9-[(2R,3R,4S,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]-6-oxidanylidene-3H-purin-2-olate

Systemtic Name: 9-[(2R,3R,4S,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]-6-oxidanylidene-3H-purin-2-olate Openeye Name: 9-[(2R,3R,4S,5R)-3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]-6-oxo-3H-purin-2-olate CAS Name: 9-[(2R,3R,4S,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)-2-oxolanyl]-6-oxo-3H-purin-2-olate IUPAC Name: 9-[(2R,3R,4S,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]-6-oxo-3H-purin-2-olate Traditional Name: 9-[(2R,3R,4S,5R)-3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]-6-keto-3H-purin-2-olate Formula: C16H17N4O9- MolecularWeight: 409.32758

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC(=NC3=O)[O-])OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@@H]([C@H]([C@@H](O1)N2C=NC3=C2NC(=NC3=O)[O-])OC(=O)C)OC(=O)C

InChI

InChI=1S/C16H18N4O9/c1-6(21)26-4-9-11(27-7(2)22)12(28-8(3)23)15(29-9)20-5-17-10-13(20)18-16(25)19-14(10)24/h5,9,11-12,15H,4H2,1-3H3,(H2,18,19,24,25)/p-1/t9-,11+,12-,15-/m1/s1