[(2R,3S,4R,5R)-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-4-oxidanyl-2-(phosphonooxymethyl)oxolan-3-yl] [(2S,4R,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-4-oxidanyl-oxolan-2-yl]methyl hydrogen phosphate

Systemtic Name: [(2R,3S,4R,5R)-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-4-oxidanyl-2-(phosphonooxymethyl)oxolan-3-yl] [(2S,4R,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-4-oxidanyl-oxolan-2-yl]methyl hydrogen phosphate Openeye Name: [(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] [(2S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-4-hydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate CAS Name: [(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-2-(phosphonooxymethyl)-3-oxolanyl] [(2S,4R,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-4-hydroxy-2-oxolanyl]methyl hydrogen phosphate IUPAC Name: [(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-2-(phosphonooxymethyl)oxolan-3-yl] [(2S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methyl hydrogen phosphate Traditional Name: [(2R,3S,4R,5R)-5-(2-amino-6-keto-3H-purin-9-yl)-4-hydroxy-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] [(2S,4R,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-4-hydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate Formula: C19H26N8O14P2 MolecularWeight: 652.402462

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(C1O)N2C=CC(=NC2=O)N)COP(=O)(O)OC3C(OC(C3O)N4C=NC5=C4NC(=NC5=O)N)COP(=O)(O)O

Isomeric SMILES

C1[C@H](O[C@H]([C@@H]1O)N2C=CC(=NC2=O)N)COP(=O)(O)O[C@@H]3[C@H](O[C@H]([C@@H]3O)N4C=NC5=C4NC(=NC5=O)N)COP(=O)(O)O

InChI

InChI=1S/C19H26N8O14P2/c20-10-1-2-26(19(31)23-10)16-8(28)3-7(39-16)4-38-43(35,36)41-13-9(5-37-42(32,33)34)40-17(12(13)29)27-6-22-11-14(27)24-18(21)25-15(11)30/h1-2,6-9,12-13,16-17,28-29H,3-5H2,(H,35,36)(H2,20,23,31)(H2,32,33,34)(H3,21,24,25,30)/t7-,8+,9+,12+,13+,16+,17+/m0/s1