[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl N-[2,3-bis(phenylmethoxy)phenyl]carbonylsulfamate; N,N-diethylethanamine

Systemtic Name: [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl N-[2,3-bis(phenylmethoxy)phenyl]carbonylsulfamate; N,N-diethylethanamine Openeye Name: [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl N-(2,3-dibenzyloxybenzoyl)sulfamate; N,N-diethylethanamine CAS Name: N-[[2,3-bis(phenylmethoxy)phenyl]-oxomethyl]sulfamic acid [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester; N,N-diethylethanamine IUPAC Name: [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl N-[2,3-bis(phenylmethoxy)benzoyl]sulfamate; N,N-diethylethanamine Traditional Name: N-(2,3-dibenzoxybenzoyl)sulfamic acid [(3aR,4R,6R,6aR)-4-adenin-9-yl-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester; triethylamine Formula: C40H49N7O9S MolecularWeight: 803.92356

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CC1(OC2C(OC(C2O1)N3C=NC4=C3N=CN=C4N)COS(=O)(=O)NC(=O)C5=C(C(=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)C

Isomeric SMILES

CCN(CC)CC.CC1(O[C@@H]2[C@H](O[C@H]([C@@H]2O1)N3C=NC4=C3N=CN=C4N)COS(=O)(=O)NC(=O)C5=C(C(=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)C

InChI

InChI=1S/C34H34N6O9S.C6H15N/c1-34(2)48-28-25(47-33(29(28)49-34)40-20-38-26-30(35)36-19-37-31(26)40)18-46-50(42,43)39-32(41)23-14-9-15-24(44-16-21-10-5-3-6-11-21)27(23)45-17-22-12-7-4-8-13-22;1-4-7(5-2)6-3/h3-15,19-20,25,28-29,33H,16-18H2,1-2H3,(H,39,41)(H2,35,36,37);4-6H2,1-3H3/t25-,28-,29-,33-;/m1./s1