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采用超高效液相色谱-四极杆-飞行时间串联质谱(UHPLC-Q-TOF-MS/MS)和超高效液相色谱-串联质谱(UHPLC-MS/MS)对传统中药鸡鸣散及其主要代谢产物在大鼠体内的代谢谱和药代动力学进行鉴定。

Identification for metabolism profiles and pharmacokinetic studies of tradition Chinese prescription Ji-Ming-San and its major metabolites in rats by UHPLC-Q-TOF-MS/MS and UHPLC-MS/MS.

作者信息

Hsieh Cheng-Yang, Wang Ching-Chiung, Tayo Lemmuel L, Tsai Po-Wei, Lee Chia-Jung

机构信息

Program in Clinical Drug Development of Herbal Medicine, College of Pharmacy, Taipei Medical University, Taipei, 110, Taiwan.

Laboratory of Oncology, Pharmacy Practice and Sciences, Graduate School of Pharmaceutical Sciences, Tohoku University, Sendai, Japan.

出版信息

J Food Drug Anal. 2023 Aug 31;31(3):502-518. doi: 10.38212/2224-6614.3473.

Abstract

Ji-Ming-Shan (JMS) is a traditional prescription use for patients with rheumatism, tendons swelling, athlete's foot, diuresis and even gout. This study developed a rapid and sensitive method for the analysis of JMS chemical components in the Traditional Chinese medicine (TCM) prescription and in the serum samples of rats which were administered with the herbal extract. Two mass spectrometric approaches were used namely Ultra-performance liquid chromatography-quadrupole time-of-flight-mass spectrometry (UPLC-Q-TOF-MS) method for the major metabolites of the JMS extract while Ultra-performance liquid chromatography-tandem mass spectrometry (UPLC-MS/MS) was employed for the detection of the JMS metabolites in the sera of rats. It was revealed that the major components in the JMS extract were identified to be narirutin and hesperidin. It was confirmed that 17 compounds were determined in JMS prescription extract and 16 metabolites resulting from the biotransformation of narirutin and hesperidin were identified in the serum samples. In silico analyses also revealed that the metabolite hersperidin-7-glucoside exhibited the best binding ability with respect to the Cyclooxygenase-2 (COX-2) enzyme target. This study showcased the possible biochemical mechanism involved in the therapeutic efficiency of JMS components and their biotransformation products.

摘要

鸡鸣散(JMS)是一种用于治疗风湿、肌腱肿胀、足癣、利尿甚至痛风患者的传统方剂。本研究开发了一种快速灵敏的方法,用于分析中药方剂中的JMS化学成分以及给予草药提取物的大鼠血清样本中的化学成分。使用了两种质谱方法,即超高效液相色谱-四极杆飞行时间质谱(UPLC-Q-TOF-MS)法分析JMS提取物的主要代谢产物,而超高效液相色谱-串联质谱(UPLC-MS/MS)法用于检测大鼠血清中的JMS代谢产物。结果表明,JMS提取物中的主要成分被鉴定为橙皮苷和柚皮苷。已确认在JMS方剂提取物中测定了17种化合物,并在血清样本中鉴定出16种由橙皮苷和柚皮苷生物转化产生的代谢产物。计算机模拟分析还表明,代谢产物橙皮苷-7-葡萄糖苷对环氧合酶-2(COX-2)酶靶点表现出最佳的结合能力。本研究展示了JMS成分及其生物转化产物治疗效果中可能涉及的生化机制。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6fc9/10629916/3aa77beeabf3/jfda-31-03-502f1.jpg

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