[(2R,3R,4R)-4-acetyloxy-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(1-oxidanyl-2-oxidanylidene-heptyl)oxolan-3-yl] ethanoate

Systemtic Name: [(2R,3R,4R)-4-acetyloxy-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(1-oxidanyl-2-oxidanylidene-heptyl)oxolan-3-yl] ethanoate Openeye Name: [(2R,3R,4R)-4-acetoxy-5-(2-amino-6-oxo-3H-purin-9-yl)-2-(1-hydroxy-2-oxo-heptyl)tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [(2R,3R,4R)-4-acetyloxy-5-(2-amino-6-oxo-3H-purin-9-yl)-2-(1-hydroxy-2-oxoheptyl)-3-oxolanyl] ester IUPAC Name: [(2R,3R,4R)-4-acetyloxy-5-(2-amino-6-oxo-3H-purin-9-yl)-2-(1-hydroxy-2-oxoheptyl)oxolan-3-yl] acetate Traditional Name: acetic acid [(2R,3R,4R)-4-acetoxy-5-(2-amino-6-keto-3H-purin-9-yl)-2-(1-hydroxy-2-keto-heptyl)tetrahydrofuran-3-yl] ester Formula: C20H27N5O8 MolecularWeight: 465.45708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(C1C(C(C(O1)N2C=NC3=C2NC(=NC3=O)N)OC(=O)C)OC(=O)C)O

Isomeric SMILES

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

InChI

InChI=1S/C20H27N5O8/c1-4-5-6-7-11(28)13(29)14-15(31-9(2)26)16(32-10(3)27)19(33-14)25-8-22-12-17(25)23-20(21)24-18(12)30/h8,13-16,19,29H,4-7H2,1-3H3,(H3,21,23,24,30)/t13?,14-,15-,16-,19?/m1/s1