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CHEBI:87327 - 6-pentyloxan-2-one

ChEBI IDCHEBI:87327
ChEBI Name6-pentyloxan-2-one
Stars
DefinitionA δ-lactone that is 5-valerolactone substituted by a pentyl group at position 6.
Last Modified2 September 2015
Submitternamrata
DownloadsMolfile
FormulaC10H18O2
Net Charge0
Average Mass170.252
Monoisotopic Mass170.13068
SMILESCCCCCC1CCCC(=O)O1
InChIInChI=1S/C10H18O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h9H,2-8H2,1H3
InChIKeyGHBSPIPJMLAMEP-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)
6-pentyloxan-2-one (CHEBI:87327) has functional parent 5-valerolactone (CHEBI:16545)
6-pentyloxan-2-one (CHEBI:87327) has role metabolite (CHEBI:25212)
6-pentyloxan-2-one (CHEBI:87327) is a δ-lactone (CHEBI:18946)
IUPAC Name 
6-pentyloxan-2-one
Synonyms  Source
6-Pentyltetrahydro-2H-pyran-2-oneChEBI
6-pentylvalerolactoneChEBI
5-hydroxydecanoic acid δ-lactoneChEBI
5-decanolideChEBI
δ-amylvalerolactoneNIST Chemistry WebBook
δ-decalactoneChemIDplus
Registry NumbersSources
Reaxys:4662460Reaxys
CAS:705-86-2ChemIDplus
CAS:705-86-2NIST Chemistry WebBook