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Sodium (2R,4aR,6R,7R,7aS)-6-(2-Bromo-9-Oxo-6-Phenyl-4,9-Dihydro-3H-Imidazo[1,2-a]Purin-3-Yl)-7-Hydroxytetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinine-2-Thiolate 2-Oxide
[CAS# 185246-32-6]

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Identification
Name Sodium (2R,4aR,6R,7R,7aS)-6-(2-Bromo-9-Oxo-6-Phenyl-4,9-Dihydro-3H-Imidazo[1,2-a]Purin-3-Yl)-7-Hydroxytetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinine-2-Thiolate 2-Oxide
Synonyms 2-Bromo-3,4-dihydro-3-[3,5-O-[(R)-mercaptophosphinylidene]-ß-D-ribofuranosyl]-6-phenyl-9H-Imidazo[1,2-a]purin-9-one sodium salt; Rp-8-Br-PET-cGMPS
Molecular Structure CAS#: 185246-32-6, Sodium (2R,4aR,6R,7R,7aS)-6-(2-Bromo-9-Oxo-6-Phenyl-4,9-Dihydro-3H-Imidazo[1,2-a]Purin-3-Yl)-7-Hydroxytetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinine-2-Thiolate 2-Oxide
Molecular Formula C18H14BrN5NaO6PS
Molecular Weight 562.27
CAS Registry Number 185246-32-6
SMILES C1[C@@H]2[C@H]([C@H]([C@@H](O2)N3C4=C(C(=O)N5C=C(N=C5N4)C6=CC=CC=C6)N=C3Br)O)O[P@@](=O)(O1)S[Na]
InChI 1S/C18H15BrN5O6PS.Na/c19-17-21-11-14(24(17)16-12(25)13-10(29-16)7-28-31(27,32)30-13)22-18-20-9(6-23(18)15(11)26)8-4-2-1-3-5-8;/h1-6,10,12-13,16,25H,7H2,(H,20,22)(H,27,32);/q;+1/p-1/t10-,12-,13-,16-,31-;/m1./s1
InChIKey SVMPQLHYWRTQCX-DBHVCDLJSA-M
Properties
Refractive index (Cal.)
solubility Soluble to 20 mM in water and to 40 mM in DMSO
Safety Data
SDS Available
Market Analysis Reports
List of Reports Available for Sodium (2R,4aR,6R,7R,7aS)-6-(2-Bromo-9-Oxo-6-Phenyl-4,9-Dihydro-3H-Imidazo[1,2-a]Purin-3-Yl)-7-Hydroxytetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinine-2-Thiolate 2-Oxide
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