[[[(5R)-5-(6-aminopurin-9-yl)-3-oxidanyl-oxolan-2-yl]methoxy-sulfanidyl-phosphinothioyl]oxy-oxidanidyl-phosphoryl] phosphate

Systemtic Name: [[[(5R)-5-(6-aminopurin-9-yl)-3-oxidanyl-oxolan-2-yl]methoxy-sulfanidyl-phosphinothioyl]oxy-oxidanidyl-phosphoryl] phosphate Openeye Name: [[[(5R)-5-(6-aminopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-sulfido-phosphinothioyl]oxy-oxido-phosphoryl] phosphate CAS Name: [[[(5R)-5-(6-aminopurin-9-yl)-3-hydroxy-2-oxolanyl]methoxy-sulfidophosphinothioyl]oxy-oxidophosphoryl] phosphate IUPAC Name: [[[(5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-sulfidophosphinothioyl]oxy-oxidophosphoryl] phosphate Traditional Name: [[[(5R)-5-adenin-9-yl-3-hydroxy-tetrahydrofuran-2-yl]methoxy-sulfido-thiophosphoryl]oxy-oxido-phosphoryl] phosphate Formula: C10H12N5O10P3S2-4 MolecularWeight: 519.281063

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3N)COP(=S)(OP(=O)([O-])OP(=O)([O-])[O-])[S-])O

Isomeric SMILES

C1[C@@H](OC(C1O)COP(=S)(OP(=O)([O-])OP(=O)([O-])[O-])[S-])N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C10H16N5O10P3S2/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(23-7)2-22-28(29,30)25-27(20,21)24-26(17,18)19/h3-7,16H,1-2H2,(H,20,21)(H,29,30)(H2,11,12,13)(H2,17,18,19)/p-4/t5?,6?,7-/m1/s1