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

Systemtic Name: [5-(2-nonyl-6-oxidanylidene-3H-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [3,4-dihydroxy-5-(2-nonyl-6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [3,4-dihydroxy-5-(2-nonyl-6-oxo-3H-purin-9-yl)-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [3,4-dihydroxy-5-(2-nonyl-6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [3,4-dihydroxy-5-(6-keto-2-nonyl-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C19H31N4O8P MolecularWeight: 474.445201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O

Isomeric SMILES

CCCCCCCCCC1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O

InChI

InChI=1S/C19H31N4O8P/c1-2-3-4-5-6-7-8-9-13-21-17-14(18(26)22-13)20-11-23(17)19-16(25)15(24)12(31-19)10-30-32(27,28)29/h11-12,15-16,19,24-25H,2-10H2,1H3,(H,21,22,26)(H2,27,28,29)