CAS: 131685-11-5; N-[2H3]Acetylcysteine

该化合物是N-acetyl-L-cysteine(NAC)的离子模拟物,用取代三种氢原子,这种稳定的同位素标签化合物主要用作基于质量光谱的分析方法的内部标准,确保在药用和代谢研究中精确量化NAC,其结构与NAC相似,可以进行精确校准和最小的矩阵干扰.除子代谢替代可增强分子稳定性,减少代谢干扰,提高探测灵敏度. N-Acetyl-L-cystene-d3在涉及氧化压力,脱毒途径和肌肉活动的研究中特别有用,在这些研究中,高纯度的同位素标准对于可靠的数据解释至关重要.

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3]Acetyl-S-benzylcysteineN-[2H3]Acetyl-S-benzylcysteine cysteine disulfide Acetic anhydride-d6

合成工艺路线路线简述

  • 合成目标产物 N-Acetyl-D3-L-Cysteine 主要起始原料 N-(Acetyl-D3)-S-Benzyl-L-Cysteine
  • (文献来源)合成步骤主要原料 N-(Acetyl-D3)-S-Benzyl-L-Cysteine
📜N-(乙酰基-D3)-S-苄基-L-半胱氨酸置于sodium体系中,用 氨 用作溶剂,以85%的收率获得n-(2H3)乙酰半胱氨酸
参考文献:Urinary Metabolite Profile Of Phenyl And O-Cresyl Glycidyl Ether In Rats: Identification Of A Novel Pathway Leading To N-Acetylserine O-Conjugates
标题:Urinary Metabolite Profile Of Phenyl And O-Cresyl Glycidyl Ether In Rats: Identification Of A Novel Pathway Leading To N-Acetylserine O-Conjugates
摘要:The Urinary Excretion Of Metabolites Of Phenyl Glycidyl Ether (Pge) And O-Cresyl Glycidyl Ether (O-Cge) Was Investigated In Rats. Urine Was Collected,In Fractions,From Rats Intraperitoneally Administered Pge Or O-Cge In Doses Ranging From 0.033 To 1.0 Mmol/kg. The Metabolites Were Extracted From Acidified Urine With Ethyl Acetate Or Diethyl Ether,And Their Identity Was Elucidated By Gc/ms Analysis. The Epoxide Of Pge Can Be Inactivated By Glutathione (Gsh) Conjugation Or Epoxide Hydrolysis. After Further Metabolism,These Routes Lead To The Urinary Excretion Of Phenyl Glycidyl Ether Mercapturic Acid (Pgema) And 3-(Phenyloxy)Lactic Acid (Pola). The Excretion Of Pgema And Pola Was Described Before And Is Confirmed In This Study. Additionally,A New Metabolite Was Identified As N-Acetyl-O-Phenylserine (Naps),Which Is Proposed To Be Formed From Pola By Subsequent Oxidation,Transamination,And N-Acetylation. For Pgema A Linear Dose-Excretion Relationship Was Found (R(2) = 0.988),And The Percentage Of The Dose Excreted Declined From 27 % To 10 % With Increasing Pge Dose. For Naps Also A Linear Dose-Excretion Relationship Was Found (R(2) = 0.985),And Naps Accounted For 27 % Of The Pge Dose. The Excretion Of Pgema And Naps Was Rather Fast: 93 % And 75 %,Respectively,Of The Respective Total Cumulative Amounts Excreted Was Already Collected Within 6 H After Administration. The Urinary Metabolite Profile Of O-Cge Was Not Investigated In Rats Before. Three Urinary Metabolites Of O-Cge Were Identified,Namely,3-(O-Cresyloxy)Lactic Acid (Cola),O-Cresyl Glycidyl Ether Mercapturic Acid (O-Cgema),And N-Acetyl-O-(O-Cresyl)Serine (Nags),Showing That The Metabolite Profiles Of Pge And O-Cge Are Comparable. Up To A O-Cge Dose Of 0.333 Mmol/kg,The Excretion Of O-Cgema Was Linear (R(2) = 0.997),While Above This Dose The Excretion Did Not Increase Anymore. The Percentage Of The O-Cge Dose Excreted As O-Cgema Declined From 31 % To 11 % With Increasing Dose. Again 93 % Of The Total Cumulative Amount Of O-Cgema Excreted Was Collected Within 6 H After Administration Of O-Cge. Analytical Methods Were Developed For The Quantitative Determination Of Mercapturic Acid Metabolites Of Pge And O-Cge. These Methods Were Sufficiently Sensitive For Their Determination In Urine Of Rats Administered Pge Or O-Cge In The Dose Range Applied. It Is Anticipated That The Analytical Methods Developed Are Also Sufficiently Sensitive To Investigate Excretion Of The Mercapturic Acid Metabolites In Humans occupationally Exposed To Low Air Concentrations (< 6 Mg/m(3) Of Air,8H-Twa) Of Pge Or O-Cge.
Doi:10.1021/tx970020N

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✅ COA系统入驻 | 共享模式

合成参考文献


参考文献:10.1007/s002040050319
摘要:Lock EA, Sani Y, Moore RB, Finkelstein MB, Anders MW, Seawright AA. Bone marrow and renal injury associated with haloalkene cysteine conjugates in calves. Archives of Toxicology. 1996 Aug 01;70(10):607–19. doi: 10.1007/s002040050319.
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