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CHEBI:63092 - methyl purine-6-carboxylate

ChEBI IDCHEBI:63092
ChEBI Namemethyl purine-6-carboxylate
Stars
DefinitionA methyl ester that is purine bearing a methoxycarbonyl substituent at position 6.
Last Modified6 March 2015
SubmitterSteve
DownloadsMolfile
FormulaC7H6N4O2
Net Charge0
Average Mass178.151
Monoisotopic Mass178.04908
SMILESCOC(=O)c1ncnc2ncnc12
InChIInChI=1S/C7H6N4O2/c1-13-7(12)5-4-6(10-2-8-4)11-3-9-5/h2-3H,1H3,(H,8,9,10,11)
InChIKeyHILMMWCZVHCJNL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl purine-6-carboxylate (CHEBI:63092) is a methyl ester (CHEBI:25248)
methyl purine-6-carboxylate (CHEBI:63092) is a purines (CHEBI:26401)
IUPAC Name 
methyl 9H-purine-6-carboxylate
Synonym  Source
purine-6-caboxylic acid methyl esterChEBI
Registry NumbersSources
Reaxys:521857Reaxys
Citations