InChIInChI=1S/C5H10O/c1-5(2)3-4-6/h6H,1,3-4H2,2H3
InChIKeyCPJRRXSHAYUTGL-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
isopentenyl alcohol (CHEBI:62898) has role metabolite (CHEBI:25212)
isopentenyl alcohol (CHEBI:62898) is a homoallylic alcohol (CHEBI:134362)
isopentenyl alcohol (CHEBI:62898) is a primary alcohol (CHEBI:15734)
Incoming Relation(s)
isopentenyl phosphate (CHEBI:65121) has functional parent isopentenyl alcohol (CHEBI:62898)
isopentenyl-UTP (CHEBI:62897) has functional parent isopentenyl alcohol (CHEBI:62898)
IUPAC Name 
3-methylbut-3-en-1-ol
Synonyms  Source
3-Isopentenyl alcoholChemIDplus
MethallylcarbinolChemIDplus
3-Methyl-3-buten-1-olChemIDplus
Isopropenylethyl alcoholChemIDplus
Δ3-isopentenyl alcoholChEBI
IsoprenolChemIDplus
Manual XrefsDatabases
US4220719Patent
US4205125Patent
KR20070114938Patent
Registry NumbersSources
Reaxys:1071239Reaxys
CAS:763-32-6ChemIDplus