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

Feedback

methyl isocyanate

	Properties	Image
MNX_ID	MNXM61764
reference	chebi:59059
formula	C₂H₃NO
global charge	0
mol weight	57.052
InChIKey	HAMGRBXTJNITHG-UHFFFAOYSA-N
InChI	InChI=1S/C2H3NO/c1-3-2-4/h1H3
SMILES	CN=C=O

MNX internals

InChI (mnx)	InChI=1/C2H3NO/c1-3-2-4/h1H3
SMILES (mnx)	[CH3:1][N:3]=[C:2]=[O:4]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	2

Similar chemical compounds in external resources
Identifier	Description
CHEBI:59059 chebi:59059 HAMGRBXTJNITHG-UHFFFAOYSA-N	methyl isocyanate Iso-cyanatomethane Isocyanate de methyle MIC Methyl carbonimide Methyl isocyanide Methylcarbylamine isocyanatomethane
kegg.compound:C22645 keggC:C22645 HAMGRBXTJNITHG-UHFFFAOYSA-N	Methyl isocyanate
hmdb:HMDB0254594 HAMGRBXTJNITHG-UHFFFAOYSA-N	Methyl isocyanate Iso-cyanatomethane Isocyanate de methyle Isocyanatomethane Isocyanic acid de methyle MIC Methyl carbonimide Methyl isocyanic acid Methyl isocyanide Methylcarbylamine Methylisocyanate isocyanatomethane methyl isocyanate
metacyc.compound:CPD-18305 metacycM:CPD-18305 seed.compound:cpd33261 seedM:cpd33261 HAMGRBXTJNITHG-UHFFFAOYSA-N	methyl isocyanate
keggC:M_C22645 seedM:M_cpd33261	secondary/obsolete/fantasy identifier