N-Acetyl-S-(2-hydroxy-1-phenylethyl)-L-cysteine + N-Acetyl-S-(2-hydroxy-2-phenylethyl)-L-cysteine (Mixture)

CAS: 14510-10-2, 69278-53-1

Ref. TR-A179025

Product Information

• Name: N-Acetyl-S-(2-hydroxy-1-phenylethyl)-L-cysteine + N-Acetyl-S-(2-hydroxy-2-phenylethyl)-L-cysteine (Mixture)
• Synonyms: N-Acetyl-S-(1-phenyl-2-hydroxyethyl)-L-cysteine + N-acetyl-S-(2-phenyl-2-hydroxyethyl)-L-cysteine
• Brand: TRC

Description

Stability Hygroscopic
Applications A mixture of 2 metabolites of Styrene. The 2 regioisomers are in a roughly 3: 1ratio
References Ryan, A., et al.: Drug Metab. Dispos., 5, 363 (1977), Delbressine, L., et al.: Xenobiotica, 11, 589 (1981), Truchon, G., et al.: J. Anal. Toxicol., 14, 227 (1990),

Chemical properties

• Molecular weight: 283.34
• Formula: C₁₃H₁₇NO₄S
• Color/Form: Neat
• InChI: InChI=1S/2C13H17NO4S/c1-9(16)14-11(13(17)18)8-19-12(7-15)10-5-3-2-4-6-10;1-9(15)14-11(13(17)18)7-19-8-12(16)10-5-3-2-4-6-10/h2-6,11-12,15H,7-8H2,1H3,(H,14,16)(H,17,18);2-6,11-12,16H,7-8H2,1H3,(H,14,15)(H,17,18)/q+1;/t2*11-,12?/m00/s1
• SMILES: CC(=O)N[C@@H](CSC(CO)[C+]1=CC=CC=C1)C(=O)O.CC(=O)N[C@@H](CSCC(O)c1ccccc1)C(=O)O