CHEBI:87416 - 4-butyl-γ-butyrolactone

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ChEBI Name 4-butyl-γ-butyrolactone
ChEBI ID CHEBI:87416
ChEBI ASCII Name 4-butyl-gamma-butyrolactone
Definition A butan-4-olide that is γ-butyrolactone substituted by a butyl group at position 4.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C8H14O2
Net Charge 0
Average Mass 142.19560
Monoisotopic Mass 142.09938
InChI InChI=1S/C8H14O2/c1-2-3-4-7-5-8(9)10-6-7/h7H,2-6H2,1H3
InChIKey WJPRNDJHASWDLE-UHFFFAOYSA-N
SMILES CCCCC1COC(=O)C1
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing 4-butyl-γ-butyrolactone (CHEBI:87416) has functional parent γ-butyrolactone (CHEBI:42639)
4-butyl-γ-butyrolactone (CHEBI:87416) has role metabolite (CHEBI:25212)
4-butyl-γ-butyrolactone (CHEBI:87416) is a butan-4-olide (CHEBI:22950)
IUPAC Name
4-butyloxolan-2-one
Synonyms Sources
4-butyldihydrofuran-2(3H)-one ChEBI
4-octanolide ChEBI
Registry Number Type Source
1562185 Reaxys Registry Number Reaxys
Last Modified
28 August 2015