(1S,2R,6R)-6-(6-aminopurin-9-yl)cyclohex-3-ene-1,2-diol

Systemtic Name: (1S,2R,6R)-6-(6-aminopurin-9-yl)cyclohex-3-ene-1,2-diol Openeye Name: (1S,2R,6R)-6-(6-aminopurin-9-yl)cyclohex-3-ene-1,2-diol CAS Name: (1S,2R,6R)-6-(6-aminopurin-9-yl)cyclohex-3-ene-1,2-diol IUPAC Name: (1S,2R,6R)-6-(6-aminopurin-9-yl)cyclohex-3-ene-1,2-diol Traditional Name: (1S,2R,6R)-6-adenin-9-ylcyclohex-3-ene-1,2-diol Formula: C11H13N5O2 MolecularWeight: 247.25322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C(C1N2C=NC3=C2N=CN=C3N)O)O

Isomeric SMILES

C1C=C[C@H]([C@H]([C@@H]1N2C=NC3=C2N=CN=C3N)O)O

InChI

InChI=1S/C11H13N5O2/c12-10-8-11(14-4-13-10)16(5-15-8)6-2-1-3-7(17)9(6)18/h1,3-7,9,17-18H,2H2,(H2,12,13,14)/t6-,7-,9+/m1/s1