3-azanyl-4-oxidanyl-5-[6-[(2-phenylmethoxyphenyl)methylamino]purin-9-yl]oxolane-2-carboxylic acid

Systemtic Name: 3-azanyl-4-oxidanyl-5-[6-[(2-phenylmethoxyphenyl)methylamino]purin-9-yl]oxolane-2-carboxylic acid Openeye Name: 3-amino-5-[6-[(2-benzyloxyphenyl)methylamino]purin-9-yl]-4-hydroxy-tetrahydrofuran-2-carboxylic acid CAS Name: 3-amino-4-hydroxy-5-[6-[(2-phenylmethoxyphenyl)methylamino]-9-purinyl]-2-oxolanecarboxylic acid IUPAC Name: 3-amino-4-hydroxy-5-[6-[(2-phenylmethoxyphenyl)methylamino]purin-9-yl]oxolane-2-carboxylic acid Traditional Name: 3-amino-5-[6-[(2-benzoxybenzyl)amino]purin-9-yl]-4-hydroxy-tetrahydrofuran-2-carboxylic acid Formula: C24H24N6O5 MolecularWeight: 476.48456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2CNC3=NC=NC4=C3N=CN4C5C(C(C(O5)C(=O)O)N)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2CNC3=NC=NC4=C3N=CN4C5C(C(C(O5)C(=O)O)N)O

InChI

InChI=1S/C24H24N6O5/c25-17-19(31)23(35-20(17)24(32)33)30-13-29-18-21(27-12-28-22(18)30)26-10-15-8-4-5-9-16(15)34-11-14-6-2-1-3-7-14/h1-9,12-13,17,19-20,23,31H,10-11,25H2,(H,32,33)(H,26,27,28)