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CAS 16652-75-8

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L-Isoleucine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)

Description:
L-Isoleucine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1), with the CAS number 16652-75-8, is a chemical compound that combines an amino acid derivative with a sulfonate group. This compound features L-isoleucine, an essential branched-chain amino acid important for protein synthesis and metabolic processes, esterified with phenylmethyl (benzyl) to enhance its lipophilicity and potentially improve its bioavailability. The presence of the 4-methylbenzenesulfonate moiety contributes to its solubility and stability in various solvents. Typically, such compounds are utilized in biochemical research, particularly in studies involving protein interactions, enzyme activity, and drug formulation. The characteristics of this compound may include moderate to high solubility in organic solvents, potential for forming salts, and specific reactivity patterns due to the functional groups present. As with many amino acid derivatives, it may exhibit chirality, influencing its biological activity and interactions in physiological systems. Proper handling and storage conditions are essential to maintain its integrity and efficacy in laboratory settings.
Formula:C13H19NO2·C7H8O3S
InChI:InChI=1S/C13H19NO2.C7H8O3S/c1-3-10(2)12(14)13(15)16-9-11-7-5-4-6-8-11;1-6-2-4-7(5-3-6)11(8,9)10/h4-8,10,12H,3,9,14H2,1-2H3;2-5H,1H3,(H,8,9,10)/t10-,12-;/m0./s1
InChI key:InChIKey=XAWVXTVKSVYPNE-JGAZGGJJSA-N
SMILES:C(OC([C@H]([C@H](CC)C)N)=O)C1=CC=CC=C1.S(=O)(=O)(O)C1=CC=C(C)C=C1
Synonyms:
  • (2S,3S)-1-(benzyloxy)-3-methyl-1-oxopentan-2-aminium 4-methylbenzenesulfonate
  • <span class="text-smallcaps">L</span>-Isoleucine benzyl ester p-toluenesulfonate
  • <span class="text-smallcaps">L</span>-Isoleucine benzyl ester tosylate
  • <span class="text-smallcaps">L</span>-Isoleucine, phenylmethyl ester, 4-methylbenzenesulfonate
  • <span class="text-smallcaps">L</span>-Isoleucine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)
  • Benzyl <span class="text-smallcaps">L</span>-isoleucinate p-toluenesulfonate
  • Benzyl <span class="text-smallcaps">L</span>-isoleucinate tosylate
  • H-Ile-OBzl.Tos
  • H-Ile-OBzl・Tosh
  • Isoleucine benzyl ester p-toluenesulfonate
  • See more synonyms
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