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CHEBI:39721 - ethyl 2-amino-4-hydroxypyrimidine-5-carboxylate

Default Structure
ChEBI IDCHEBI:39721
ChEBI Nameethyl 2-amino-4-hydroxypyrimidine-5-carboxylate
Stars
DefinitionAn aminopyrimidine that is 2-amino-4-hydroxypyrimidine in which the hydrogen at position 5 is substituted by an ethoxycarbonyl group.
Last Modified2 March 2015
DownloadsMolfile
FormulaC7H9N3O3
Net Charge0
Average Mass183.167
Monoisotopic Mass183.06439
SMILESCCOC(=O)c1cnc(N)nc1O
InChIInChI=1S/C7H9N3O3/c1-2-13-6(12)4-3-9-7(8)10-5(4)11/h3H,2H2,1H3,(H3,8,9,10,11)
InChIKeyHRRHGLKNOJHIGY-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
ethyl 2-amino-4-hydroxypyrimidine-5-carboxylate (CHEBI:39721) is a aminopyrimidine (CHEBI:38338)
ethyl 2-amino-4-hydroxypyrimidine-5-carboxylate (CHEBI:39721) is a ethyl ester (CHEBI:23990)
ethyl 2-amino-4-hydroxypyrimidine-5-carboxylate (CHEBI:39721) is a hydroxypyrimidine (CHEBI:38340)
ethyl 2-amino-4-hydroxypyrimidine-5-carboxylate (CHEBI:39721) is a pyrimidinecarboxylate ester (CHEBI:48451)
IUPAC Name 
ethyl 2-amino-4-hydroxypyrimidine-5-carboxylate
Synonyms  Source
2-AMINO-4-HYDROXYPYRIMIDINE-5-CARBOXYLIC ACID ETHYL ESTERPDBeChem
2-amino-6-oxo-1,6-dihydro-pyrimidine-5-carboxylic acid ethyl esterChEBI
ethyl 2-amino-1,4-dihydro-4-oxopyrimidine-5-carboxylateChEBI
Manual XrefsDatabases
204PDBeChem
Registry NumbersSources
Reaxys:1569760Reaxys
CAS:15400-53-0ChemIDplus