title: Ultra-high performance liquid chromatography coupled with photo-diode array and quadrupole/time-of-flight mass spectrometry based chemical profiling approach to evaluate the influence of preparation methods on the holistic quality of Qiong-Yu-Gao, a traditional complex herbal medicine.
abstract: Qiong-Yu-Gao (QYG), consisting of Rehmanniae Radix (RR), Poriae (PO) and Ginseng Radix (GR), is a commonly used tonic traditional complex herbal medicine (CHM). So far, three different methods have been documented for preparation of QYG, i.e. method 1 (M1): mixing powders of GR and PO with decoction of RR; method 2 (M2): combining the decoction of RR and PO with the decoction of GR; method 3 (M3): decocting the mixture of RR, GR and PO. In present study, an ultra-high performance liquid chromatography coupled with photo-diode array and quadrupole/time-of-flight mass spectrometry (UHPLC-PDA-QTOF-MS/MS) based chemical profiling approach was developed to investigate the influence of the three preparation methods on the holistic quality of QYG. All detected peaks were unambiguously identified by comparing UV spectra, accurate mass data/characteristic mass fragments and retention times with those of reference compounds, and/or tentatively assigned by matching empirical molecular formula with that of known compounds, and/or elucidating quasi-molecular ions and fragment ions referring to information available in literature. A total of 103 components, mainly belonging to ginsenosides, phenethylalcohol glycosides, iridoid glycosides and triterpenoid acids, were identified, of which 5 degraded ginsenosides were putatively determined to be newly generated during preparation procedures of QYG samples. Triterpenoid acids and malonyl-ginsenosides were detected only in M1 samples, while degraded ginsenosides were merely detectable in M2/M3 samples. The possible reasons for the difference among chemical profiles of QYG samples prepared with three methods were also discussed. It could be concluded that preparation method do significantly affect the holistic quality of QYG. The influence of the altered chemical profiles on the bioactivity of QYG needs further investigation. The present study demonstrated that UHPLC-PDA-QTOF-MS/MS based chemical profiling approach is efficient and reliable for evaluating the holistic quality of traditional CHM.
authors.affiliation: Department of Pharmaceutical Analysis and Metabolomics, Jiangsu Province Academy of Traditional Chinese Medicine, Nanjing 210028, China.
authors.forename: Jin-Di
authors.initials: JD
authors.lastname: Xu
authors.forename: Qian
authors.initials: Q
authors.lastname: Mao
authors.forename: Hong
authors.initials: H
authors.lastname: Shen
authors.forename: Ling-Ying
authors.initials: LY
authors.lastname: Zhu
authors.forename: Song-Lin
authors.initials: SL
authors.lastname: Li
authors.forename: Ru
authors.initials: R
authors.lastname: Yan
mesh_terms: D000363:Agaricales / Q000737:chemistry*; D002851:Chromatography, High Pressure Liquid / Q000379:methods*; D004365:Drugs, Chinese Herbal / Q000737:chemistry*; D036145:Ginsenosides / Q000032:analysis; D006027:Glycosides / Q000032:analysis; D029001:Herbal Medicine / Q000379:methods; D057889:Iridoid Glycosides / Q000032:analysis; D005894:Panax / Q000737:chemistry*; D032267:Rehmannia / Q000737:chemistry*; D053719:Tandem Mass Spectrometry / Q000379:methods*; D014315:Triterpenes / Q000032:analysis
chemical_list: D004365:Drugs, Chinese Herbal; D036145:Ginsenosides; D006027:Glycosides; D057889:Iridoid Glycosides; D014315:Triterpenes
keywords: Chemical profiling; Ginseng Radix; Poriae; Qiong-Yu-Gao; Rehmanniae Radix; UHPLC-PDA-QTOF–MS/MS