MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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isoniazid

	Properties	Image
MNX_ID	MNXM4018
reference	chebi:6030
formula	C₆H₇N₃O
global charge	0
mol weight	137.142
InChIKey	QRXWMOHMRWLFEY-UHFFFAOYSA-N
InChI	InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)
SMILES	NNC(=O)C1=CC=NC=C1

MNX internals

InChI (mnx)	InChI=1/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)
SMILES (mnx)	[CH:1]1=[CH:3][N:8]=[CH:4][CH:2]=[C:5]1[C:6]([NH:9][NH2:7])=[O:10]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	9
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-159316 reactomeM:R-ALL-159316 CHEBI:6030 chebi:6030 QRXWMOHMRWLFEY-UHFFFAOYSA-N	isoniazid 4-pyridinecarbohydrazide Isoniazid Isonicotinsaeurehydrazid isoniazide isonicotinic acid hydrazide isonicotinic hydrazide isonicotinohydrazide isonicotinoylhydrazide pyridine-4-carbohydrazide pyridine-4-carboxylic acid hydrazide
envipath:...8795f4db1551 envipathM:...8795f4db1551 kegg.compound:C07054 keggC:C07054 vmhM:isnzd vmhmetabolite:isnzd QRXWMOHMRWLFEY-UHFFFAOYSA-N	Isoniazid
kegg.drug:D00346 keggD:D00346 QRXWMOHMRWLFEY-UHFFFAOYSA-N	Isoniazid (JP18/USP/INN) Laniazid (TN)
hmdb:HMDB0015086 QRXWMOHMRWLFEY-UHFFFAOYSA-N	Isoniazid 4-Pyridinecarbohydrazide Acid vanillylidenehydrazide, isonicotinic Ftivazide HIA Hydrazid Hydrazide Hydrazide, isonicotinic acid INH Isohydrazide Isonex Isonicotinate hydrazide Isonicotinhydrazid Isonicotinic acid hydrazide Isonicotinic acid vanillylidenehydrazide Isonicotinic hydrazide Isonicotinohydrazide Isonicotinoyl hydrazide Isonicotinoylhydrazide Isonicotinsaeurehydrazid Isonicotinyl hydrazide Isonicotinyl hydrazine Isonicotinylhydrazine Laniazid Phthivazid Phthivazide Pyridine-4-carboxylate hydrazide Pyridine-4-carboxylic acid hydrazide Tubazide Vanillylidenehydrazide, isonicotinic acid isoniazid pyridine-4-carbohydrazide
seed.compound:cpd04344 seedM:cpd04344 QRXWMOHMRWLFEY-UHFFFAOYSA-N	Isoniazid INH isoniazid isoniazide isonicotinate hydrazide isonicotinic acid hydrazide isonicotinylhydrazide
sabiork.compound:9172 sabiorkM:9172 QRXWMOHMRWLFEY-UHFFFAOYSA-N	Isoniazid Isonicotinic acid hydrazide
metacyc.compound:ISONIAZIDE metacycM:ISONIAZIDE QRXWMOHMRWLFEY-UHFFFAOYSA-N	isoniazid INH isoniazide isonicotinate hydrazide isonicotinic acid hydrazide isonicotinylhydrazide
hmdb:HMDB15086 keggC:M_C07054 keggD:M_D00346 seedM:M_cpd04344 vmhM:M_isnzd	secondary/obsolete/fantasy identifier