AIDS-133329

Molecular Formula: C₄₀H₅₀N₈O₂₀S₂

InChI: InChI=1/C40H50N8O20S2/c1-15(49)59-13-23-27(61-17(3)51)29(63-19(5)53)31(65-21(7)55)37(67-23)43-33-25(35(57)47-39(45-33)69-9)41-11-12-42-26-34(46-40(70-10)48-36(26)58)44-38-32(66-22(8)56)30(64-20(6)54)28(62-18(4)52)24(68-38)14-60-16(2)50/h11-12,23-24,27-32,37-38,41H,13-14H2,1-10H3,(H2,43,45,47,57)(H,44,46,48,58)/b12-11+,42-26-/f/h43-45H

InChIKey: InChIKey=FMVQVJWKTHRPLR-DBZJXXLSDZ
SMILES: CC(=O)OCC1C(C(C(C(O1)NC2=C(C(=O)N=C(N2)SC)NC=CN=C3C(=NC(=NC3=O)SC)NC4C(C(C(C(O4)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Names:
    AIDS-133329
    AIDS133329
    NSC628735
    [3,5-diacetyloxy-2-(acetyloxymethyl)-6-[[2-methylsulfanyl-5-[[(E)-2-[[2-methylsulfanyl-4-oxo-6-[[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]amino]pyrimidin-5-ylidene]amino]ethenyl]amino]-6-oxo-3H-pyrimidin-4-yl]amino]oxan-4-yl] acetate

Registries:
    PubChem CID 5464981
    PubChem ID 229278