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CHEBI:46894 - 2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one

ChEBI IDCHEBI:46894
ChEBI Name2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one
Stars
ASCII Name2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one
DefinitionA 7-methylguanine that is 1,2,3,7-tetrahydro-6H-purin-6-one substituted by an imino group at position 2 and a methyl group at position 7.
Last Modified14 July 2014
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC6H7N5O
Net Charge0
Average Mass165.156
Monoisotopic Mass165.06506
SMILESCn1cnc2nc(=N)nc(=O)c21
InChIInChI=1S/C6H7N5O/c1-11-2-8-4-3(11)5(12)10-6(7)9-4/h2H,1H3,(H3,7,9,10,12)
InChIKeyFZWGECJQACGGTI-UHFFFAOYSA-N
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one (CHEBI:46894) is a 7-methylguanine (CHEBI:2274)
2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one (CHEBI:46894) is tautomer of 2-amino-7-methyl-1,7-dihydro-6H-purin-6-one (CHEBI:28664)
2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one (CHEBI:46894) is tautomer of 2-amino-7-methyl-7H-purin-6-ol (CHEBI:46897)
Incoming Relation(s)
2-amino-7-methyl-1,7-dihydro-6H-purin-6-one (CHEBI:28664) is tautomer of 2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one (CHEBI:46894)
2-amino-7-methyl-7H-purin-6-ol (CHEBI:46897) is tautomer of 2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one (CHEBI:46894)
IUPAC Name 
2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one
Registry NumbersSources
Reaxys:1110391Reaxys