[5-(6-methoxypurin-9-yl)-4-oxidanyl-3-(2-phenylethanoyloxy)oxolan-2-yl]methyl 2-phenylethanoate

Systemtic Name: [5-(6-methoxypurin-9-yl)-4-oxidanyl-3-(2-phenylethanoyloxy)oxolan-2-yl]methyl 2-phenylethanoate Openeye Name: [4-hydroxy-5-(6-methoxypurin-9-yl)-3-(2-phenylacetyl)oxy-tetrahydrofuran-2-yl]methyl 2-phenylacetate CAS Name: 2-phenylacetic acid [4-hydroxy-5-(6-methoxy-9-purinyl)-3-(1-oxo-2-phenylethoxy)-2-oxolanyl]methyl ester IUPAC Name: [4-hydroxy-5-(6-methoxypurin-9-yl)-3-(2-phenylacetyl)oxyoxolan-2-yl]methyl 2-phenylacetate Traditional Name: 2-phenylacetic acid [4-hydroxy-5-(6-methoxypurin-9-yl)-3-(2-phenylacetyl)oxy-tetrahydrofuran-2-yl]methyl ester Formula: C27H26N4O7 MolecularWeight: 518.51794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC2=C1N=CN2C3C(C(C(O3)COC(=O)CC4=CC=CC=C4)OC(=O)CC5=CC=CC=C5)O

Isomeric SMILES

COC1=NC=NC2=C1N=CN2C3C(C(C(O3)COC(=O)CC4=CC=CC=C4)OC(=O)CC5=CC=CC=C5)O

InChI

InChI=1S/C27H26N4O7/c1-35-26-22-25(28-15-29-26)31(16-30-22)27-23(34)24(38-21(33)13-18-10-6-3-7-11-18)19(37-27)14-36-20(32)12-17-8-4-2-5-9-17/h2-11,15-16,19,23-24,27,34H,12-14H2,1H3