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CHEBI:18083 - 1-methyladenine

ChEBI IDCHEBI:18083
ChEBI Name1-methyladenine
Stars
DefinitionAdenine substituted with a methyl group at position N-1.
Secondary ChEBI IDsCHEBI:642, CHEBI:11265, CHEBI:21802
Last Modified13 November 2017
DownloadsMolfile
FormulaC6H7N5
Net Charge0
Average Mass149.157
Monoisotopic Mass149.07015
SMILESCn1cnc2ncnc-2c1N
InChIInChI=1S/C6H7N5/c1-11-3-10-6-4(5(11)7)8-2-9-6/h2-3H,7H2,1H3
InChIKeyHPZMWTNATZPBIH-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
1-methyladenine (CHEBI:18083) has role metabolite (CHEBI:25212)
1-methyladenine (CHEBI:18083) is a methyladenine (CHEBI:25272)
IUPAC Name 
1-methyl-1H-purin-6-amine
Synonyms  Source
1-MethyladenineKEGG COMPOUND
N1-methyladenineChEBI
UniProt Name  Source
1-methyladenineUniProt
Manual XrefsDatabases
C02216KEGG COMPOUND
C02216KEGG COMPOUND
HMDB0011599HMDB
1-METHYLADENINEMetaCyc
Registry NumbersSources
Reaxys:137917Reaxys
CAS:5142-22-3KEGG COMPOUND
CAS:5142-22-3ChemIDplus
Citations