CHEBI:87373 - pentyl propanoate

ChEBI IDCHEBI:87373
ChEBI Namepentyl propanoate
Stars
DefinitionA propanoate ester of pentan-1-ol.
Last Modified4 September 2017
Submitternamrata
DownloadsMolfile
FormulaC8H16O2
Net Charge0
Average Mass144.214
Monoisotopic Mass144.11503
SMILESCCCCCOC(=O)CC
InChIInChI=1S/C8H16O2/c1-3-5-6-7-10-8(9)4-2/h3-7H2,1-2H3
InChIKeyTWSRVQVEYJNFKQ-UHFFFAOYSA-N
Roles Classification
Biological Role:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
pentyl propanoate (CHEBI:87373) has functional parent pentan-1-ol (CHEBI:44884)
pentyl propanoate (CHEBI:87373) has role fungal metabolite (CHEBI:76946)
pentyl propanoate (CHEBI:87373) is a propanoate ester (CHEBI:36243)
IUPAC Name 
pentyl propanoate
Synonyms  Source
amyl propionateChEBI
propionic acid pentyl esterChEBI
n-pentyl propionateChEBI
UniProt Name  Source
pentyl propanoateUniProt
Registry NumbersSources
Reaxys:1747102Reaxys
CAS:624-54-4ChemIDplus
CAS:624-54-4NIST Chemistry WebBook
Citations