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CAS 135592-14-2

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N-[(1,1-Dimethylethoxy)carbonyl]-3-[(triphenylmethyl)thio]-D-valine

Description:
N-[(1,1-Dimethylethoxy)carbonyl]-3-[(triphenylmethyl)thio]-D-valine, with CAS number 135592-14-2, is a synthetic compound that belongs to the class of amino acid derivatives. This substance features a D-valine backbone, which is an essential amino acid, modified with a triphenylmethyl thio group and a dimethylethoxycarbonyl protecting group. The presence of the triphenylmethyl group imparts significant steric bulk, which can influence the compound's reactivity and solubility. The dimethylethoxycarbonyl moiety serves as a protective group, commonly used in peptide synthesis to prevent unwanted reactions at the amino group. The compound is likely to exhibit characteristics typical of amino acids, such as solubility in polar solvents and potential for forming hydrogen bonds. Its structural complexity suggests potential applications in medicinal chemistry, particularly in the design of peptide-based therapeutics or as intermediates in organic synthesis. However, specific physical and chemical properties such as melting point, boiling point, and solubility would require empirical determination or literature reference for precise values.
Formula:C29H33NO4S
InChI:InChI=1S/C29H33NO4S/c1-27(2,3)34-26(33)30-24(25(31)32)28(4,5)35-29(21-15-9-6-10-16-21,22-17-11-7-12-18-22)23-19-13-8-14-20-23/h6-20,24H,1-5H3,(H,30,33)(H,31,32)/t24-/m0/s1
InChI key:InChIKey=GFULWLRDJMLHCD-DEOSSOPVSA-N
SMILES:C(SC([C@@H](NC(OC(C)(C)C)=O)C(O)=O)(C)C)(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
Synonyms:
  • N-[(1,1-Dimethylethoxy)carbonyl]-3-[(triphenylmethyl)thio]-D-valine
  • D-Valine, N-[(1,1-dimethylethoxy)carbonyl]-3-[(triphenylmethyl)thio]-
  • (2S)-3-Methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-tritylsulfanylbutanoic acid
  • See more synonyms
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