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CHEBI:38635 - 3-methyladenine

ChEBI IDCHEBI:38635
ChEBI Name3-methyladenine
Stars
DefinitionA methyladenine that is adenine substituted with a methyl group at position N-3.
Secondary ChEBI IDsCHEBI:1590, CHEBI:21828, CHEBI:40596
Last Modified25 February 2016
DownloadsMolfile
FormulaC6H7N5
Net Charge0
Average Mass149.157
Monoisotopic Mass149.07015
SMILESCn1cnc(N)c2ncnc1-2
InChIInChI=1S/C6H7N5/c1-11-3-10-5(7)4-6(11)9-2-8-4/h2-3H,7H2,1H3
InChIKeyFSASIHFSFGAIJM-UHFFFAOYSA-N
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
autophagy inhibitor  Any compound that inhibits the process of autophagy (the self-digestion of one or more components of a cell through the action of enzymes originating within the same cell).
ChEBI Ontology
Outgoing Relation(s)
3-methyladenine (CHEBI:38635) has role autophagy inhibitor (CHEBI:88230)
3-methyladenine (CHEBI:38635) has role human metabolite (CHEBI:77746)
3-methyladenine (CHEBI:38635) is a methyladenine (CHEBI:25272)
IUPAC Names 
3-methyl-3H-purin-6-amine
3-methyladenine
Synonyms  Source
3-MethyladenineKEGG COMPOUND
3-METHYL-3H-PURIN-6-YLAMINEPDBeChem
3-methyl-3H-adenineChemIDplus
6-amino-3-methylpurineNIST Chemistry WebBook
Manual XrefsDatabases
C00913KEGG COMPOUND
ADKPDBeChem
DB04104DrugBank
HMDB0011600HMDB
3-Methyl-AdeninesMetaCyc
LSM-4733LINCS
Registry NumbersSources
Gmelin:279109Gmelin
Reaxys:146087Reaxys
Reaxys:6503822Reaxys
CAS:5142-23-4KEGG COMPOUND
CAS:5142-23-4ChemIDplus
CAS:5142-23-4NIST Chemistry WebBook
CAS:5142-23-4ChemIDplus
Citations