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CHEBI:87515 - 4-penten-1-yl acetate

ChEBI IDCHEBI:87515
ChEBI Name4-penten-1-yl acetate
Stars
DefinitionAn acetate ester of pent-4-en-1-ol.
Last Modified17 August 2015
Submitternamrata
DownloadsMolfile
FormulaC7H12O2
Net Charge0
Average Mass128.171
Monoisotopic Mass128.08373
SMILESC=CCCCOC(C)=O
InChIInChI=1S/C7H12O2/c1-3-4-5-6-9-7(2)8/h3H,1,4-6H2,2H3
InChIKeyLVHDNIMNOMRZMF-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)
4-penten-1-yl acetate (CHEBI:87515) has role metabolite (CHEBI:25212)
4-penten-1-yl acetate (CHEBI:87515) is a acetate ester (CHEBI:47622)
IUPAC Name 
pent-4-en-1-yl acetate
Synonym  Source
5-acetoxy-1-penteneChEBI
Registry NumbersSources
Reaxys:1747236Reaxys
CAS:1576-85-8ChemIDplus
CAS:1576-85-8NIST Chemistry WebBook