[[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-4-oxidanyl-oxolan-2-yl]methoxy-oxidanidyl-phosphoryl]oxy-oxidanidyl-phosphoryl] phosphate

Systemtic Name: [[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-4-oxidanyl-oxolan-2-yl]methoxy-oxidanidyl-phosphoryl]oxy-oxidanidyl-phosphoryl] phosphate Openeye Name: [[[5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-tetrahydrofuran-2-yl]methoxy-oxido-phosphoryl]oxy-oxido-phosphoryl] phosphate CAS Name: [[[5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-2-oxolanyl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl] phosphate IUPAC Name: [[[5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl] phosphate Traditional Name: [[[5-(2-amino-6-keto-3H-purin-9-yl)-4-hydroxy-tetrahydrofuran-2-yl]methoxy-oxido-phosphoryl]oxy-oxido-phosphoryl] phosphate Formula: C10H12N5O13P3-4 MolecularWeight: 503.149263

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(C1O)N2C=NC3=C2NC(=NC3=O)N)COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-]

Isomeric SMILES

C1C(OC(C1O)N2C=NC3=C2NC(=NC3=O)N)COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-]

InChI

InChI=1S/C10H16N5O13P3/c11-10-13-7-6(8(17)14-10)12-3-15(7)9-5(16)1-4(26-9)2-25-30(21,22)28-31(23,24)27-29(18,19)20/h3-5,9,16H,1-2H2,(H,21,22)(H,23,24)(H2,18,19,20)(H3,11,13,14,17)/p-4