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CAS 135038-59-4

:

N-[(2S)-3-(1,3-Benzodioxol-5-yl)-2-(mercaptomethyl)-1-oxopropyl]-L-alanine

Description:
N-[(2S)-3-(1,3-Benzodioxol-5-yl)-2-(mercaptomethyl)-1-oxopropyl]-L-alanine, with the CAS number 135038-59-4, is a synthetic compound that features a complex structure incorporating both amino acid and aromatic components. This substance is characterized by the presence of a mercaptomethyl group, which contributes to its potential reactivity and biological activity. The benzodioxole moiety is known for its role in various pharmacological activities, often associated with antioxidant properties. The L-alanine component indicates that this compound is an amino acid derivative, which may influence its interactions in biological systems, particularly in protein synthesis or enzyme activity. The stereochemistry of the molecule, denoted by the (2S) configuration, suggests specific spatial arrangements that can affect its biological function and binding affinity to targets. Overall, this compound may have applications in medicinal chemistry, particularly in the development of therapeutic agents, but detailed studies would be necessary to fully elucidate its properties and potential uses.
Formula:C14H17NO5S
InChI:InChI=1S/C14H17NO5S/c1-8(14(17)18)15-13(16)10(6-21)4-9-2-3-11-12(5-9)20-7-19-11/h2-3,5,8,10,21H,4,6-7H2,1H3,(H,15,16)(H,17,18)/t8-,10+/m0/s1
InChI key:InChIKey=TXSINLUUGRGAJO-WCBMZHEXSA-N
SMILES:C([C@@H](C(N[C@H](C(O)=O)C)=O)CS)C=1C=C2C(=CC1)OCO2
Synonyms:
  • L-Alanine, N-[(2S)-3-(1,3-benzodioxol-5-yl)-2-(mercaptomethyl)-1-oxopropyl]-
  • N-[(2S)-3-(1,3-Benzodioxol-5-yl)-2-(mercaptomethyl)-1-oxopropyl]-L-alanine
  • L-Alanine, N-[3-(1,3-benzodioxol-5-yl)-2-(mercaptomethyl)-1-oxopropyl]-, (S)-
  • Alatrioprilat
  • Aladotrilat
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