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920606

(S,R,S)-AHPC-piperazine-pyridine-alkyne-NH₂ hydrochloride

Name: (S,R,S)-AHPC-piperazine-pyridine-alkyne-NH2 hydrochloride
Brand: ALDRICH

别名:

(2S,4R)-1-((S)-2-(4-(4-(5-(3-Aminoprop-1-yn-1-yl)pyridin-2-yl)piperazin-1-yl)butanamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide hydrochloride, Crosslinker−E3 Ligase ligand conjugate, Protein degrader building block for PROTAC^® research, Template for synthesis of targeted protein degrader, VH032 conjugate

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About This Item

经验公式（希尔记法）:

C₃₈H₅₀N₈O₄S · xHCl

分子量:

714.92 (free base basis)

MDL编号:

MFCD34549905

UNSPSC代码:

12352200

NACRES:

NA.22

ligand

VH032

质量水平

100

表单

powder or crystals

反应适用性

reactivity: carboxyl reactive
reagent type: ligand-linker conjugate

官能团

amine

储存温度

2-8°C

SMILES字符串

CC(N=CS1)=C1C2=CC=C(CNC([C@@H]3C[C@@H](O)CN3C([C@@H](NC(CCCN(CC4)CCN4C5=CC=C(C#CCN)C=N5)=O)C(C)(C)C)=O)=O)C=C2.Cl

InChI

1S/C38H50N8O4S.ClH/c1-26-34(51-25-42-26)29-12-9-28(10-13-29)23-41-36(49)31-21-30(47)24-46(31)37(50)35(38(2,3)4)43-33(48)8-6-16-44-17-19-45(20-18-44)32-14-11-27(22-40-32)7-5-15-39;/h9-14,22,25,30-31,35,47H,6,8,15-21,23-24,39H2,1-4H3,(H,41,49)(H,43,48);1H/t

InChI key

KKQIIRSKIVMTFT-JNOFBCBOSA-N

应用

Protein degrader building block (S,R,S)-AHPC-piperazine-pyridine-alkyne-NH₂ hydrochloride enables the synthesis of molecules for targeted protein degradation and PROTAC (proteolysis-targeting chimeras) technology. This conjugate contains a von Hippel-Lindau (VHL)-recruiting ligand, a rigid linker, and a pendant amine for reactivity with a carboxylic acid on the target ligand. Because even slight alterations in ligands and crosslinkers can affect ternary complex formation between the target, E3 ligase, and PROTAC, many analogs are prepared to screen for optimal target degradation. When used with other protein degrader building blocks with a pendant amine, parallel synthesis can be used to more quickly generate PROTAC libraries that feature variation in crosslinker length, composition, and E3 ligase ligand.

其他说明

Technology Spotlight: Degrader Building Blocks for Targeted Protein Degradation

Portal: Building PROTAC^® Degraders for Targeted Protein Degradation

Targeted Protein Degradation by Small Molecules

Small-Molecule PROTACS: New Approaches to Protein Degradation

Targeted Protein Degradation: from Chemical Biology to Drug Discovery

Impact of linker length on the activity of PROTACs

法律信息

PROTAC is a registered trademark of Arvinas Operations, Inc., and is used under license

储存分类代码

11 - Combustible Solids

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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