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CAS 270065-72-0

:

(βS)-β-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-4-iodobenzenebutanoic acid

Description:
The chemical substance known as (βS)-β-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-4-iodobenzenebutanoic acid, with the CAS number 270065-72-0, 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 iodine atom in the para position of the aromatic ring enhances its reactivity and can facilitate further chemical modifications. The structure includes a butanoic acid moiety, contributing to its acidic properties. The β-amino acid configuration suggests potential applications in the development of bioactive peptides, as β-amino acids can impart unique conformational and functional properties to peptides. Overall, this compound is characterized by its complex structure, which combines elements of aromatic chemistry, amino acid functionality, and protective group strategies, making it a valuable tool in organic synthesis and drug development.
Formula:C25H22INO4
InChI:InChI=1S/C25H22INO4/c26-17-11-9-16(10-12-17)13-18(14-24(28)29)27-25(30)31-15-23-21-7-3-1-5-19(21)20-6-2-4-8-22(20)23/h1-12,18,23H,13-15H2,(H,27,30)(H,28,29)/t18-/m0/s1
InChI key:InChIKey=HTZYQICRFPOZOG-SFHVURJKSA-N
SMILES:C(OC(N[C@@H](CC1=CC=C(I)C=C1)CC(O)=O)=O)C2C=3C(C=4C2=CC=CC4)=CC=CC3
Synonyms:
  • (3S)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4-(4-iodophenyl)butanoic acid
  • (βS)-β-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-4-iodobenzenebutanoic acid
  • Benzenebutanoic acid, β-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-iodo-, (βS)-
  • Fmoc-L-3-Amino-4-(4-iodophenyl)-butyric acid
  • Fmoc-β-HoPhe(4-I)-OH
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