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CHEBI:61036 - 7-carboxylato-7-deazaguanine

ChEBI IDCHEBI:61036
ChEBI Name7-carboxylato-7-deazaguanine
Stars
DefinitionA monocarboxylic acid anion resulting from the removal of a proton from the carboxylic acid group of 7-carboxy-7-deazaguanine. The major form of 7-carboxy-7-deazaguanine at pH 7.3.
Last Modified12 May 2025
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC7H5N4O3
Net Charge-1
Average Mass193.142
Monoisotopic Mass193.03671
SMILESNc1nc(=O)c2c(C(=O)[O-])cnc2n1
InChIInChI=1S/C7H6N4O3/c8-7-10-4-3(5(12)11-7)2(1-9-4)6(13)14/h1H,(H,13,14)(H4,8,9,10,11,12)/p-1
InChIKeyXIUIRSLBMMTDSK-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
7-carboxylato-7-deazaguanine (CHEBI:61036) is a monocarboxylic acid anion (CHEBI:35757)
7-carboxylato-7-deazaguanine (CHEBI:61036) is conjugate base of 7-carboxy-7-deazaguanine (CHEBI:61125)
Incoming Relation(s)
7-carboxy-7-deazaguanine (CHEBI:61125) is conjugate acid of 7-carboxylato-7-deazaguanine (CHEBI:61036)
IUPAC Name 
2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine-5-carboxylate
Synonym  Source
7-deaza-7-carboxylatoguanineChEBI
UniProt Name  Source
7-carboxy-7-carbaguanineUniProt
Citations