C-C-PPU-LOF

Molecular Formula: C39H50N12O19P2


InChI: InChI=1/C39H50N12O19P2/c1-48(2)32-26-33(43-16-42-32)51(17-44-26)35-27(54)25(47-34(57)19(53)12-18-6-4-3-5-7-18)21(67-35)14-64-71(60,61)70-31-22(68-37(29(31)56)50-11-9-24(41)46-39(50)59)15-65-72(62,63)69-30-20(13-52)66-36(28(30)55)49-10-8-23(40)45-38(49)58/h3-11,16-17,19-22,25,27-31,35-37,52-56H,12-15H2,1-2H3,(H,47,57)(H,60,61)(H,62,63)(H2,40,45,58)(H2,41,46,59)/t19-,20+,21+,22+,25+,27+,28+,29+,30+,31+,35+,36+,37+/m0/s1/f/h47,60,62H,40-41H2

InChIKey: InChIKey=NMKYEWTYESCOPO-BVWLYPGEDB
SMILES: CN(C)C1=NC=NC2=C1N=CN2C3C(C(C(O3)COP(=O)(O)OC4C(OC(C4O)N5C=CC(=NC5=O)N)COP(=O)(O)OC6C(OC(C6O)N7C=CC(=NC7=O)N)CO)NC(=O)C(CC8=CC=CC=C8)O)O

Names:
    C-C-PPU-LOF
    [(2R,3S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-2-[[[(2R,3S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxy-phosphoryl]oxymethyl]-4-hydroxy-oxolan-3-yl]oxy-[[(2R,3S,4R,5R)-5-(6-dimethylaminopurin-9-yl)-4-hydroxy-3-[[(2S)-2-hydroxy-3-phenyl-propanoyl]amino]oxolan-2-yl]methoxy]phosphinic acid

Registries:
    PubChem CID 5326856
    PubChem ID 8142659