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CHEBI:85895 - 4-amino-5-formamidomethyl-2-methylpyrimidine

Default Structure
ChEBI IDCHEBI:85895
ChEBI Name4-amino-5-formamidomethyl-2-methylpyrimidine
Stars
DefinitionA member of the class of aminopyrimidine with the amino group at position 4 with additional methyl and formamidomethyl substituents at positions 2 and 5 respectively.
Last Modified8 June 2015
SubmitterAnne Morgat
DownloadsMolfile
FormulaC7H10N4O
Net Charge0
Average Mass166.184
Monoisotopic Mass166.08546
SMILES[H]C(=O)NCc1cnc(C)nc1N
InChIInChI=1S/C7H10N4O/c1-5-10-3-6(2-9-4-12)7(8)11-5/h3-4H,2H2,1H3,(H,9,12)(H2,8,10,11)
InChIKeyPVWNFAGYFUUDRC-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
4-amino-5-formamidomethyl-2-methylpyrimidine (CHEBI:85895) has role bacterial xenobiotic metabolite (CHEBI:76976)
4-amino-5-formamidomethyl-2-methylpyrimidine (CHEBI:85895) is a aminopyrimidine (CHEBI:38338)
4-amino-5-formamidomethyl-2-methylpyrimidine (CHEBI:85895) is a formamides (CHEBI:24079)
IUPAC Name 
N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide
Synonyms  Source
2-methyl-4-amino-5-formylaminomethylpyrimidineChEBI
2-Methyl-4-amino-5-(formylaminomethyl)pyrimidineKEGG COMPOUND
FAMPKEGG COMPOUND
N-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]methanamidePDBeChem
UniProt Name  Source
N-formyl-4-amino-5-aminomethyl-2-methylpyrimidineUniProt
Manual XrefsDatabases
C19872KEGG COMPOUND
NFMPDBeChem
Registry NumbersSources
Reaxys:9948Reaxys
Citations