CHEBI:16628 - methylguanidine

ChEBI IDCHEBI:16628
ChEBI Namemethylguanidine
Stars
DefinitionA guanidine in which one of the amino hydrogens of guanidine itself is substituted by a methyl group.
Secondary ChEBI IDsCHEBI:6876, CHEBI:14600, CHEBI:25304, CHEBI:43998
Last Modified25 September 2017
DownloadsMolfile
FormulaC2H7N3
Net Charge0
Average Mass73.099
Monoisotopic Mass73.06400
SMILESCNC(=N)N
InChIInChI=1S/C2H7N3/c1-5-2(3)4/h1H3,(H4,3,4,5)
InChIKeyCHJJGSNFBQVOTG-UHFFFAOYSA-N
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
uremic toxin  A toxin that accumulates in patients with chronic kidney disease.
EC 1.14.13.39 (nitric oxide synthase) inhibitor  An EC 1.14.13.* (oxidoreductase acting on paired donors, incorporating 1 atom of oxygen, with NADH or NADPH as one donor) inhibitor that interferes with the action of nitric oxide synthase (EC 1.14.13.39).
ChEBI Ontology
Outgoing Relation(s)
methylguanidine (CHEBI:16628) has role EC 1.14.13.39 (nitric oxide synthase) inhibitor (CHEBI:61908)
methylguanidine (CHEBI:16628) has role metabolite (CHEBI:25212)
methylguanidine (CHEBI:16628) has role uremic toxin (CHEBI:64584)
methylguanidine (CHEBI:16628) is a guanidines (CHEBI:24436)
methylguanidine (CHEBI:16628) is conjugate base of methylguanidinium (CHEBI:57840)
Incoming Relation(s)
methylguanidinium (CHEBI:57840) is conjugate acid of methylguanidine (CHEBI:16628)
IUPAC Name 
1-methylguanidine
Synonyms  Source
1-METHYLGUANIDINEPDBeChem
N-methylguanidineNIST Chemistry WebBook
MethylguanidinChemIDplus
MethylguanidineKEGG COMPOUND
MGXHMDB
Monomethyl guanidinHMDB
Manual XrefsDatabases
C02294KEGG COMPOUND
CPD-593MetaCyc
HMDB0001522HMDB
MGXPDBeChem
PL391702Patent
Registry NumbersSources
Reaxys:1738993Reaxys
Gmelin:323399Gmelin
CAS:471-29-4ChemIDplus
CAS:471-29-4NIST Chemistry WebBook
CAS:471-29-4KEGG COMPOUND
Citations