CHEBI:179152 - 7-Carboxy-7-carbaguanine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 7-Carboxy-7-carbaguanine
ChEBI ID CHEBI:179152
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C7H6N4O3
Net Charge 0
Average Mass 194.150
Monoisotopic Mass 194.04399
InChI InChI=1S/C7H6N4O3/c8-7-10-4-3(5(12)11-7)2(1-9-4)6(13)14/h1-2H,(H,13,14)(H3,8,10,11,12)
InChIKey WUOUUTDOPPNBHW-UHFFFAOYSA-N
SMILES OC(=O)C1C2=C(NC(=NC2=O)N)N=C1
ChEBI Ontology
Outgoing 7-Carboxy-7-carbaguanine (CHEBI:179152) is a pyrrolopyrimidine (CHEBI:38670)
IUPAC Name
2-amino-4-oxo-1,5-dihydropyrrolo[2,3-d]pyrimidine-5-carboxylic acid