CHEBI:4885 - ethionamide

ChEBI IDCHEBI:4885
ChEBI Nameethionamide
Stars
DefinitionA thiocarboxamide that is pyridine-4-carbothioamide substituted by an ethyl group at position 2. A prodrug that undergoes metabolic activation by conversion to the corresponding S-oxide.
Last Modified22 February 2017
DownloadsMolfile
FormulaC8H10N2S
Net Charge0
Average Mass166.249
Monoisotopic Mass166.05647
SMILESCCc1cc(C(N)=S)ccn1
InChIInChI=1S/C8H10N2S/c1-2-7-5-6(8(9)11)3-4-10-7/h3-5H,2H2,1H3,(H2,9,11)
InChIKeyAEOCXXJPGCBFJA-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
leprostatic drug  A substance that suppresses Mycobacterium leprae, ameliorates the clinical manifestations of leprosy, and/or reduces the incidence and severity of leprous reactions.
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.
Applications:
leprostatic drug  A substance that suppresses Mycobacterium leprae, ameliorates the clinical manifestations of leprosy, and/or reduces the incidence and severity of leprous reactions.
antitubercular agent  A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis.
prodrug  A compound that, on administration, must undergo chemical conversion by metabolic processes before becoming the pharmacologically active drug for which it is a prodrug.
antilipemic drug  A substance used to treat hyperlipidemia (an excess of lipids in the blood).
ChEBI Ontology
Outgoing Relation(s)
ethionamide (CHEBI:4885) has role antilipemic drug (CHEBI:35679)
ethionamide (CHEBI:4885) has role antitubercular agent (CHEBI:33231)
ethionamide (CHEBI:4885) has role fatty acid synthesis inhibitor (CHEBI:50185)
ethionamide (CHEBI:4885) has role leprostatic drug (CHEBI:35816)
ethionamide (CHEBI:4885) has role prodrug (CHEBI:50266)
ethionamide (CHEBI:4885) is a pyridines (CHEBI:26421)
ethionamide (CHEBI:4885) is a thiocarboxamide (CHEBI:47956)
Incoming Relation(s)
ethionamide S-oxide (CHEBI:87805) has functional parent ethionamide (CHEBI:4885)
IUPAC Name 
2-ethylpyridine-4-carbothioamide
INNs  Source
ethionamidumChemIDplus
etionamidaChemIDplus
Synonyms  Source
2-ethyl-4-thiopyridylamideChEBI
ETHDrugBank
EthinamideDrugBank
EthionamideKEGG COMPOUND
EthioniamideDrugBank
EthylisothiamideDrugBank
Brand Name  Source
TrecatorChemIDplus
UniProt Name  Source
ethionamideUniProt
Manual XrefsDatabases
1083DrugCentral
C07665KEGG COMPOUND
D00591KEGG DRUG
DB00609DrugBank
EthionamideWikipedia
GB800250Patent
HMDB0014747HMDB
LSM-5620LINCS
Registry NumbersSources
Reaxys:116474Reaxys
CAS:536-33-4NIST Chemistry WebBook
CAS:536-33-4KEGG COMPOUND
CAS:536-33-4ChemIDplus
Citations