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

Systemtic Name: [3,4-bis(oxidanyl)-5-(6-oxidanylidene-2-pyridin-3-yl-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [3,4-dihydroxy-5-[6-oxo-2-(3-pyridyl)-3H-purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [3,4-dihydroxy-5-[6-oxo-2-(3-pyridinyl)-3H-purin-9-yl]-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [3,4-dihydroxy-5-(6-oxo-2-pyridin-3-yl-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [3,4-dihydroxy-5-[6-keto-2-(3-pyridyl)-3H-purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C15H16N5O8P MolecularWeight: 425.290001

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N5O8P/c21-10-8(5-27-29(24,25)26)28-15(11(10)22)20-6-17-9-13(20)18-12(19-14(9)23)7-2-1-3-16-4-7/h1-4,6,8,10-11,15,21-22H,5H2,(H,18,19,23)(H2,24,25,26)