[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl cyclohexanecarboxylate

Systemtic Name: [(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl cyclohexanecarboxylate Openeye Name: [(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [(2R,3S,5R)-5-adenin-9-yl-3-hydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C17H23N5O4 MolecularWeight: 361.39562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OCC2C(CC(O2)N3C=NC4=C3N=CN=C4N)O

Isomeric SMILES

C1CCC(CC1)C(=O)OC[C@@H]2[C@H](C[C@@H](O2)N3C=NC4=C3N=CN=C4N)O

InChI

InChI=1S/C17H23N5O4/c18-15-14-16(20-8-19-15)22(9-21-14)13-6-11(23)12(26-13)7-25-17(24)10-4-2-1-3-5-10/h8-13,23H,1-7H2,(H2,18,19,20)/t11-,12+,13+/m0/s1