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

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ChEBI Name 2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one
ChEBI ID CHEBI:46894
ChEBI ASCII Name 2-imino-7-methyl-1,2,3,7-tetrahydro-6H-purin-6-one
Definition A 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.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB6473974, eMolecules:3714969, ZINC000008613011
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Formula C6H7N5O
Net Charge 0
Average Mass 165.15288
Monoisotopic Mass 165.06506
InChI InChI=1S/C6H7N5O/c1-11-2-8-4-3(11)5(12)10-6(7)9-4/h2H,1H3,(H3,7,9,10,12)
InChIKey FZWGECJQACGGTI-UHFFFAOYSA-N
SMILES Cn1cnc2[nH]c(=N)[nH]c(=O)c12
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via 7-methylguanine )
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ChEBI Ontology
Outgoing 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 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 Number Type Source
1110391 Reaxys Registry Number Reaxys
Last Modified
14 July 2014