methyl 2-acetyloxy-2-[3,4-diacetyloxy-5-(6-aminopurin-9-yl)oxolan-2-yl]ethanoate

Systemtic Name: methyl 2-acetyloxy-2-[3,4-diacetyloxy-5-(6-aminopurin-9-yl)oxolan-2-yl]ethanoate Openeye Name: methyl 2-acetoxy-2-[3,4-diacetoxy-5-(6-aminopurin-9-yl)tetrahydrofuran-2-yl]acetate CAS Name: 2-acetyloxy-2-[3,4-diacetyloxy-5-(6-aminopurin-9-yl)-2-oxolanyl]acetic acid methyl ester IUPAC Name: methyl 2-acetyloxy-2-[3,4-diacetyloxy-5-(6-aminopurin-9-yl)oxolan-2-yl]acetate Traditional Name: 2-acetoxy-2-(3,4-diacetoxy-5-adenin-9-yl-tetrahydrofuran-2-yl)acetic acid methyl ester Formula: C18H21N5O9 MolecularWeight: 451.38744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(OC1C(C(=O)OC)OC(=O)C)N2C=NC3=C2N=CN=C3N)OC(=O)C

Isomeric SMILES

CC(=O)OC1C(C(OC1C(C(=O)OC)OC(=O)C)N2C=NC3=C2N=CN=C3N)OC(=O)C

InChI

InChI=1S/C18H21N5O9/c1-7(24)29-11-12(14(18(27)28-4)31-9(3)26)32-17(13(11)30-8(2)25)23-6-22-10-15(19)20-5-21-16(10)23/h5-6,11-14,17H,1-4H3,(H2,19,20,21)