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

Systemtic Name: [5-(2-heptyl-6-oxidanylidene-3H-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [5-(2-heptyl-6-oxo-3H-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [5-(2-heptyl-6-oxo-3H-purin-9-yl)-3,4-dihydroxy-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [5-(2-heptyl-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [5-(2-heptyl-6-keto-3H-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C17H27N4O8P MolecularWeight: 446.392041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O

Isomeric SMILES

CCCCCCCC1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O

InChI

InChI=1S/C17H27N4O8P/c1-2-3-4-5-6-7-11-19-15-12(16(24)20-11)18-9-21(15)17-14(23)13(22)10(29-17)8-28-30(25,26)27/h9-10,13-14,17,22-23H,2-8H2,1H3,(H,19,20,24)(H2,25,26,27)