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CHEBI:84609 - 8-aza-cAMP

ChEBI IDCHEBI:84609
ChEBI Name8-aza-cAMP
Stars
DefinitionA nucleoside 3',5'-cyclic phosphate that is cAMP in which the methine (C-H) group at position 8 on the purine fragment is replaced by nitrogen.
Last Modified20 March 2015
SubmitterMargaret Duesbury
DownloadsMolfile
FormulaC9H11N6O6P
Net Charge0
Average Mass330.197
Monoisotopic Mass330.04777
SMILESNc1ncnc2c1nnn2[C@@H]1O[C@@H]2COP(=O)(O)O[C@H]2[C@H]1O
InChIInChI=1S/C9H11N6O6P/c10-7-4-8(12-2-11-7)15(14-13-4)9-5(16)6-3(20-9)1-19-22(17,18)21-6/h2-3,5-6,9,16H,1H2,(H,17,18)(H2,10,11,12)/t3-,5-,6-,9-/m1/s1
InChIKeyBIGYHYCRZXFCJX-UUOKFMHZSA-N
ChEBI Ontology
Outgoing Relation(s)
8-aza-cAMP (CHEBI:84609) has functional parent 8-azaguanine (CHEBI:63486)
8-aza-cAMP (CHEBI:84609) is a nucleoside 3',5'-cyclic phosphate (CHEBI:18375)
8-aza-cAMP (CHEBI:84609) is a triazolopyrimidines (CHEBI:48435)
IUPAC Name 
(4aR,6R,7R,7aS)-6-(7-amino-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)-2,7-dihydroxytetrahydro-2H,4H-2λ5-furo[3,2-d][1,3,2]dioxaphosphinin-2-one
Synonyms  Source
8-N-cAMPChEBI
8-azaadenosine cyclic 3',5'-phosphateChEBI
8-aza-3',5'-cyclic AMPChEBI
Citations