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2172819-76-8

2172819-76-8 Structure

2172819-76-8 Structure
IdentificationBack Directory
[Name]

L-Prolinamide, N-(8-carboxy-1-oxooctyl)-3-methyl-L-valyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-, (4R)-
[CAS]

2172819-76-8
[Synonyms]

VH032-C6-COOH
VH 032 amide-alkylC7-acid
L-Prolinamide, N-(8-carboxy-1-oxooctyl)-3-methyl-L-valyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-, (4R)-
9-(((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)-9-oxononanoic acid
[Molecular Formula]

C31H44N4O6S
[MOL File]

2172819-76-8.mol
[Molecular Weight]

600.77
Chemical PropertiesBack Directory
[Boiling point ]

888.3±65.0 °C(Predicted)
[density ]

1.229±0.06 g/cm3(Predicted)
[solubility ]

DMSO: Soluble: =10 mg/ml
Ethanol: Sparingly soluble: 1-10 mg/mlPBS (pH 7.2): Slightly soluble: 0.1-1 mg/ml
[form ]

Solid
[pka]

4.77±0.10(Predicted)
[color ]

White to off-white
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Thiazole-->2-Cyanothiazole-->Pyrrole-->(R)-3-N-Boc-aminobutan-2-one-->Nonanoic acid
Hazard InformationBack Directory
[Uses]

(S,R,S)-AHPC-amido-C7-acid incorporates a VHL ligand for the E3 ubiquitin ligase and a PROTAC linker. (S,R,S)-AHPC-amido-C5-acid can be used to design PROTACs[1].
[References]

[1] Sun N, et al. Discovery of the First Lactate Dehydrogenase Proteolysis Targeting Chimera Degrader for the Treatment of Pancreatic Cancer. J Med Chem. 2023 Jan 12;66(1):596-610. DOI:10.1021/acs.jmedchem.2c01505
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