[5-(2-azanyl-6-oxidanylidene-7H-purin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethylphosphonic acid

Systemtic Name: [5-(2-azanyl-6-oxidanylidene-7H-purin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethylphosphonic acid Openeye Name: [5-(2-amino-6-oxo-7H-purin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]oxymethylphosphonic acid CAS Name: [5-(2-amino-6-oxo-7H-purin-1-yl)-3,4-dihydroxy-2-oxolanyl]oxymethylphosphonic acid IUPAC Name: [5-(2-amino-6-oxo-7H-purin-1-yl)-3,4-dihydroxyoxolan-2-yl]oxymethylphosphonic acid Traditional Name: [5-(2-amino-6-keto-7H-purin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]oxymethylphosphonic acid Formula: C10H14N5O8P MolecularWeight: 363.220621

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=O)N(C(=N2)N)C3C(C(C(O3)OCP(=O)(O)O)O)O

Isomeric SMILES

C1=NC2=C(N1)C(=O)N(C(=N2)N)C3C(C(C(O3)OCP(=O)(O)O)O)O

InChI

InChI=1S/C10H14N5O8P/c11-10-14-6-3(12-1-13-6)7(18)15(10)8-4(16)5(17)9(23-8)22-2-24(19,20)21/h1,4-5,8-9,16-17H,2H2,(H2,11,14)(H,12,13)(H2,19,20,21)