CHEBI:84641 - (Sp)-8-Br-cGMPS

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ChEBI Name (Sp)-8-Br-cGMPS
ChEBI ID CHEBI:84641
ChEBI ASCII Name (Sp)-8-Br-cGMPS
Definition A nucleoside 3',5'-cyclic phosphorothioate having 8-bromoguanine as the nucleobase (the Sp-stereoisomer).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Margaret Duesbury
Supplier Information
Download Molfile XML SDF
Formula C10H11BrN5O6PS
Net Charge 0
Average Mass 440.16700
Monoisotopic Mass 438.93510
InChI InChI=1S/C10H11BrN5O6PS/c11-9-13-3-6(14-10(12)15-7(3)18)16(9)8-4(17)5-2(21-8)1-20-23(19,24)22-5/h2,4-5,8,17H,1H2,(H,19,24)(H3,12,14,15,18)/t2-,4-,5-,8-,23+/m1/s1
InChIKey KRYIOQOBMVFLBO-JXGIQVKMSA-N
SMILES Nc1nc2n([C@@H]3O[C@@H]4CO[P@@](S)(=O)O[C@H]4[C@H]3O)c(Br)nc2c(=O)[nH]1
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-Br-cGMPS (CHEBI:84641) has functional parent 3',5'-cyclic GMP (CHEBI:16356)
(Sp)-8-Br-cGMPS (CHEBI:84641) has role protein kinase agonist (CHEBI:64106)
(Sp)-8-Br-cGMPS (CHEBI:84641) is a nucleoside 3',5'-cyclic phosphorothioate (CHEBI:85287)
(Sp)-8-Br-cGMPS (CHEBI:84641) is a organobromine compound (CHEBI:37141)
(Sp)-8-Br-cGMPS (CHEBI:84641) is a purines (CHEBI:26401)
IUPAC Name
2-amino-8-bromo-9-[(2S,4aR,6R,7R,7aS)-7-hydroxy-2-oxo-2-sulfanyltetrahydro-2H,4H-2λ5-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-1,9-dihydro-6H-purin-6-one
Synonyms Sources
(Sp)-8-bromoguanosine-3',5'-cyclic monophosphorothioate ChEBI
8-bromo-Sp-cGMPS ChEBI
Sp-8-Br-cGMPS ChEBI
Citations Waiting for Citations Types Sources
24605759 PubMed citation SUBMITTER
9589370 PubMed citation Europe PMC
Last Modified
24 March 2015