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However, its systematic chemical composition analysis and important marker components remain unclear, which hinders the development of standards or guidelines for quality evaluation. Herein, a high\u2010resolution and efficient method was established to comprehensively investigate the chemical ingredients and metabolites of LBHX by using gas chromatography\u2010tandem mass spectrometry and ultra\u2010high\u2010performance liquid chromatography coupled with quadrupole time\u2010of\u2010flight mass spectrometry. AutoDock Vina was applied to conduct visual screening for identifying potential active compounds targeting two important sick sinus syndrome\u2010associated proteins. As a result, 53 volatile compounds, as well as 191 non\u2010volatile chemical components, including bufadienolides, diterpenoids, bile acids, phenolic acids, and triterpenoid saponins, were unambiguously characterized or tentatively identified. Fifty prototypes and 62 metabolites were identified in the plasma of rats, whilst metabolism reactions included phase I reactions (hydrolysis, oxidation, and hydroxylation) and phase II reactions (glucuronidation and methylation). Eleven compounds with good binding affinity have been observed by docking with key proteins. It is the first systematic study on the pharmacodynamic material basis of LBHX and the result consolidates the foundation for further study regarding the mechanism in treating cardiovascular diseases.<\/jats:p>","DOI":"10.1002\/jssc.202300233","type":"journal-article","created":{"date-parts":[[2023,11,27]],"date-time":"2023-11-27T19:41:31Z","timestamp":1701114091000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":8,"title":["Chemical components characterization and in vivo metabolites profiling of Lingbao Huxin Dan by gas chromatography\u2010mass spectrometry and ultra\u2010high\u2010performance liquid chromatography\u2010tandem quadrupole time\u2010of\u2010flight mass spectrometry"],"prefix":"10.1002","volume":"47","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-0561-1471","authenticated-orcid":false,"given":"Fan","family":"Huang","sequence":"first","affiliation":[{"name":"Institute of Interdisciplinary Integrative Medicine Research Shanghai University of Traditional Chinese Medicine  Shanghai China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Ziying","family":"Wang","sequence":"additional","affiliation":[{"name":"Tianjin University of Science and Technology School of Biological Engineering  Tianjin China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Lulu","family":"Wang","sequence":"additional","affiliation":[{"name":"School of Pharmacy Dali University  Dali China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Ruxia","family":"Liu","sequence":"additional","affiliation":[{"name":"Department of Pharmacy Fujian University of Traditional Chinese Medicine Fuzhou  Fujian China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Chi","family":"Ma","sequence":"additional","affiliation":[{"name":"Institute of Interdisciplinary Integrative Medicine Research Shanghai University of Traditional Chinese Medicine  Shanghai China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Yanzhong","family":"Che","sequence":"additional","affiliation":[{"name":"Lei Yun Shang Pharmaceutical Co., Ltd.  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