[4,5-bis(oxidanyl)-2-(7H-purin-8-ylcarbonyl)oxan-3-yl] dihydrogen phosphate

Systemtic Name: [4,5-bis(oxidanyl)-2-(7H-purin-8-ylcarbonyl)oxan-3-yl] dihydrogen phosphate Openeye Name: [4,5-dihydroxy-2-(7H-purine-8-carbonyl)tetrahydropyran-3-yl] dihydrogen phosphate CAS Name: [4,5-dihydroxy-2-[oxo(7H-purin-8-yl)methyl]-3-oxanyl] dihydrogen phosphate IUPAC Name: [4,5-dihydroxy-2-(7H-purine-8-carbonyl)oxan-3-yl] dihydrogen phosphate Traditional Name: [4,5-dihydroxy-2-(7H-purine-8-carbonyl)tetrahydropyran-3-yl] dihydrogen phosphate Formula: C11H13N4O8P MolecularWeight: 360.216681

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(O1)C(=O)C2=NC3=NC=NC=C3N2)OP(=O)(O)O)O)O

Isomeric SMILES

C1C(C(C(C(O1)C(=O)C2=NC3=NC=NC=C3N2)OP(=O)(O)O)O)O

InChI

InChI=1S/C11H13N4O8P/c16-5-2-22-8(9(6(5)17)23-24(19,20)21)7(18)11-14-4-1-12-3-13-10(4)15-11/h1,3,5-6,8-9,16-17H,2H2,(H2,19,20,21)(H,12,13,14,15)