(1S,6R,8R,9R)-8-(6-aminopurin-9-yl)-3-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-3-oxo-2,4,7-trioxa-3λ5-phosphabicyclo[4.3.0]nonan-9-ol

Molecular Formula: C19H21N6O10P


InChI: InChI=1/C19H21N6O10P/c1-30-11-3-9(10(25(27)28)4-12(11)31-2)5-32-36(29)33-6-13-16(35-36)15(26)19(34-13)24-8-23-14-17(20)21-7-22-18(14)24/h3-4,7-8,13,15-16,19,26H,5-6H2,1-2H3,(H2,20,21,22)/t13-,15-,16-,19-,36u/m1/s1/f/h20H2

InChIKey: InChIKey=DLFFGJVBHVWTLX-RMIHJXRBDC
SMILES: COC1=C(C=C(C(=C1)COP2(=O)OCC3C(O2)C(C(O3)N4C=NC5=C4N=CN=C5N)O)[N+](=O)[O-])OC

Names:
    (1S,6R,8R,9R)-8-(6-aminopurin-9-yl)-3-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-3-oxo-2,4,7-trioxa-3λ5-phosphabicyclo[4.3.0]nonan-9-ol

Registries:
    PubChem CID 124793
    PubChem ID 10241179