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CAS 1260587-57-2

:

(αS)-α-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-4-methylbenzenebutanoic acid

Description:
The chemical substance known as (αS)-α-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-4-methylbenzenebutanoic acid, with the CAS number 1260587-57-2, is a synthetic compound primarily used in the field of medicinal chemistry and peptide synthesis. This compound features a fluorenylmethoxycarbonyl (Fmoc) protecting group, which is commonly employed to protect amino groups during peptide synthesis. The presence of the 4-methylbenzene moiety indicates that it has a hydrophobic character, which can influence its solubility and interaction with biological systems. The α-amino acid structure suggests that it can participate in peptide bond formation, making it relevant for the development of peptide-based therapeutics. Additionally, the specific stereochemistry indicated by (αS) implies that it has a defined spatial arrangement, which is crucial for its biological activity and interaction with receptors or enzymes. Overall, this compound is characterized by its complex structure, protective groups, and potential applications in drug development and biochemistry.
Formula:C26H25NO4
InChI:InChI=1S/C26H25NO4/c1-17-10-12-18(13-11-17)14-15-24(25(28)29)27-26(30)31-16-23-21-8-4-2-6-19(21)20-7-3-5-9-22(20)23/h2-13,23-24H,14-16H2,1H3,(H,27,30)(H,28,29)/t24-/m0/s1
InChI key:InChIKey=JLOKXQGKJIXTSW-DEOSSOPVSA-N
SMILES:C(OC(N[C@@H](CCC1=CC=C(C)C=C1)C(O)=O)=O)C2C=3C(C=4C2=CC=CC4)=CC=CC3
Synonyms:
  • (αS)-α-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-4-methylbenzenebutanoic acid
  • Benzenebutanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-methyl-, (αS)-
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