N-Acetyl-S-(2-hydroxy-1-phenylethyl)-L-cysteine + N-Acetyl-S-(2-hydroxy-2-phenylethyl)-L-cysteine (Mixture)
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- structure.search.product.name N-Acetyl-S-(2-hydroxy-1-phenylethyl)-L-cysteine + N-Acetyl-S-(2-hydroxy-2-phenylethyl)-L-cysteine (Mixture)
- Product Code: TRC-A179025
- Brand: TRC
Product Overview
Product Code
TRC-A179025
Product Format
Neat
Molecular Formula
C13H17NO4S
Molecular Weight
283.34
Product Categories
Product Type
MetaboliteAlternate CAS Number
Documentation
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Product Information
Chemical Data
Analyte Name
N-Acetyl-S-(2-hydroxy-1-phenylethyl)-L-cysteine + N-Acetyl-S-(2-hydroxy-2-phenylethyl)-L-cysteine (Mixture)
Molecular Formula
C13H17NO4S
Molecular Weight
283.34
Accurate Mass
283.09
SMILES
OCC(SC[C@@H](C(O)=O)NC(C)=O)[C+]1=CC=CC=C1.OC(CSC[C@@H](C(O)=O)NC(C)=O)C2=CC=CC=C2
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
IUPAC
N-Acetyl-S-(2-hydroxy-1-phenylethyl)-L-cysteine +N-Acetyl-S-(2-hydroxy-2-phenylethyl)-L-cysteine
Alternate CAS Number
69278-53-1 + 14510-10-2
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat
Product Description
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),
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