[(2R,3R,4R)-3,4-diacetyloxy-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4R)-3,4-diacetyloxy-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4R)-3,4-diacetoxy-5-(2-amino-6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4R)-3,4-diacetyloxy-5-(2-amino-6-oxo-3H-purin-9-yl)-2-oxolanyl]methyl ester IUPAC Name: [(2R,3R,4R)-3,4-diacetyloxy-5-(2-amino-6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4R)-3,4-diacetoxy-5-(2-amino-6-keto-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl ester Formula: C16H19N5O8 MolecularWeight: 409.35076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC(=NC3=O)N)OC(=O)C)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C16H19N5O8/c1-6(22)26-4-9-11(27-7(2)23)12(28-8(3)24)15(29-9)21-5-18-10-13(21)19-16(17)20-14(10)25/h5,9,11-12,15H,4H2,1-3H3,(H3,17,19,20,25)/t9-,11-,12-,15?/m1/s1