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CHEBI:234257 - 7-iminomethyladenylyl-7-carbaguanine(1−)

ChEBI IDCHEBI:234257
ChEBI Name7-iminomethyladenylyl-7-carbaguanine(1−)
Stars
ASCII Name7-iminomethyladenylyl-7-carbaguanine(1-)
DefinitionMajor species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC17H18N10O8P
Net Charge-1
Average Mass521.367
Monoisotopic Mass521.10522
SMILESN=C(OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O)c1cnc2nc(N)nc(=O)c12
InChIInChI=1S/C17H19N10O8P/c18-11-8-14(23-3-22-11)27(4-24-8)16-10(29)9(28)6(34-16)2-33-36(31,32)35-12(19)5-1-21-13-7(5)15(30)26-17(20)25-13/h1,3-4,6,9-10,16,19,28-29H,2H2,(H,31,32)(H2,18,22,23)(H4,20,21,25,26,30)/p-1/t6-,9-,10-,16-/m1/s1
InChIKeyMEPOKIUPHRMKDR-QNIHBFOLSA-M
ChEBI Ontology
Outgoing Relation(s)
7-iminomethyladenylyl-7-carbaguanine(1−) (CHEBI:234257) is a organophosphate oxoanion (CHEBI:58945)
Synonym  Source
2-amino-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidine-5-carboximidyl-5'-adenylate(1−)SUBMITTER
UniProt Name  Source
7-iminomethyladenylyl-7-carbaguanineUniProt