CHEBI:84619 - (Sp)-8-bromo-cAMPS

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ChEBI Name (Sp)-8-bromo-cAMPS
ChEBI ID CHEBI:84619
ChEBI ASCII Name (Sp)-8-bromo-cAMPS
Definition A nucleoside 3',5'-cyclic phosphorothioate having 8-bromoadenine as the nucleobase (the Sp-stereoisomer).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Margaret Duesbury
Supplier Information ZINC000230541072
Download Molfile XML SDF
Formula C10H11BrN5O5PS
Net Charge 0
Average Mass 424.16800
Monoisotopic Mass 422.94019
InChI InChI=1S/C10H11BrN5O5PS/c11-10-15-4-7(12)13-2-14-8(4)16(10)9-5(17)6-3(20-9)1-19-22(18,23)21-6/h2-3,5-6,9,17H,1H2,(H,18,23)(H2,12,13,14)/t3-,5-,6-,9-,22+/m1/s1
InChIKey RBORURQQJIQWBS-FHIGPPGSSA-N
SMILES Nc1ncnc2n([C@@H]3O[C@@H]4CO[P@@](S)(=O)O[C@H]4[C@H]3O)c(Br)nc12
Roles Classification
Biological Role(s): protein kinase agonist
An agonist that selectively binds to and activates a protein kinase receptor.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (Sp)-8-bromo-cAMPS (CHEBI:84619) has functional parent 3',5'-cyclic AMP (CHEBI:17489)
(Sp)-8-bromo-cAMPS (CHEBI:84619) has role protein kinase agonist (CHEBI:64106)
(Sp)-8-bromo-cAMPS (CHEBI:84619) is a nucleoside 3',5'-cyclic phosphorothioate (CHEBI:85287)
(Sp)-8-bromo-cAMPS (CHEBI:84619) is a organobromine compound (CHEBI:37141)
(Sp)-8-bromo-cAMPS (CHEBI:84619) is a purines (CHEBI:26401)
IUPAC Name
(2S,4aR,6R,7R,7aS)-6-(6-amino-8-bromo-9H-purin-9-yl)-7-hydroxy-2-sulfanyltetrahydro-2H,4H-2λ5-furo[3,2-d][1,3,2]dioxaphosphinin-2-one
Synonyms Sources
(Sp)-8-bromoadenosine-3',5'-cyclic monophosphorothioate ChEBI
8-bromo-Sp-cAMPS ChEBI
Sp-8-Br-cAMPS ChEBI
Registry Number Type Source
15036769 Reaxys Registry Number Reaxys
Citations
Last Modified
23 March 2015