[4,5-diacetyloxy-6-(6-aminopurin-9-yl)oxan-3-yl] ethanoate

Systemtic Name: [4,5-diacetyloxy-6-(6-aminopurin-9-yl)oxan-3-yl] ethanoate Openeye Name: [4,5-diacetoxy-6-(6-aminopurin-9-yl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [4,5-diacetyloxy-6-(6-aminopurin-9-yl)-3-oxanyl] ester IUPAC Name: [4,5-diacetyloxy-6-(6-aminopurin-9-yl)oxan-3-yl] acetate Traditional Name: acetic acid (4,5-diacetoxy-6-adenin-9-yl-tetrahydropyran-3-yl) ester Formula: C16H19N5O7 MolecularWeight: 393.35136

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C16H19N5O7/c1-7(22)26-10-4-25-16(13(28-9(3)24)12(10)27-8(2)23)21-6-20-11-14(17)18-5-19-15(11)21/h5-6,10,12-13,16H,4H2,1-3H3,(H2,17,18,19)