4-oxidanyl-5-[6-(2-pyridin-2-ylethylamino)purin-9-yl]oxolane-2-carboxylic acid

Systemtic Name: 4-oxidanyl-5-[6-(2-pyridin-2-ylethylamino)purin-9-yl]oxolane-2-carboxylic acid Openeye Name: 4-hydroxy-5-[6-[2-(2-pyridyl)ethylamino]purin-9-yl]tetrahydrofuran-2-carboxylic acid CAS Name: 4-hydroxy-5-[6-[2-(2-pyridinyl)ethylamino]-9-purinyl]-2-oxolanecarboxylic acid IUPAC Name: 4-hydroxy-5-[6-(2-pyridin-2-ylethylamino)purin-9-yl]oxolane-2-carboxylic acid Traditional Name: 4-hydroxy-5-[6-[2-(2-pyridyl)ethylamino]purin-9-yl]tetrahydrofuran-2-carboxylic acid Formula: C17H18N6O4 MolecularWeight: 370.36262

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1C(=O)O)N2C=NC3=C2N=CN=C3NCCC4=CC=CC=N4)O

Isomeric SMILES

C1C(C(OC1C(=O)O)N2C=NC3=C2N=CN=C3NCCC4=CC=CC=N4)O

InChI

InChI=1S/C17H18N6O4/c24-11-7-12(17(25)26)27-16(11)23-9-22-13-14(20-8-21-15(13)23)19-6-4-10-3-1-2-5-18-10/h1-3,5,8-9,11-12,16,24H,4,6-7H2,(H,25,26)(H,19,20,21)