[(2R,3S,5R)-3-oxidanyl-5-[6-(oxidanylamino)purin-9-yl]oxolan-2-yl]methyl [oxidanyl(phosphonooxy)phosphoryl] hydrogen phosphate

Systemtic Name: [(2R,3S,5R)-3-oxidanyl-5-[6-(oxidanylamino)purin-9-yl]oxolan-2-yl]methyl [oxidanyl(phosphonooxy)phosphoryl] hydrogen phosphate Openeye Name: [(2R,3S,5R)-3-hydroxy-5-[6-(hydroxyamino)purin-9-yl]tetrahydrofuran-2-yl]methyl [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate CAS Name: [(2R,3S,5R)-3-hydroxy-5-[6-(hydroxyamino)-9-purinyl]-2-oxolanyl]methyl [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate IUPAC Name: [(2R,3S,5R)-3-hydroxy-5-[6-(hydroxyamino)purin-9-yl]oxolan-2-yl]methyl [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate Traditional Name: [(2R,3S,5R)-3-hydroxy-5-[6-(hydroxyamino)purin-9-yl]tetrahydrofuran-2-yl]methyl [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate Formula: C10H16N5O13P3 MolecularWeight: 507.181023

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3NO)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2N=CN=C3NO)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O

InChI

InChI=1S/C10H16N5O13P3/c16-5-1-7(15-4-13-8-9(14-17)11-3-12-10(8)15)26-6(5)2-25-30(21,22)28-31(23,24)27-29(18,19)20/h3-7,16-17H,1-2H2,(H,21,22)(H,23,24)(H,11,12,14)(H2,18,19,20)/t5-,6+,7+/m0/s1