(2S)-4-[2-[3-[[4-[[[(2R,3S,4S,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-(hydroxy-oxido-phosphoryl)oxy-tetrahydrofuran-2-yl]methoxy-oxido-phosphoryl]oxy-oxido-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-2-hydroxy-4-oxo-butanoate

More details:

• Systematic name

  (2S)-4-[2-[3-[[4-[[[(2R,3S,4S,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-(hydroxy-oxido-phosphoryl)oxy-tetrahydrofuran-2-yl]methoxy-oxido-phosphoryl]oxy-oxido-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-2-hydroxy-4-oxo-butanoate

• SMILES

  CC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@H]([C@@H]([C@@H](O1)n2cnc3c2ncnc3N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCSC(=O)C[C@@H](C(=O)[O-])O)O

• Std. InChi

  InChI=1S/C25H40N7O20P3S/c1-25(2,19(37)22(38)28-4-3-14(34)27-5-6-56-15(35)7-12(33)24(39)40)9-49-55(46,47)52-54(44,45)48-8-13-18(51-53(41,42)43)17(36)23(50-13)32-11-31-16-20(26)29-10-30-21(16)32/h10-13,17-19,23,33,36-37H,3-9H2,1-2H3,(H,27,34)(H,28,38)(H,39,40)(H,44,45)(H,46,47)(H2,26,29,30)(H2,41,42,43)/p-4

• Std. InChIKey

  HJQWLHMLMCDAEL-UHFFFAOYSA-J

• Cite this record

  CSID:21233629, http://www.chemspider.com/Chemical-Structure.21233629.html (accessed 04:04, Apr 18, 2024)