ethionamide S-oxide (CHEBI:87805)

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ChEBI Name	ethionamide S-oxide

ChEBI ID	CHEBI:87805

ChEBI ASCII Name	ethionamide S-oxide

Definition	A member of the class of pyridines that is the S-oxide and active metabolite of the antitubercular drug ethionamide.

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

Submitter	Anne Morgat

Supplier Information

Download	Molfile XML SDF

Formula

C8H10N2OS

Net Charge

Average Mass

182.244

Monoisotopic Mass

182.05138

InChI

InChI=1S/C8H10N2OS/c1-2-7-5-6(3-4-10-7)8(9)12-11/h3-5H,2,9H2,1H3

InChIKey

QDQQNGZRIJPDGA-UHFFFAOYSA-N

SMILES

C1=C(C=C(N=C1)CC)C(=S=O)N

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	See: PubMed

Roles Classification
Biological Role(s):	human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. antitubercular agent A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis. fatty acid synthesis inhibitor Any pathway inhibitor that inhibits the synthesis of fatty acids. leprostatic drug A substance that suppresses Mycobacterium leprae, ameliorates the clinical manifestations of leprosy, and/or reduces the incidence and severity of leprous reactions.

Application(s):	antilipemic drug A substance used to treat hyperlipidemia (an excess of lipids in the blood). antitubercular agent A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis. leprostatic drug A substance that suppresses Mycobacterium leprae, ameliorates the clinical manifestations of leprosy, and/or reduces the incidence and severity of leprous reactions.

ChEBI Ontology
Outgoing	ethionamide S-oxide (CHEBI:87805) has functional parent ethionamide (CHEBI:4885) ethionamide S-oxide (CHEBI:87805) has role antilipemic drug (CHEBI:35679) ethionamide S-oxide (CHEBI:87805) has role antitubercular agent (CHEBI:33231) ethionamide S-oxide (CHEBI:87805) has role fatty acid synthesis inhibitor (CHEBI:50185) ethionamide S-oxide (CHEBI:87805) has role human xenobiotic metabolite (CHEBI:76967) ethionamide S-oxide (CHEBI:87805) has role leprostatic drug (CHEBI:35816) ethionamide S-oxide (CHEBI:87805) is a pyridines (CHEBI:26421)

IUPAC Name

1-(2-ethylpyridin-4-yl)-1-(oxo-λ⁴-sulfanylidene)methanamine

Registry Number	Type	Source
472920	Reaxys Registry Number	Reaxys

Last Modified

23 September 2015