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基于 UPLC-Q-TOF/MS 和 UPLC-QQQ/MS 的非靶向筛查和定量分析策略的建立,以提高五灵胶囊的质量控制。

Development of a Non-Target Screening and Quantitative Analysis Strategy Based on UPLC-Q-TOF/MS and UPLC-QQQ/MS to Improve the Quality Control of Wuling Capsule.

机构信息

Chengdu Institute of Biology, Chinese Academy of Sciences, Chengdu 610041, China.

Sichuan Center for Disease Control and Prevention, Chengdu 610041, China.

出版信息

Molecules. 2024 May 31;29(11):2598. doi: 10.3390/molecules29112598.

Abstract

Herbal medicine has been widely valued because of its remarkable efficacy and minimal side effects. The quantitative analysis of herbal medicines is essential to ensure their safety and efficacy. The simultaneous detection of multiple quality markers (Q-markers) has emerged as an important approach and trend in herbal medicine quality control. In recent years, non-targeted screening has become an effective strategy for the discovery and identification of unknown compounds. This study developed a non-targeted screening and quantitative analysis strategy to discover, identify and quantify the multiple components that truly represent the efficacy of Wuling capsule. Within this strategy, 18 types of flavonoids were tentatively discovered and identified from Wuling capsule by analyzing mass cleavage pathways, the precise molecular weights of compounds, and comparing the data with a database. Ten types of flavonoids were determined after the comparison of the standards. Additionally, following the evaluation of the regression equation, linear range, limit of detection (LOD), limit of quantitation (LOQ), precision, repeatability, and recovery of the proposed quantitative method, six flavonoids were quantified. This method successfully screened, identified, and quantified the potential active components in Wuling capsule, providing insights for improving the quality control standards in other herbal medicines.

摘要

草药因其显著的疗效和极小的副作用而备受重视。草药的定量分析对于确保其安全性和疗效至关重要。同时检测多个质量标志物(Q-标志物)已成为草药质量控制的重要方法和趋势。近年来,非靶向筛选已成为发现和鉴定未知化合物的有效策略。本研究开发了一种非靶向筛选和定量分析策略,以发现、鉴定和定量真正代表五灵胶囊疗效的多种成分。在该策略中,通过分析质量裂解途径、化合物的精确分子量以及与数据库比较,从五灵胶囊中初步发现和鉴定了 18 种黄酮类化合物。经过与标准品的比较,确定了 10 种黄酮类化合物。此外,在对所提出的定量方法的回归方程、线性范围、检测限(LOD)、定量限(LOQ)、精密度、重复性和回收率进行评估后,对六种黄酮类化合物进行了定量。该方法成功地对五灵胶囊中的潜在活性成分进行了筛选、鉴定和定量,为提高其他草药的质量控制标准提供了思路。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dac7/11173814/0bc8b85a06ec/molecules-29-02598-g001.jpg

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