[4-(4-methoxyphenyl)carbonyloxy-5-(6-methoxypurin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl 4-methoxybenzoate

Systemtic Name: [4-(4-methoxyphenyl)carbonyloxy-5-(6-methoxypurin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl 4-methoxybenzoate Openeye Name: [3-hydroxy-4-(4-methoxybenzoyl)oxy-5-(6-methoxypurin-9-yl)tetrahydrofuran-2-yl]methyl 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [3-hydroxy-4-[(4-methoxyphenyl)-oxomethoxy]-5-(6-methoxy-9-purinyl)-2-oxolanyl]methyl ester IUPAC Name: [3-hydroxy-4-(4-methoxybenzoyl)oxy-5-(6-methoxypurin-9-yl)oxolan-2-yl]methyl 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [3-hydroxy-5-(6-methoxypurin-9-yl)-4-p-anisoyloxy-tetrahydrofuran-2-yl]methyl ester Formula: C27H26N4O9 MolecularWeight: 550.51674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4OC)OC(=O)C5=CC=C(C=C5)OC)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4OC)OC(=O)C5=CC=C(C=C5)OC)O

InChI

InChI=1S/C27H26N4O9/c1-35-17-8-4-15(5-9-17)26(33)38-12-19-21(32)22(40-27(34)16-6-10-18(36-2)11-7-16)25(39-19)31-14-30-20-23(31)28-13-29-24(20)37-3/h4-11,13-14,19,21-22,25,32H,12H2,1-3H3