2-methylthiolan-3-one (CHEBI:87506)

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ChEBI Name	2-methylthiolan-3-one

ChEBI ID	CHEBI:87506

Definition	A member of the class of tetrahydrothiophenes that is thiolane substituted by a methyl group at position 2 and an oxo group at position 3 respectively.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C5H8OS

Net Charge

Average Mass

116.18100

Monoisotopic Mass

116.02959

InChI

InChI=1S/C5H8OS/c1-4-5(6)2-3-7-4/h4H,2-3H2,1H3

InChIKey

YMZZPMVKABUEBL-UHFFFAOYSA-N

SMILES

CC1SCCC1=O

Roles Classification
Biological Role(s):	flavouring agent A food additive that is used to added improve the taste or odour of a food. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

Application(s):	flavouring agent A food additive that is used to added improve the taste or odour of a food.

ChEBI Ontology
Outgoing	2-methylthiolan-3-one (CHEBI:87506) has parent hydride tetrahydrothiophene (CHEBI:48458) 2-methylthiolan-3-one (CHEBI:87506) has role flavouring agent (CHEBI:35617) 2-methylthiolan-3-one (CHEBI:87506) has role metabolite (CHEBI:25212) 2-methylthiolan-3-one (CHEBI:87506) is a cyclic ketone (CHEBI:3992) 2-methylthiolan-3-one (CHEBI:87506) is a tetrahydrothiophenes (CHEBI:48224)

IUPAC Name

2-methylthiolan-3-one

Synonym	Source
2-methyltetrahydrothiophen-3-one	ChEBI

Last Modified

17 August 2015