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CHEBI:77798 - melamine(1+)

ChEBI IDCHEBI:77798
ChEBI Namemelamine(1+)
Stars
DefinitionAn organic cation obtained by protonation of one of the three ring nitrogens of melamine. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified19 June 2014
SubmitterAnne Morgat
DownloadsMolfile
FormulaC3H7N6
Net Charge+1
Average Mass127.131
Monoisotopic Mass127.07267
SMILESNc1nc(N)[nH+]c(N)n1
InChIInChI=1S/C3H6N6/c4-1-7-2(5)9-3(6)8-1/h(H6,4,5,6,7,8,9)/p+1
InChIKeyJDSHMPZPIAZGSV-UHFFFAOYSA-O
Roles Classification
Biological Role:
xenobiotic metabolite  Any metabolite produced by metabolism of a xenobiotic compound.
ChEBI Ontology
Outgoing Relation(s)
melamine(1+) (CHEBI:77798) has role xenobiotic metabolite (CHEBI:76206)
melamine(1+) (CHEBI:77798) is a organic cation (CHEBI:25697)
melamine(1+) (CHEBI:77798) is conjugate acid of melamine (CHEBI:27915)
Incoming Relation(s)
melamine (CHEBI:27915) is conjugate base of melamine(1+) (CHEBI:77798)
IUPAC Name 
2,4,6-triamino-1,3,5-triazin-1-ium
UniProt Name  Source
melamineUniProt
Manual XrefsDatabases
CPD-7398MetaCyc