8-Thio-benzyl cyclic amp

(4aR,6R,7R,7aS)-6-(6-amino-8-benzylsulfanylpurin-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol

Also Known As: 8-S-Benzyl cyclic amp|8-Benzylthio-camp|8-Thio-benzyl cyclic amp|KST-1A3898|8-benzylthioadenosine 3',5'-cyclic phosphate|8-Benzylthioadenosine 3 ,5 -phosphoric acid|8-benzylsulfanyl-O3',O5'-hydroxyphosphoryl-adenosine|8-((Phenylmethyl)thio)adenosine, cyclic 3',5'-(hydrogen phosphate)|8-(Phenylmethylthio)adenosine 3 ,5 -phosphoric acid|(4aR,6R,7R,7aS)-6-(6-amino-8-benzylsulfanylpurin-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol|(1S,6R,8R,9R)-8-[6-Amino-8-(phenylmethylsulfanyl)purin-9-yl]-3-hydroxy-3-oxo-2,4,7-trioxa-3lambda5-phosphabicyclo[4.3.0]nonan-9-ol|(4ar,6r,7r,7as)-6-[6-amino-8-(benzylsulfanyl)-9h-purin-9-yl]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol 2-oxide|(4aR,6R,7R,7aS)-6-[6-amino-8-(benzylsulfanyl)-9H-purin-9-yl]-2,7-dihydroxy-hexahydro-2lambda5-furo[3,2-d][1,3,2]dioxaphosphinin-2-one|(4aR,6R,7R,7aS)-6-[6-Amino-8-(benzylsulfanyl)-9H-purin-9-yl]-2,7-dihydroxytetrahydro-2H,4H-2lambda~5~-furo[3,2-d][1,3,2]dioxaphosphinin-2-one|6-[6-Amino-8-(benzylsulfanyl)-9H-purin-9-yl]-2,7-dihydroxytetrahydro-2H,4H-2lambda~5~-furo[3,2-d][1,3,2]dioxaphosphinin-2-one

Molecular Formula	C17H18N5O6PS
Molecular Weight	451.07153 g/mol
LogP	1.47
Topological Polar Surface Area	154.84 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	11
Rotatable Bonds	4
Exact Mass	451.07153
Heavy Atoms	30
Complexity	1130.5

Chemical Identifiers

CAS Number	32487-38-0
SMILES	C1[C@@H]2[C@H]([C@H]([C@@H](O2)N3C4=NC=NC(=C4N=C3SCC5=CC=CC=C5)N)O)OP(=O)(O1)O