Z-L-aspartic acid β-tert-butyl ester monohydrate
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Z-L-aspartic acid β-tert-butyl ester monohydrate

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Category
CBZ-Amino Acids
Catalog number
BAT-003331
CAS number
229957-50-0
Molecular Formula
C16H21NO6·H2O
Molecular Weight
341.30
Z-L-aspartic acid β-tert-butyl ester monohydrate
IUPAC Name
(2S)-4-[(2-methylpropan-2-yl)oxy]-4-oxo-2-(phenylmethoxycarbonylamino)butanoic acid;hydrate
Alternative CAS
5545-52-8
Synonyms
Z-L-Asp(OtBu)-OH H2O; (S)-2-(((Benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanoic acid hydrate
Appearance
White to off-white powder
Purity
≥ 99% (HPLC)
Density
1.219 g/cm3
Melting Point
52-58 °C
Boiling Point
513.1°C
Storage
Store at 2-8 °C
InChI
InChI=1S/C16H21NO6.H2O/c1-16(2,3)23-13(18)9-12(14(19)20)17-15(21)22-10-11-7-5-4-6-8-11;/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,19,20);1H2/t12-;/m0./s1
InChI Key
UWDOQNWFLPMMLQ-YDALLXLXSA-N
Canonical SMILES
CC(C)(C)OC(=O)CC(C(=O)O)NC(=O)OCC1=CC=CC=C1.O

Z-L-aspartic acid β-tert-butyl ester monohydrate is a chemical compound with specific applications in the field of bioscience and biotechnology. Here are some key applications of Z-L-aspartic acid β-tert-butyl ester monohydrate:

Peptide Synthesis: Z-L-aspartic acid β-tert-butyl ester monohydrate is widely used as a building block in peptide synthesis. Its protected ester form makes it a valuable intermediate for creating complex peptides. Researchers use it to introduce aspartic acid residues in a controlled manner, ensuring the correct sequence and structure of the synthesized peptides.

Drug Development: In pharmaceutical research, Z-L-aspartic acid β-tert-butyl ester monohydrate serves as a precursor in the synthesis of bioactive compounds. Its use allows for the strategic incorporation of aspartic acid into drug molecules. This can enhance the drug's efficacy, stability, and bioavailability, providing a pathway for developing new therapeutic agents.

Enzyme Inhibition Studies: Z-L-aspartic acid β-tert-butyl ester monohydrate is used in biochemical research to study enzyme-substrate interactions. By incorporating this compound into various assays, scientists can investigate how modifications to the aspartic acid residue affect enzyme activity. These studies are essential for understanding enzyme mechanisms and developing specific inhibitors.

Biomolecular Research: In the field of structural biology, Z-L-aspartic acid β-tert-butyl ester monohydrate is used in the synthesis of modified proteins and peptides for crystallization and NMR studies. By understanding how this ester affects molecular structures, researchers can gain insights into protein folding and function. This knowledge is critical for designing molecules with desired biological activities.

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