Name: MDN19780
CAS#: 2172819-78-0
Chemical Formula: C33H48N4O6S
Exact Mass: 628.3295
Molecular Weight: 628.829
Elemental Analysis: C, 63.03; H, 7.69; N, 8.91; O, 15.27; S, 5.10
Description: MDN19780 is a Functionalized von-Hippel-Lindau protein (VHL) ligand for PROTAC? research and development. It incorporates an E3 ligase ligand plus an alkylC9 linker with terminal carboxylic acid ready for conjugation to a target protein ligand. MDN19780 is Part of a range of functionalized tool molecules for PROTAC R&D.
IUPAC/Chemical Name: 11-(((S)-1-((2S,4R)-4-hydroxy-2-((4-(4-methylthiazol-5-yl)benzyl)carbamoyl)pyrrolidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl)amino)-11-oxoundecanoic acid
InChi Key: MTQZLQCVZFDQOZ-DIIXFEDBSA-N
InChi Code: InChI=1S/C33H48N4O6S/c1-22-29(44-21-35-22)24-16-14-23(15-17-24)19-34-31(42)26-18-25(38)20-37(26)32(43)30(33(2,3)4)36-27(39)12-10-8-6-5-7-9-11-13-28(40)41/h14-17,21,25-26,30,38H,5-13,18-20H2,1-4H3,(H,34,42)(H,36,39)(H,40,41)/t25-,26+,30-/m1/s1
SMILES Code: CC1=C(SC=N1)C2=CC=C(CNC([C@@H]3C[C@@H](O)CN3C([C@@H](NC(CCCCCCCCCC(O)=O)=O)C(C)(C)C)=O)=O)C=C2
Appearance: Solid powder
關鍵字： 2172819-78-0;MDN19780;
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