摘要
目的基于总量统计矩(TQSM)与分子连接性指数(MCI)对金银花和山银花互代的双黄连口服液进行质量评价。方法建立双黄连口服液(金银花)和双黄连口服液(山银花)的超高效液相色谱(UPLC)指纹图谱,计算指纹图谱TQSM参数及其相似度;通过查阅相关文献结合TCMSP数据库,建立双黄连口服液(金银花)和双黄连口服液(山银花)化学成分数据库,并将所有成分划分为不同的成分群,计算MCI及其相似度。结果15批双黄连口服液(金银花)色谱峰数目和总量零阶矩(AUCT)均大于双黄连口服液(山银花),总量一阶矩(MRT_(T))和总量二阶矩(VRT_(T))差异均无统计学意义(P<0.05);15批双黄连口服液(金银花)的总量统计矩相似度(TQSMS)为1.0000~0.8246,15批双黄连口服液(山银花)的TQSMS为1.0000~0.6590,15批双黄连口服液(金银花)与15批双黄连口服液(山银花)的TQSMS为1.0000~0.6198。双黄连口服液(金银花)与双黄连口服液(山银花)各类成分的MCI相似度为1.0000~0.9849,其中总体成分的MCI相似度为0.9958。结论双黄连口服液(金银花)与双黄连口服液(山银花)各类成分及整体“印迹模板”无显著差异,推测金银花与山银花互代不会影响双黄连口服液的药效作用性质,但药效作用强度可能存在差异,以双黄连口服液(金银花)为优。
Objective To evaluate the quality of Shuanghuanglian Oral Liquid after mutual substitution of honeysuckle and wild honeysuckle using total quantum statistical moment(TQSM)and molecular connectivity index(MCI).Methods UPLC fingerprint of Shuanghuanglian Oral Liquid(honeysuckle)and Shuanghuanglian oral liquid(wild honeysuckle)were established,the TQSM parameters and similarity of the fingerprint were calculated;by reviewing relevant literature,as well as the Traditional Chinese Medicine Systems Pharmacology Database and Analysis Platform(TCMSP),chemical composition databases for Shuanghuanglian Oral Liquid(honeysuckle)and Shuanghuanglian Oral Liquid(wild honeysuckle)was established,all components were divided into different component groups,and MCI and its similarity were calculated.Results The number of chromatographic peaks and total zero order moment(AUCT)of 15 batches of Shuanghuanglian Oral Liquid(honeysuckle)were higher than those of Shuanghuanglian Oral Liquid(wild honeysuckle),but there was no significant difference in total first order moment(MRT_(T))and total second order moment(VRT_(T));the total quantum statistical moment similarity(TQSMS)between 15 batches of Shuanghuanglian Oral Liquid(honeysuckle)was 1.0000-0.8246,the TQSMS between 15 batches of Shuanghuanglian Oral Liquid(wild honeysuckle)was 1.0000-0.6590,and the TQSMS between 15 batches of Shuanghuanglian Oral Liquid(honeysuckle)and Shuanghuanglian Oral Liquid(wild honeysuckle)was 1.0000-0.6198.The MCI similarity of various components between Shuanghuanglian Oral Liquid(honeysuckle)and Shuanghuanglian Oral Liquid(wild honeysuckle)was 1.0000-0.9849,with an overall MCI similarity of 0.9958.Conclusion There is no significant difference in the various components and overall“imprinting template”between Shuanghuanglian Oral Liquid(honeysuckle)and Shuanghuanglian Oral Liquid(wild honeysuckle).It is speculated that the substitution of honeysuckle and wild honeysuckle will not affect the pharmacological properties of Shuanghuanglian Oral Liquid,but there may be differences in the intensity of pharmacological effects,with Shuanghuanglian Oral Liquid(honeysuckle)being the most effective.
作者
李海英
李文姣
谯茹
陈凡
高湘婷
薛晓
刘林劵
肖美凤
贺鹏
贺福元
LI Haiying;LI Wenjiao;QIAO Ru;CHEN Fan;GAO Xiangting;XUE Xiao;LIU Linjuan;XIAO Meifeng;HE Peng;HE Fuyuan(The First Hospital of Hunan University of Chinese Medicine,Changsha 410007,China;The Second Affiliated Hospital of Hunan University of Chinese Medicine,Changsha 410005,China;College of Pharmacy,Hunan University of Chinese Medicine,Changsha 410208,China;The First Affiliated Hospital,Hengyang Medical School,University of South China,Hengyang 421001,China)
出处
《中国中医药信息杂志》
2025年第9期120-127,共8页
Chinese Journal of Information on Traditional Chinese Medicine
基金
湖南省自然科学基金青年基金项目(2024JJ6362、2023JJ40598)
湖南省卫生健康委卫生科研课题(W20243177)
湖南省教育厅优秀青年项目(24B0428)
湖南中医药大学“揭榜挂帅”专项(2022-12-27-1)。
关键词
分子连接性指数
总量统计矩
印迹模板
指纹图谱
双黄连口服液
金银花
山银花
molecular connectivity index
total quantum statistical moment
imprinting template
fingerprint
Shuanghuanglian Oral Liquid
honeysuckle
wild honeysuckle
