2-(3,5-dimethoxy-4-phenylmethoxy-phenyl)-3-(ethylamino)-4-oxidanyl-3-purin-9-yl-oxolane-2-carboxylic acid

Systemtic Name: 2-(3,5-dimethoxy-4-phenylmethoxy-phenyl)-3-(ethylamino)-4-oxidanyl-3-purin-9-yl-oxolane-2-carboxylic acid Openeye Name: 2-(4-benzyloxy-3,5-dimethoxy-phenyl)-3-(ethylamino)-4-hydroxy-3-purin-9-yl-tetrahydrofuran-2-carboxylic acid CAS Name: 2-(3,5-dimethoxy-4-phenylmethoxyphenyl)-3-(ethylamino)-4-hydroxy-3-(9-purinyl)-2-oxolanecarboxylic acid IUPAC Name: 2-(3,5-dimethoxy-4-phenylmethoxyphenyl)-3-(ethylamino)-4-hydroxy-3-purin-9-yloxolane-2-carboxylic acid Traditional Name: 2-(4-benzoxy-3,5-dimethoxy-phenyl)-3-(ethylamino)-4-hydroxy-3-purin-9-yl-tetrahydrofuran-2-carboxylic acid Formula: C27H29N5O7 MolecularWeight: 535.54846

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1(C(COC1(C2=CC(=C(C(=C2)OC)OCC3=CC=CC=C3)OC)C(=O)O)O)N4C=NC5=CN=CN=C54

Isomeric SMILES

CCNC1(C(COC1(C2=CC(=C(C(=C2)OC)OCC3=CC=CC=C3)OC)C(=O)O)O)N4C=NC5=CN=CN=C54

InChI

InChI=1S/C27H29N5O7/c1-4-31-27(32-16-30-19-12-28-15-29-24(19)32)22(33)14-39-26(27,25(34)35)18-10-20(36-2)23(21(11-18)37-3)38-13-17-8-6-5-7-9-17/h5-12,15-16,22,31,33H,4,13-14H2,1-3H3,(H,34,35)