Name: N-Acetyl-S-(2-hydroxyethyl-[d4])-L-cysteine Dicyclohexylamine Salt
Brand: BOC Sciences
Rating: 5 (1 reviews)

General Information

Catalog: BLP-009922

CAS: 1331894-57-5

Molecular Formula: C19H32D4N2O4S

Molecular Weight: 392.59

Chemical Structure

Synonyms	L-S-(2-Hydroxyethyl-d4)mercapturic Acid
IUPAC Name	(2R)-2-acetamido-3-(1,1,2,2-tetradeuterio-2-hydroxyethyl)sulfanylpropanoic acid;N-cyclohexylcyclohexanamine
Related CAS	1331896-18-4 (unlabelled)
Isomeric SMILES	[2H]C([2H])(C([2H])([2H])SC[C@@H](C(=O)O)NC(=O)C)O.C1CCC(CC1)NC2CCCCC2
Canonical SMILES	CC(=O)NC(CSCCO)C(=O)O.C1CCC(CC1)NC2CCCCC2
InChI	InChI=1S/C12H23N.C7H13NO4S/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-5(10)8-6(7(11)12)4-13-3-2-9/h11-13H,1-10H2;6,9H,2-4H2,1H3,(H,8,10)(H,11,12)/t;6-/m.0/s1/i;2D2,3D2
InChI Key	XLGHARKAPCCVFZ-XAEDZKCESA-N
Purity	95% by HPLC; 98% atom D

N-Acetyl-S-(2-hydroxyethyl-[d4])-L-cysteine Dicyclohexylamine Salt is a chemical compound with various applications in bioscience and pharmaceutical research. Here are some key applications:

Metabolomics Research: This compound is used as an internal standard in mass spectrometry-based metabolomics studies. Its unique isotopic labeling helps in accurately quantifying metabolites in complex biological samples. Researchers rely on it to ensure precision and reliability in metabolic profiling and biomarker discovery.

Pharmacokinetics: N-Acetyl-S-(2-hydroxyethyl-[d4])-L-cysteine Dicyclohexylamine Salt is pivotal in studying the pharmacokinetics of drugs and their metabolites. By using this compound, scientists can trace the drug’s metabolism and excretion pathways in preclinical and clinical trials. This information is crucial for optimizing drug dosing and minimizing adverse effects.

Toxicology Studies: In toxicology, this compound is employed to analyze the detoxification processes in the body. Its effectiveness in tracing the conjugation and excretion of toxins provides insights into the body’s defense mechanisms. This application helps in assessing the safety and potential toxicity of new chemical entities.

Biochemical Assays: This isotopically-labeled compound is used in various biochemical assays to study enzyme activities and metabolic pathways. Its specific labeling allows for precise monitoring of biochemical reactions and metabolic fluxes. Researchers utilize this tool to explore enzyme kinetics and the regulatory mechanisms of metabolic pathways.