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CHEBI:39624 - 1-methylcytosine

ChEBI IDCHEBI:39624
ChEBI Name1-methylcytosine
Stars
DefinitionA pyrimidone that is cytosine in which the hydrogen attached to the nitrogen at position 1 is substituted by a methyl group.
Last Modified15 February 2018
DownloadsMolfile
FormulaC5H7N3O
Net Charge0
Average Mass125.131
Monoisotopic Mass125.05891
SMILESCn1ccc(N)nc1=O
InChIInChI=1S/C5H7N3O/c1-8-3-2-4(6)7-5(8)9/h2-3H,1H3,(H2,6,7,9)
InChIKeyHWPZZUQOWRWFDB-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
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-methylcytosine (CHEBI:39624) has functional parent cytosine (CHEBI:16040)
1-methylcytosine (CHEBI:39624) has role metabolite (CHEBI:25212)
1-methylcytosine (CHEBI:39624) is a aminopyrimidine (CHEBI:38338)
1-methylcytosine (CHEBI:39624) is a methylcytosine (CHEBI:134207)
1-methylcytosine (CHEBI:39624) is a pyrimidone (CHEBI:38337)
IUPAC Name 
4-amino-1-methylpyrimidin-2(1H)-one
Synonym  Source
1-METHYLCYTOSINEPDBeChem
Manual XrefsDatabases
1MCPDBeChem
DB04314DrugBank
Registry NumbersSources
Reaxys:117959Reaxys
CAS:1122-47-0ChemIDplus
Citations