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CHEBI:6030 - isoniazide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name isoniazide
ChEBI ID CHEBI:6030
Definition A carbohydrazide obtained by formal condensation between pyridine-4-carboxylic acid and hydrazine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H7N3O
Net Charge 0
Average Mass 137.13930
Monoisotopic Mass 137.059
InChI InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)
InChIKey QRXWMOHMRWLFEY-UHFFFAOYSA-N
SMILES NNC(=O)c1ccncc1
Roles Classification
Biological Role(s): drug allergen
Any drug which causes the onset of an allergic reaction.
antitubercular agent
A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis.
Application(s): drug allergen
Any drug which causes the onset of an allergic reaction.
antitubercular agent
A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing isoniazide (CHEBI:6030) has functional parent isonicotinic acid (CHEBI:6032)
isoniazide (CHEBI:6030) has role antitubercular agent (CHEBI:33231)
isoniazide (CHEBI:6030) has role drug allergen (CHEBI:88188)
isoniazide (CHEBI:6030) is a carbohydrazide (CHEBI:35363)
Incoming N'-acetylisoniazid (CHEBI:7207) has functional parent isoniazide (CHEBI:6030)
IUPAC Name
pyridine-4-carbohydrazide
Synonyms Sources
4-pyridinecarbohydrazide ChEBI
Isoniazid KEGG COMPOUND
isonicotinic acid hydrazide NIST Chemistry WebBook
isonicotinic hydrazide ChEBI
isonicotinohydrazide NIST Chemistry WebBook
isonicotinoylhydrazide IUPAC
Isonicotinsäurehydrazid ChEBI
pyridine-4-carboxylic acid hydrazide ChEBI
Database Links Databases
C07054 KEGG COMPOUND
D00346 KEGG DRUG
DB00951 DrugBank
Isoniazid Wikipedia
ISONIAZIDE MetaCyc
LSM-6682 LINCS
View more database links
Registry Numbers Types Sources
119374 Beilstein Registry Number Beilstein
119374 Reaxys Registry Number Reaxys
54-85-3 CAS Registry Number KEGG COMPOUND
54-85-3 CAS Registry Number ChemIDplus
54-85-3 CAS Registry Number NIST Chemistry WebBook
82804 Gmelin Registry Number Gmelin
Citations Waiting for Citations Types Sources
15013786 PubMed citation Europe PMC
18220565 PubMed citation Europe PMC
19183459 PubMed citation Europe PMC
445303 PubMed citation Europe PMC
Last Modified
25 February 2016