[3,4-bis(oxidanyl)-5-(6-oxidanylidene-2-phenyl-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [3,4-bis(oxidanyl)-5-(6-oxidanylidene-2-phenyl-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [3,4-dihydroxy-5-(6-oxo-2-phenyl-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [3,4-dihydroxy-5-(6-oxo-2-phenyl-3H-purin-9-yl)-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [3,4-dihydroxy-5-(6-oxo-2-phenyl-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [3,4-dihydroxy-5-(6-keto-2-phenyl-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C16H17N4O8P MolecularWeight: 424.301941

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=O)C3=C(N2)N(C=N3)C4C(C(C(O4)COP(=O)(O)O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=O)C3=C(N2)N(C=N3)C4C(C(C(O4)COP(=O)(O)O)O)O

InChI

InChI=1S/C16H17N4O8P/c21-11-9(6-27-29(24,25)26)28-16(12(11)22)20-7-17-10-14(20)18-13(19-15(10)23)8-4-2-1-3-5-8/h1-5,7,9,11-12,16,21-22H,6H2,(H,18,19,23)(H2,24,25,26)