Chemometrics-enhanced high performance liquid chromatography-ultraviolet detection of bioactive metabolites from phytochemically unknown plants

Journal of Chromatography A

Volumn 1422, Issue , 2015, Pages 213-221

  Alvarez Zapata, Radamés ^a   Sánchez Medina, Alberto ^b   Chan Bacab, Manuel ^c   García Sosa, Karlina ^a   Escalante Erosa, Fabiola ^a   García Rodríguez, Rosa Virginia ^b   Peña Rodríguez, Luis Manuel ^a  

^a CENTRO DE INVESTIGACIÓN CIENTÍFICA DE YUCATÁN   (Mexico)

^b UNIVERSIDAD VERACRUZANA   (Mexico)

^c UNIVERSIDAD AUTÓNOMA DE CAMPECHE   (Mexico)

Author keywords

Bioactive metabolites; Chemometrics; Chromatographic profiles; Colubrina greggii var. yucatanensis; Leishmanicidal activity; Rhamnaceae

Indexed keywords

BIOMOLECULES; HIGH PERFORMANCE LIQUID CHROMATOGRAPHY; LEAST SQUARES APPROXIMATIONS; MEAN SQUARE ERROR; PLANT EXTRACTS; PREDICTIVE ANALYTICS; PURIFICATION;

CHEMOMETRICS; CHROMATOGRAPHIC PROFILES; COLUBRINA GREGGII VAR. YUCATANENSIS; DETERMINATION COEFFICIENTS; HIGH-PERFOR-MANCE LIQUID CHROMATOGRAPHY-ULTRAVIOLET DETECTIONS; PARTIAL LEAST SQUARE (PLS); RHAMNACEAE; ROOT MEAN SQUARE ERRORS;

METABOLITES;

ANTILEISHMANIAL AGENT; COLUBRINA GREGGII VAR. YUCATANENSIS EXTRACT; PLANT EXTRACT; PLANT MEDICINAL PRODUCT; UNCLASSIFIED DRUG; ANTIPARASITIC AGENT; DRUG MIXTURE;

ANTIPROTOZOAL ACTIVITY; ARTICLE; BIOASSAY; CHEMOMETRICS; COLUBRINA; COLUBRINA GREGGII VAR. YUCATANENSIS; CONTROLLED STUDY; DRUG DETERMINATION; DRUG ISOLATION; DRUG PURIFICATION; DRUG SCREENING; FRACTIONATION; HIGH PERFORMANCE LIQUID CHROMATOGRAPHY; HIGH PERFORMANCE LIQUID CHROMATOGRAPHY ULTRAVIOLET DETECTION; IC50; LEISHMANIA MEXICANA; METABOLITE; ORTHOGONAL PARTIAL LEAST SQUARE; PLANT ROOT; PRINCIPAL COMPONENT ANALYSIS; PRIORITY JOURNAL; QUANTITATIVE ANALYSIS; STATISTICAL ANALYSIS; CHEMISTRY; DRUG EFFECTS; DRUG MIXTURE; ISOLATION AND PURIFICATION; MEDICINAL PLANT; METABOLISM; PROCEDURES; REGRESSION ANALYSIS; ULTRAVIOLET RADIATION;

ANTIPARASITIC AGENTS; CHROMATOGRAPHY, HIGH PRESSURE LIQUID; COLUBRINA; COMPLEX MIXTURES; LEAST-SQUARES ANALYSIS; LEISHMANIA MEXICANA; PHYTOCHEMICALS; PLANT EXTRACTS; PLANTS, MEDICINAL; PRINCIPAL COMPONENT ANALYSIS; ULTRAVIOLET RAYS;

EID: 84947599479     PISSN: 00219673     EISSN: 18733778     Source Type: Journal    
DOI: 10.1016/j.chroma.2015.10.026     Document Type: Article

References (44)

1. Newman D.J., Cragg G.M. Natural products as sources of new drugs over the 30 years from 1981 to 2010. J. Nat. Prod. 2012, 75:311-335.
2. Brusotti G., Cesari I., Dentamaro A., Caccialanza G., Massolini G. Isolation and characterization of bioactive compounds from plant resources: the role of analysis in the ethnopharmacological approach. J. Pharm. Biomed. Anal. 2014, 87:218-228.
3. Jones W., Kinghorn A.D. Extraction of plant secondary metabolites. Nat. Prod. Isol. SE - 13 2012, 341-366. Humana Press. S.D. Sarker, L. Nahar (Eds.).
4. Sticher O. Natural product isolation. Nat. Prod. Rep. 2008, 25:517-554.
5. Chau F., Xu Q., Sze D., Chan H., Lau T., Yuan D., et al. A new methodology for uncovering the bioactive fractions in herbal medicine using the approach of quantitative pattern-activity relationship. Data Anal. Tradit. Chinese Med. Res. SE - 9 2014, 155-172. Springer International Publishing. J. Poon, S.K. Poon (Eds.).
6. Katiyar C., Kanjilal S., Gupta A., Katiyar S. Drug discovery from plant sources: An integrated approach. AYU (Int. Q. J. Res. Ayurveda) 2012, 33:10-19.
7. Pieters L., Vlietinck A.J. Bioguided isolation of pharmacologically active plant components, still a valuable strategy for the finding of new lead compounds?. J. Ethnopharmacol. 2005, 100:57-60.
8. Weller M.G. A unifying review of bioassay-guided fractionation, effect-directed analysis and related techniques. Sensors 2012, 12:9181-9209.
9. Cifuentes-Barreto M.C. Proceso biodirigido para la obtención de fracciones con actividad antitumoral a partir de la Petiveria alliacea 2010, 108. Facultad de Ciencias, Pontífica Universidad Javeriana, Bogotá, Colobia, (Ph. D. thesis).
10. Kvalheim O.M., Chan H., Benzie I.F.F., Szeto Y., Tzang A.H., Mok D.K., et al. Chromatographic profiling and multivariate analysis for screening and quantifying the contributions from individual components to the bioactive signature in natural products. Chemom. Intell. Lab. Syst. 2011, 107:98-105.
11. Kumar N., Bansal A., Sarma G.S., Rawal R.K. Chemometrics tools used in analytical chemistry: an overview. Talanta 2014, 123:186-199.
12. Bansal A., Chhabra V., Rawal R.K., Sharma S. Chemometrics: a new scenario in herbal drug standardization. J. Pharm. Anal. 2014, 4:223-233.
13. Gao J., Zhao H., Hylands P.J., Corcoran O. Secondary metabolite mapping identifies Scutellaria inhibitors of human lung cancer cells. J. Pharm. Biomed. Anal. 2010, 53:723-728.
14. Sheridan H., Krenn L., Jiang R., Sutherland I., Ignatova S., Marmann A., et al. The potential of metabolic fingerprinting as a tool for the modernisation of TCM preparations. J. Ethnopharmacol. 2012, 140:482-491.
15. a Gad H., El-Ahmady S.H., Abou-Shoer M.I., Al-Azizi M.M. Application of chemometrics in authentication of herbal medicines: a review. Phytochem. Anal. 2013, 24:1-24.
16. Garza-Juárez A., De La Luz Salazar-Cavazos M., Salazar-Aranda R., Pérez-Meseguer J., Waksman De Torres N. Correlation between chromatographic fingerprint and antioxidant activity of Turnera diffusa (Damiana). Planta Med. 2011, 77:958-963.
17. Tistaert C., Dejaegher B., Nguyen H.N., Chataigné G., Rivière C., Nguyen T.H.V., et al. Potential antioxidant compounds in Mallotus species fingerprints. Part I: Indication, using linear multivariate calibration techniques. Anal. Chim. Acta 2009, 652:189-197.
18. Tistaert C., Dejaegher B., Chataigné G., Rivière C., Nguyen Hoai N., Van M.C., et al. Potential antioxidant compounds in Mallotus species fingerprints. Part II: Fingerprint alignment, data analysis and peak identification. Anal. Chim. Acta 2012, 721:35-43.
19. Chau F.T., Chan H.Y., Cheung C.Y., Xu C.J., Liang Y., Kvalheim O.M. Recipe for uncovering the bioactive components in herbal medicine. Anal. Chem. 2009, 81:7217-7225.
20. Dumarey M., van Nederkassel A.M., Deconinck E., Vander Heyden Y. Exploration of linear multivariate calibration techniques to predict the total antioxidant capacity of green tea from chromatographic fingerprints. J. Chromatogr. A 2008, 1192:81-88.
21. Lucio-Gutiérrez J.R., Garza-Juárez A., Coello J., Maspoch S., Salazar-Cavazos M.L., Salazar-Aranda R., et al. Multi-wavelength high-performance liquid chromatographic fingerprints and chemometrics to predict the antioxidant activity of Turnera diffusa as part of its quality control. J. Chromatogr. A 2012, 1235:68-76.
22. van Nederkassel A.M., Daszykowski M., Massart D.L., Vander Heyden Y. Prediction of total green tea antioxidant capacity from chromatograms by multivariate modeling. J. Chromatogr. A 2005, 1096:177-186.
23. Daszykowski M., Vander Heyden Y., Walczak B. Robust partial least squares model for prediction of green tea antioxidant capacity from chromatograms. J. Chromatogr. A 2007, 1176:12-18.
24. Ronowicz J., Kupcewicz B., Budzisz E. Chemometric analysis of antioxidant properties of herbal products containing Ginkgo biloba extract. Cent. Eur. J. Biol. 2013, 8:374-385.
25. Tistaert C., Chataigné G., Dejaegher B., Rivière C., Nguyen Hoai N., Chau Van M., et al. Multivariate data analysis to evaluate the fingerprint peaks responsible for the cytotoxic activity of Mallotus species. J. Chromatogr. B: Analyt. Technol. Biomed. Life Sci. 2012, 910:103-113.
26. Bin Kang K., Lee D.Y., Kim T.B., Kim S.H., Kim H.J., Kim J., et al. Prediction of tyrosinase inhibitory activities of Morus alba root bark extracts from HPLC fingerprints. Microchem. J. 2013, 110:731-738.
27. Shan S.-M., Luo J.-G., Huang F., Kong L.-Y. Chemical characteristics combined with bioactivity for comprehensive evaluation of Panax ginseng C.A. Meyer in different ages and seasons based on HPLC-DAD and chemometric methods. J. Pharm. Biomed. Anal. 2014, 89:76-82.
28. Tistaert C., Dejaegher B., Vander Heyden Y. Chromatographic separation techniques and data handling methods for herbal fingerprints: a review. Anal. Chim. Acta 2011, 690:148-161.
29. Jiang W., Zhang Z.-M., Yun Y., Zhan D.-J., Zheng Y.-B., Liang Y.-Z., et al. Comparisons of five algorithms for chromatogram alignment. Chromatographia 2013, 76:1067-1078.
30. van Nederkassel A.M., Daszykowski M., Eilers P.H.C., Vander Heyden Y. A comparison of three algorithms for chromatograms alignment. J. Chromatogr. A 2006, 1118:199-210.
31. Skov T., Van Den Berg F., Tomasi G., Bro R. Automated alignment of chromatographic data. J. Chemom. 2006, 20:484-497.
32. Bloemberg T.G., Gerretzen J., Lunshof A., Wehrens R., Buydens L.M.C. Warping methods for spectroscopic and chromatographic signal alignment: a tutorial. Anal. Chim. Acta 2013, 781:14-32.
33. Zhang Z.-M., Chen S., Liang Y.-Z. Baseline correction using adaptive iteratively reweighted penalized least squares. Analyst 2010, 135:1138-1146.
34. Hendriks M.M.W.B., Cruz-Juarez L., De Bont D., Hall R.D. Preprocessing and exploratory analysis of chromatographic profiles of plant extracts. Anal. Chim. Acta 2005, 545:53-64.
35. Tistaert C., Dejaegher B., Chataigné G., Van Minh C., Quetin-Leclercq J., Vander Heyden Y. Dissimilar chromatographic systems to indicate and identify antioxidants from Mallotus species. Talanta 2011, 83:1198-1208.
36. Sharma A., Cardoso-Taketa A., Choi Y.H., Verpoorte R., Villarreal M.L. A comparison on the metabolic profiling of the Mexican anxiolytic and sedative plant Galphimia glauca four years later. J. Ethnopharmacol. 2012, 141:964-974.
37. Domínguez-Carmona D.B., Escalante-Erosa F., García-Sosa K., Ruiz-Pinell G., Gutierrez-Yapu D., Chan-Bacab M.J., et al. Metabolites from roots of Colubrina greggii var. yucatanensis and evaluation of their antiprotozoan, cytotoxic and antiproliferative activities. J. Braz. Chem. Soc. 2011, 22:1279-1285.
38. Roldán C., De La Torre A., Mota S., Morales-Soto A., Menéndez J., Segura-Carretero A. Identification of active compounds in vegetal extracts based on correlation between activity and HPLC-MS data. Food Chem. 2013, 136:392-399.
39. Goodarzi M., Russell P.J., Vander Heyden Y. Similarity analyses of chromatographic herbal fingerprints: a review. Anal. Chim. Acta 2013, 804:16-28.
40. Thiangthum S., Dejaegher B., Goodarzi M., Tistaert C., Gordien A.Y., Nguyen Hoai N., et al. Potentially antioxidant compounds indicated from Mallotus and Phyllanthus species fingerprints. J. Chromatogr. B: Analyt. Technol. Biomed. Life Sci. 2012, 910:114-121.
41. Cardoso-Taketa A.T., Pereda-Miranda R., Young H.C., Verpoorte R., Villarreal M.L. Metabolic profiling of the Mexican anxiolytic and sedative plant Galphimia glauca using nuclear magnetic resonance spectroscopy and multivariate data analysis. Planta Med. 2008, 74:1295-1301.
42. van den Berg R., Hoefsloot H., Westerhuis J., Smilde A., van der Werf M. BMC Genomics 2006, 7:142.
43. Craig A., Cloarec O., Holmes E., Nicholson J.K., Lindon J.C. Anal. Chem. 2006, 78:2262-2267.
44. Mecozzi M., Pietroletti M., Oteri F., Di Mento R. Princ. Compon. Anal. - Eng. Appl., First 2012, 65-82. InTech, Rijeka, Croatia. P. Sanguansat (Ed.).