HPLC/qTOF-MS-oriented characteristic components data set and chemometric analysis for the holistic quality control of complex TCM preparations: Niuhuang Shangqing pill as an example

Journal of Pharmaceutical and Biomedical Analysis

Volumn 89, Issue , 2014, Pages 130-141

  Wang, Dan dan ^a   Liang, Jian ^b   Yang, Wen zhi ^a   Hou, Jin jun ^a   Yang, Min ^a   Da, Juan ^a   Wang, Ying ^c   Jiang, Bao hong ^a   Liu, Xuan ^a   Wu, Wan ying ^a   Guo, De an ^a  

^a SHANGHAI INSTITUTE OF MATERIA MEDICA   (China)

^b SHENYANG PHARMACEUTICAL UNIVERSITY   (China)

^c AGILENT TECHNOLOGIES   (China)

Author keywords

Characteristic components data set; Chemometrics; Complex traditional Chinese medicine preparation; High performance liquid chromatography quadrupole time of flight mass spectrometry; Niuhuang Shangqing pill

Indexed keywords

AGLYCONE; ALKALOID; CHINESE DRUG; FLAVONOID; NIUHUANG SHANGQING; TERPENOID; UNCLASSIFIED DRUG;

ARTICLE; CHEMOMETRIC ANALYSIS; CONTROLLED STUDY; DRUG STRUCTURE; FINGER DERMATOGLYPHICS; HIGH PERFORMANCE LIQUID CHROMATOGRAPHY; MATRIX ASSISTED LASER DESORPTION IONIZATION TIME OF FLIGHT MASS SPECTROMETRY; PRIORITY JOURNAL; QUALITATIVE ANALYSIS; QUALITY CONTROL; QUANTITATIVE ANALYSIS;

CHARACTERISTIC COMPONENTS DATA SET; CHEMOMETRICS; COMPLEX TRADITIONAL CHINESE MEDICINE PREPARATION; HIGH PERFORMANCE LIQUID CHROMATOGRAPHY/QUADRUPOLE TIME-OF-FLIGHT MASS SPECTROMETRY; NIUHUANG SHANGQING PILL;

CHROMATOGRAPHY, HIGH PRESSURE LIQUID; DRUGS, CHINESE HERBAL; MEDICINE, CHINESE TRADITIONAL; PLANTS, MEDICINAL; QUALITY CONTROL; TANDEM MASS SPECTROMETRY;

EID: 84888222853     PISSN: 07317085     EISSN: 1873264X     Source Type: Journal    
DOI: 10.1016/j.jpba.2013.10.042     Document Type: Article

References (39)

1. Ye M., Liu S.H., Jiang Z.L., Lee Y.H., Tilton R., Cheng Y.C. Liquid chromatography/mass spectrometry analysis of PHY906, a Chinese medicine formulation for cancer therapy. Rapid Commun. Mass Spectrom. 2007, 21:3593-3607.
2. Hao H.P., Cui N., Wang G.J., Xiang B.R., Liang Y., Xu X.Y., Zhang H., Yang J., Zheng C.N., Wu L., Gong P., Wang W. Global detection and identification of nontarget components from herbal preparations by liquid chromatography hybrid ion trap time-of-flight mass spectrometry and a strategy. Anal. Chem. 2008, 80:8187-8194.
3. Qi L.W., Wen X.D., Cao J., Li C.Y., Li P., Yi L., Wang Y.X., Cheng X.L., Ge X.X. Rapid and sensitive screening and characterization of phenolic acids, phthalides, saponins and isoflavonoids in Danggui Buxue Tang by rapid resolution liquid chromatography/diode-array detection coupled with time-of-flight mass spectrometry. Rapid Commun. Mass Spectrom. 2008, 22:2493-2509.
4. Ni Y.N., Mei M.H., Kokot S. One- and two-dimensional gas chromatography-mass spectrometry and high performance liquid chromatography-diode-array detector fingerprints of complex substances: a comparison of classification performance of similar, complex Rhizoma Curcumae samples with the aid of chemometrics. Anal. Chim. Acta 2012, 712:37-44.
5. Lu L.X., Fan X.M., Liang Q.L., Wang W.K., Wang Y.M., Luo G.A. cDNA microarray for the study of compatibility mechanism of multi-component Chinese medicine new Shuanglong formula. Chem. J. Chin. Univ. 2012, 33:2397-2404.
6. Chung V.Q., Tattersall M., Cheung H.T.A. Interactions of a herbal combination that inhibits growth of prostate cancer cells. Cancer Chemother. Pharmacol. 2004, 53:384-390.
7. Chinese Pharmacopeia Commission Pharmacopoeia of the People' Republic of China 2010, vol. 1. Chinese Medical Science and Technology Press, Beijing. 2010 ed.
8. Yang W.Z., Ye M., Qiao X., Liu C.F., Miao W.J., Bo T., Tao H.Y., Guo D.A. A strategy for efficient discovery of new natural compounds by integrating orthogonal column chromatography and liquid chromatography/mass spectrometry analysis: its application in Panax ginseng, Panax quinquefolium and Panax notoginseng to characterize 437 potential new ginsenosides. Anal. Chim. Acta 2012, 739:56-66.
9. Miao W.J., Wang Q., Bo T., Ye M., Qiao X., Yang W.Z., Xiang C., Guan X.Y., Guo D.A. Rapid characterization of chemical constituents and rats metabolites of the traditional Chinese patent medicine Gegen-Qinlian-Wan by UHPLC/DAD/qTOF-MS. J. Pharm. Biomed. Anal. 2013, 72:99-108.
10. Steinmann D., Ganzera M. Recent advances on HPLC/MS in medicinal plant analysis. J. Pharm. Biomed. Anal. 2011, 55:744-757.
11. Holčapek M., Jirásko R., Lísa M. Recent developments in liquid chromatography-mass spectrometry and related techniques. J. Chromatogr. A 2012, 1259:3-15.
12. Gray M.J., Chang D., Zhang Y., Liu J.X., Bensoussan A. Development of liquid chromatography/mass spectrometry methods for the quantitative analysis of herbal medicine in biological fluids: a review. Biomed. Chromatogr. 2010, 24:91-103.
13. Vaclavik L., Lacina O.J., Hajslova J., Zweigenbaum J. The use of high performance liquid chromatography-quadrupole time-of-flight mass spectrometry coupled to advanced data mining and chemometric tools for discrimination and classification of red wines according to their variety. Anal. Chim. Acta 2011, 685:45-51.
14. Xu W., Zhang J., Huang Z.H., Qiu X.H. Identification of new dianthrone glycosides from Polygonum multiflorum Thunb. using high-performance liquid chromatography coupled with LTQ-Orbitrap mass spectrometry detection: a strategy for the rapid detection of new low abundant metabolites from traditional Chinese medicines. Anal. Methods 2012, 4:1806-1812.
15. Gao W., Yang H., Qi L.W., Liu E.H., Ren M.T., Yan Y.T., Chen J., Li P. Unbiased metabolite profiling by liquid chromatography-quadrupole time-of-flight mass spectrometry and multivariate data analysis for herbal authentication: classification of seven Lonicera species flower buds. J. Chromatogr. A 2012, 1245:109-116.
16. Sun X.B., Chen P., Cook S.L., Jackson G.P., Harnly J.M., Harrington P.B. Classification of cultivation locations of Panax quinquefolius L. samples using high performance liquid chromatography-electrospray ionization mass spectrometry and chemometric analysis. Anal. Chem. 2012, 84:3628-3634.
17. Sun H., Ni B., Zhang A.H., Wang M., Dong H., Wang X.J. Metabolomics study on Fuzi and its processed products using ultra-performance liquid-chromatography/electrospray-ionization synapt high-definition mass spectrometry coupled with pattern recognition analysis. Analyst 2012, 137:170-185.
18. Zhang L., Zhao Y., Zhang L., Liu T., Li C.Y., Jin R., Zhou L., Li J.R. Studies on protective effects of Niuhuang Shangqing pills on cerebral ischemia. Chin. J. Chin. Mater. Med. 2007, 32:943-948.
19. Wang Y.T., Yu Y., Wang Z.M., Zhou X., Bai L.F., Ding L., Zhang H.Q. High-pressure microwave-assisted extraction of baicalin from Niuhuang Shangqing Pills. Chem. J. Chin. Univ. 2006, 27:1862-1864.
20. Wu F., Qiao R.X., Yang R.R., Wang G.H. Studies on the characteristic fingerprint of volatile oils in Niuhuang Shangqing pill (tablet, capsule). Chin. Tradit. Pat. Med. 2012, 34:1388-1390.
21. Chinese Pharmacopeia Commission Pharmacopoeia of the People' Republic of China 2010, vol. 1:554-555. Chinese Medical Science and Technology Press, Beijing. 2010 ed.
22. Liang J., Wu W.Y., Sun G.X., Wang D.D., Hou J.J., Yang W.Z., Jiang B.H., Liu X., Guo D.A. A dynamic multiple reaction monitoring method for the multiple components quantification of complex traditional Chinese medicine preparations: Niuhuang Shangqing pill as an example. J. Chromatogr. A 2013, 1294:58-69.
23. Li S.L., Song J.Z., Qiao C.F., Zhou Y., Qian K.D., Lee K.H., Xu H.X. A novel strategy to rapidly explore potential chemical markers for the discrimination between raw and processed Radix Rehmanniae by UHPLC-TOFMS with multivariate statistical analysis. J. Pharm. Biomed. Anal. 2010, 51:812-823.
24. Cuyckens F., Claeys M. Mass spectrometry in the structural analysis of flavonoids. J. Mass Spectrom. 2004, 39:1-15.
25. Yang W.Z., Ye M., Qiao X., Wang Q., Bo T., Guo D.A. Collision-induced dissociation of 40 flavonoid aglycones and differentiation of the common flavonoid subtypes using electrospray ionization ion-trap tandem mass spectrometry and quadrupole time-of-flight mass spectrometry. Eur. J. Mass Spectrom. 2012, 18:493-503.
26. Xiang C., Qiao X., Ye M., Guo D.A. Classification and distribution analysis of compounds in Glycyrrhiza using licorice compounds database. Acta Pharmacol. Sin. 2012, 47:1023-1030.
27. Ferreres F., Silva B.M., Andrade P.B., Seaba R.M., Ferreira M.A. Approach to the study of C-glycosyl flavones by ion trap HPLC-PAD-ESI/MS/MS: application to seeds of quince (Cydonia oblonga). Phytochem. Anal. 2003, 14:352-359.
28. Zhang W., Saif M.W., Dutschman G.E., Li X., Lam W., Bussom S., Jiang Z.L., Ye M., Chu E., Cheng Y.C. Identification of chemicals and their metabolites from PHY906, a Chinese medicine formulation, in the plasma of a patient treated with irinotecan and PHY906 using liquid chromatography/tandem mass spectrometry (LC/MS/MS). J. Chromatogr. A 2010, 1217:5785-5793.
29. Li C.M., Zhang X.L., Xue X.Y., Zhang F.F., Xu Q., Liang X.M. Structural characterization of iridoid glucosides by ultra-performance liquid chromatography/electrospray ionization quadrupole time-of-flight tandem mass spectrometry. Rapid Commun. Mass Spectrom. 2008, 22:1941-1954.
30. Liu E.H., Qi L.W., Li B., Peng Y.B., Li P., Li C.Y., Cao J. High-speed separation and characterization of major constituents in Radix Paeoniae Rubra by fast high performance liquid chromatography coupled with diode-array detection and time-of-flight mass spectrometry. Rapid Commun. Mass Spectrom. 2009, 23:119-130.
31. Zheng Y.F., Qi L.W., Zhou J.L., Li P. Structural characterization and identification of oleanane-type triterpene saponins in Glycyrrhiza uralensis Fischer by rapid-resolution liquid chromatography coupled with time-of-flight mass spectrometry. Rapid Commun. Mass Spectrom. 2010, 22:3261-3270.
32. Hu Y.M., Su G.H., Sze S.C.W., Ye W.C., Tong Y. Quality assessment of Cortex Phellodendri by high-performance liquid chromatography coupled with electrospray ionization mass spectrometry. Biomed. Chromatogr. 2010, 24:438-453.
33. Chen J.H., Wang F.M., Liu J., Lee F.S.C., Wang X.R., Yang H.H. Analysis of alkaloids in Coptis chinensis Franch by accelerated solvent extraction combined with ultra performance liquid chromatography analysis with photodiode array and tandem mass spectrometry detections. Anal. Chim. Acta 2008, 613:184-195.
34. Ye M., Han J., Chen H.B., Zheng J.H., Guo D.A. Analysis of phenolic compounds in Rhubarbs using liquid chromatography coupled with electrospray ionization mass spectrometry. J. Am. Soc. Mass Spectrom. 2007, 18:82-91.
35. Clifford M.N., Wu W.G., Kirkpatrick J., Jaiswal R., Kuhnert N. Profiling and characterization by liquid chromatography/multi-stage mass spectrometry of the chlorogenic acids in Gardeniae Fructus. Rapid Commun. Mass Spectrom. 2010, 24:3109-3120.
36. Zhang X.Z., Xiao H.B., Xu Q., Li X.L., Wang J.N., Liang X.M. Characterization of phthalides in Ligusticum chuanxiong by liquid chromatographic-atmospheric pressure chemical ionization-mass spectrometry. J. Chromatogr. Sci. 2003, 41:428-433.
37. Guo H., Liu A.H., Ye M., Yang M., Guo D.A. Characterization of phenolic compounds in the fruits of Forsythia suspensa by high-performance liquid chromatography coupled with electrospray ionization tandem mass spectrometry. Rapid Commun. Mass Spectrom. 2007, 21:715-729.
38. Liu N., Yu N.J.J., Li J., Yang Y., Guo J.F.F., Zhao Y.M.M. Simultaneous qualitative analysis of coumarins in the rhizome of Angelica polymorpha Maxim. By LC-DAD-ESI-MS. Chromatographia 2011, 73:1121-1129.
39. Qiao X., Ye M., Liu C.F., Yang W.Z., Miao W.J., Dong J., Guo D.A. A tandem mass spectrometric study of bile acids: interpretation of fragmentation pathways and differentiation of steroid isomers. Steroids 2012, 77:204-211.