5-[6-(cyclohexylamino)purin-9-yl]-3,4-bis(oxidanyl)oxolane-2-carboxylic acid

Systemtic Name: 5-[6-(cyclohexylamino)purin-9-yl]-3,4-bis(oxidanyl)oxolane-2-carboxylic acid Openeye Name: 5-[6-(cyclohexylamino)purin-9-yl]-3,4-dihydroxy-tetrahydrofuran-2-carboxylic acid CAS Name: 5-[6-(cyclohexylamino)-9-purinyl]-3,4-dihydroxy-2-oxolanecarboxylic acid IUPAC Name: 5-[6-(cyclohexylamino)purin-9-yl]-3,4-dihydroxyoxolane-2-carboxylic acid Traditional Name: 5-[6-(cyclohexylamino)purin-9-yl]-3,4-dihydroxy-tetrahydrofuran-2-carboxylic acid Formula: C16H21N5O5 MolecularWeight: 363.36844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)C(=O)O)O)O

Isomeric SMILES

C1CCC(CC1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)C(=O)O)O)O

InChI

InChI=1S/C16H21N5O5/c22-10-11(23)15(26-12(10)16(24)25)21-7-19-9-13(17-6-18-14(9)21)20-8-4-2-1-3-5-8/h6-8,10-12,15,22-23H,1-5H2,(H,24,25)(H,17,18,20)