Universal quantitative NMR analysis of complex natural samples

Current Opinion in Biotechnology

Volumn 25, Issue , 2014, Pages 51-59

  Simmler, Charlotte ^a   Napolitano, José G ^a   McAlpine, James B ^a   Chen, Shao Nong ^a   Pauli, Guido F ^a  

^a UNIVERSITY OF ILLINOIS AT CHICAGO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CLINICAL DIAGNOSIS; NUCLEAR MAGNETIC RESONANCE(NMR); PHARMACEUTICAL RESEARCH; PURITY DETERMINATION; QUANTITATIVE ANALYTICAL TECHNIQUE; QUANTITATIVE NMR (QNMR); REFERENCE MATERIAL; SAMPLE COMPOSITION;

BIOTECHNOLOGY;

DIAGNOSIS;

ANTIBODY; DRUG METABOLITE; HEPARIN; HERBACEOUS AGENT; NATURAL PRODUCT; VACCINE;

ANALYTIC METHOD; CHEMOMETRICS; DIET SUPPLEMENTATION; DRUG PURITY; FOLLOW UP; FOOD; HUMAN; LIQUID CHROMATOGRAPHY; MASS SPECTROMETRY; METABOLOMICS; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PRIORITY JOURNAL; QUALITY CONTROL; QUANTITATIVE ANALYSIS; REVIEW;

ANIMALS; BIOLOGICAL PRODUCTS; DRUG DISCOVERY; FOOD ANALYSIS; HUMANS; MAGNETIC RESONANCE SPECTROSCOPY; METABOLOMICS; QUALITY CONTROL;

EID: 84884144540     PISSN: 09581669     EISSN: 18790429     Source Type: Journal    
DOI: 10.1016/j.copbio.2013.08.004     Document Type: Review

References (50)

1. 1H NMR. Development and potential of an analytical method: an update. J Nat Prod 2012, 75:834-851.
2. 1H NMR spectroscopy. TrAC, Trends Anal Chem 2012, 35:5-26.
3. Liu X., Kolpak M.X., Wu J., Leo G.C. Automatic analysis of quantitative NMR data of pharmaceutical compound libraries. Anal Chem 2012, 84:6914-6918.
4. McEwen I., Elmsjö A., Lehnström A., Hakkarainen A., Johansson B.M. Screening of counterfeit corticosteroid in creams and ointments by NMR spectroscopy. J Pharm Biomed Anal 2012, 70:245-250.
5. Mahajan S., Singh I.P. Determining and reporting purity of organic molecules: why qNMR. Magn Reson Chem 2013, 51:76-81.
6. Holzgrabe U. Quantitative NMR spectroscopy in pharmaceutical applications. Prog Nucl Magn Reson Spectrosc 2010, 57:229-240.
7. Espina R., Yu L., Wang J., Tong Z., Vashishtha S., Talaat R., Scatina J., Mutlib A. Nuclear magnetic resonance spectroscopy as a quantitative tool to determine the concentrations of biologically produced metabolites: implications in metabolites in safety testing. Chem Res Toxicol 2009, 22:299-310.
8. Vishwanathan K., Babalola K., Wang J., Espina R., Yu L., Adedoyin A., Talaat R., Mutlib A., Scatina J. Obtaining exposures of metabolites in preclinical species through plasma pooling and quantitative NMR: addressing metabolites in safety testing (MIST) guidance without using radiolabeled compounds and chemically synthesized metabolite standards. Chem Res Toxicol 2009, 22:311-322.
9. 19F) nuclear magnetic resonance (NMR) spectroscopy in metabolism studies. Chem Res Toxicol 2012, 25:572-583.
10. Barding G.A., Salditos R., Larive C.K. Quantitative NMR for bioanalysis and metabolomics. Anal Bioanal Chem 2012, 404:1165-1179.
11. Arteaga R., Pérez A., Villalobo A. Quantitative Proton Nuclear Magnetic Resonance evaluation and total assignment of the capsular polysaccharide Neisseria meningitidis serogroup X. J Pharm Biomed Anal 2012, 70:295-300.
12. 1H-NMR process. Anal Bioanal Chem 2012, 403:247-254.
13. ®) for certifying traceable and highly accurate purity values of organic reference materials with uncertainties <0.1%. Accredi Qual Assur 2013, 18:91-98.
14. 1H qNMR to determine the certified property value. Eur J Pharm Sci 2013, 48:502-513.
15. McEwen I., Amini A., Olofsso I. Identification and purity test of heparin by NMR - a summary of two years' experience at the Medical Products Agency. Pharmeur Bio Sci Notes 2010, 1:65-72.
16. Riihinen K.R., Gödecke T., Pauli G.F. Purification of berry flavonol glycosides by long-bed gel permeation chromatography. J Chromatogr A 2012, 1244:20-27.
17. Tada A., Takahashi K., Ishizuki K., Sugimoto N., Suematsu T., Arifuku K., Tahara M., Akiyama T., Ito Y., Yamazaki T., et al. Absolute quantitation of stevioside and rebaudioside A in commercial standards by quantitative NMR. Chem Pharm Bull 2013, 61:33-38.
18. Qiu F., Friesen B., McAlpine J., Pauli G. Design of countercurrent separation of Ginkgo biloba terpene lactones by nuclear magnetic resonance. J Chromatogr A 2012, 1242:26-34.
19. Marcone M.F., Wang S., Albabish W., Nie S., Somnarain D., Hill A. Diverse food-based applications of nuclear magnetic resonance (NMR) technology. Food Res Intern 2013, 51:729-747.
20. 1H NMR in Rioja red wine fermentation processes. J Agric Food Chem 2009, 57:2112-2118.
21. Bouteille R., Gaudet M., Lecanu B., This H. Monitoring lactic acid production during milk fermentation by in situ quantitative proton nuclear magnetic resonance spectroscopy. J Dairy Sci 2013, 86:1-10.
22. Ohtsuki T., Sato K., Sugimoto N. Absolute quantification for benzoic acid in processed foods using quantitative proton nuclear magnetic resonance spectroscopy. Talanta 2012, 99:342-348.
23. Ohtsuki T., Sato K., Sugimoto N. Absolute quantitative analysis for sorbic acid in processed foods using proton nuclear magnetic resonance spectroscopy [Internet]. Anal Chim Acta 2012, 734:54-61.
24. (1)H NMR: usefulness of this technique for differentiation on a qualitative and a quantitative basis. Food Chem 2012, 135:1583-1591.
25. 1H NMR spectroscopy. Food Chem 2013, 136:546-554.
26. 1H) nuclear magnetic resonance spectroscopy (qNMR) for the identification and quantification of taste compounds in raw onion (Allium cepa L.) bulbs and in aqueous solutions where onion tissues are soaked. Anal Bioanal Chem 2010, 398:3139-3153.
27. Izquierdo-García J.L., Villa P., Kyriazis A., Del Puerto-Nevado L., Pérez-Rial S., Rodriguez I., Hernandez N., Ruiz-Cabello J. Descriptive review of current NMR-based metabolomic data analysis packages. Prog Nucl Magn Reson Spectrosc 2011, 59:263-270.
28. Savorani F., Rasmussen M.A., Mikkelsen M.S., Engelsen S.B. A primer to nutritional metabolomics by NMR spectroscopy and chemometrics. Food Res Intern 2013, 10.1016/j.foodres.2012.12.025.
29. Zhang B., Powers R. Analysis of bacterial biofilms using NMR-based metabolomics. Future Med Chem 2012, 4:1273-1306.
30. Heyman H., Meyer J. NMR-based metabolomics as a quality control tool for herbal products. S Afr J Bot 2012, 82:21-32.
31. Kim H.K., Choi Y.H., Verpoorte R. NMR-based plant metabolomics: where do we stand, where do we go?. Trends Biotechnol 2011, 29:267-275.
32. Wolfender J.-L., Rudaz S., Choi Y.H., Kim H.K. Plant metabolomics: from holistic data to relevant biomarkers. Curr Med Chem 2013, 20:1056-1090.
33. Sze K.-H., Wu Q., Tse H.-S., Zhu G. Dynamic Nuclear Polarization: new methodology and applications. Top Curr Chem 2012, 326:215-242.
34. Gödecke T., Yao P., Napolitano J.G., Nikolić D., Dietz B.M., Bolton J.L., Van Breemen R.B., Farnsworth N.R., Chen S.-N., Lankin D.C., et al. Integrated standardization concept for Angelica botanicals using quantitative NMR. Fitoterapia 2012, 83:18-32.
35. Chauthe S.K., Sharma R.J., Aqil F., Gupta R.C., Singh I.P. Quantitative NMR: an applicable method for quantitative analysis of medicinal plant extracts and herbal products. Phytochem Anal 2012, 23:689-696.
36. Fan G., Zhang M.Y., Zhou X.D., Lai X.R., Yue Q.H., Tang C., Luo W.Z., Zhang Y. Quality evaluation and species differentiation of Rhizoma coptidis by using proton nuclear magnetic resonance spectroscopy. Anal Chim Acta 2012, 747:76-83.
37. Okazaki Y., Saito K. Recent advances of metabolomics in plant biotechnology. Plant Biotechnol Rep 2012, 6:1-15.
38. Cervellati C., Paetz C., Dondini L., Tartarini S., Bassi D., Schneider B., Masia A. A qNMR approach for bitterness phenotyping and QTL identification in an F1 apricot progeny. J Biotechnol 2012, 159:312-319.
39. Robinette S.L., Brüschweiler R., Schroeder F., Edison A. NMR in metabolomics and natural products research: two sides of the same coin. Acc Chem Res 2012, 45:288-297.
40. Dong S.-H., Nikolić D., Simmler C., Qiu F., Van Breemen R.B., Soejarto D.D., Pauli G.F., Chen S.-N. Diarylheptanoids from Dioscorea villosa (Wild Yam). J Nat Prod 2012, 10.1021/np300603z.
41. Gad H.a, 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.
42. Forseth R.R., Schroeder F.C. NMR-spectroscopic analysis of mixtures: from structure to function. Curr Opin Chem Biol 2011, 15:38-47.
43. Napolitano J.G., Lankin D.C., Graf T.N., Friesen J.B., Chen S.-N., McAlpine J.B., Oberlies N.H., Pauli G.F. HiFSA fingerprinting applied to isomers with near-identical NMR spectra: the Silybin/Isosilybin case. J Org Chem 2013, 78:2827-2839.
44. Napolitano J.G., Gödecke T., Rodríguez-brasco M.F., Jaki B.U., Chen S., Lankin D.C., Pauli G.F. The tandem of Full Spin Analysis and qHNMR for the quality control of botanicals exemplified with Ginkgo biloba. J Nat Prod 2011, 75:238-248.
45. Beckonert O., Keun H.C., Ebbels T.M.D., Bundy J., Holmes E., Lindon J.C., Nicholson J.K. Metabolic profiling, metabolomic and metabonomic procedures for NMR spectroscopy of urine, plasma, serum and tissue extracts. Nat Protoc 2007, 2:2692-2703.
46. Serkova N., Brown M. Quantitative analysis in magnetic resonance spectroscopy: from metabolic profiling to in vivo biomarkers. Bioanalysis 2012, 4:321-341.
47. Zhang A., Sun H., Wang P., Han Y., Wang X. Recent and potential developments of biofluid analyses in metabolomics. J Proteomics 2012, 75:1079-1088.
48. Heinzmann S.S., Merrifield C.a, Rezzi S., Kochhar S., Lindon J.C., Holmes E., Nicholson J.K. Stability and robustness of human metabolic phenotypes in response to sequential food challenges. J Proteome Res 2012, 11:643-655.
49. Beckonert O., Coen M., Keun H.C., Wang Y., Ebbels T.M.D., Holmes E., Lindon J.C., Nicholson J.K. High-resolution magic-angle-spinning NMR spectroscopy for metabolic profiling of intact tissues. Nat Protoc 2010, 5:1019-1032.
50. Moestue S., Sitter B: H.R., MAS MR spectroscopy in metabolic characterization of cancer. Curr Top Med Chem 2011, 5498:2-26.