[[(2S,3S,5R)-5-(2-azanyl-8-azido-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]-phosphonooxy-methyl] dihydrogen phosphate

Systemtic Name: [[(2S,3S,5R)-5-(2-azanyl-8-azido-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]-phosphonooxy-methyl] dihydrogen phosphate Openeye Name: [[(2S,3S,5R)-5-(2-amino-8-azido-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]-phosphonooxy-methyl] dihydrogen phosphate CAS Name: [[(2S,3S,5R)-5-(2-amino-8-azido-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]-phosphonooxymethyl] dihydrogen phosphate IUPAC Name: [[(2S,3S,5R)-5-(2-amino-8-azido-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]-phosphonooxymethyl] dihydrogen phosphate Traditional Name: [[(2S,3S,5R)-5-(2-amino-8-azido-6-keto-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]-phosphonooxy-methyl] dihydrogen phosphate Formula: C10H14N8O11P2 MolecularWeight: 484.212682

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C3=C(C(=O)N=C(N3)N)N=C2N=[N+]=[N-])C(OP(=O)(O)O)OP(=O)(O)O)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C3=C(C(=O)N=C(N3)N)N=C2N=[N+]=[N-])C(OP(=O)(O)O)OP(=O)(O)O)O

InChI

InChI=1S/C10H14N8O11P2/c11-9-14-6-4(7(20)15-9)13-10(16-17-12)18(6)3-1-2(19)5(27-3)8(28-30(21,22)23)29-31(24,25)26/h2-3,5,8,19H,1H2,(H2,21,22,23)(H2,24,25,26)(H3,11,14,15,20)/t2-,3+,5-/m0/s1