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

Systemtic Name: 4-oxidanyl-5-[6-(phenethylamino)purin-9-yl]oxolane-2-carboxylic acid Openeye Name: 4-hydroxy-5-[6-(phenethylamino)purin-9-yl]tetrahydrofuran-2-carboxylic acid CAS Name: 4-hydroxy-5-[6-(phenethylamino)-9-purinyl]-2-oxolanecarboxylic acid IUPAC Name: 4-hydroxy-5-[6-(phenethylamino)purin-9-yl]oxolane-2-carboxylic acid Traditional Name: 4-hydroxy-5-[6-(phenethylamino)purin-9-yl]tetrahydrofuran-2-carboxylic acid Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1C(=O)O)N2C=NC3=C2N=CN=C3NCCC4=CC=CC=C4)O

Isomeric SMILES

C1C(C(OC1C(=O)O)N2C=NC3=C2N=CN=C3NCCC4=CC=CC=C4)O

InChI

InChI=1S/C18H19N5O4/c24-12-8-13(18(25)26)27-17(12)23-10-22-14-15(20-9-21-16(14)23)19-7-6-11-4-2-1-3-5-11/h1-5,9-10,12-13,17,24H,6-8H2,(H,25,26)(H,19,20,21)