(S,R,S)-AHPC-PEG5-COOH

For research use only. Not for therapeutic Use.

  • CAT Number: I017715
  • CAS Number: 2172820-14-1
  • Molecular Formula: C36H54N4O11S
  • Molecular Weight: 750.90
  • Purity: ≥95%
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(S,R,S)-AHPC-PEG5-COOH (CAT: I017715) is a synthetic E3 ligase ligand-linker conjugate designed for use in PROTAC (proteolysis-targeting chimera) technology. It features the (S,R,S)-AHPC-based VHL ligand, which binds to the von Hippel–Lindau (VHL) E3 ubiquitin ligase, connected via a five-unit PEG linker terminating in a carboxylic acid group for target conjugation. This bifunctional intermediate enables the creation of heterobifunctional molecules that recruit target proteins to the ubiquitin–proteasome system for selective degradation. Owing to its optimal linker length and chemical versatility, (S,R,S)-AHPC-PEG5-COOH serves as a key building block in PROTAC design and structure–activity optimization.


CAS Number 2172820-14-1
Synonyms

3-[2-[2-[2-[2-[3-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid

Molecular Formula C36H54N4O11S
Purity ≥95%
IUPAC Name 3-[2-[2-[2-[2-[3-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
InChI InChI=1S/C36H54N4O11S/c1-25-32(52-24-38-25)27-7-5-26(6-8-27)22-37-34(45)29-21-28(41)23-40(29)35(46)33(36(2,3)4)39-30(42)9-11-47-13-15-49-17-19-51-20-18-50-16-14-48-12-10-31(43)44/h5-8,24,28-29,33,41H,9-23H2,1-4H3,(H,37,45)(H,39,42)(H,43,44)/t28-,29+,33-/m1/s1
InChIKey YDOJYEPMGKGKQV-ZLWRCJDJSA-N
SMILES CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)C3CC(CN3C(=O)C(C(C)(C)C)NC(=O)CCOCCOCCOCCOCCOCCC(=O)O)O
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