Mena Ritota

Proton NMR relaxation study of swelling and gelatinisation process in rice starch–water samples

Proton transverse magnetization decay curves of rice flour starch-water samples were measured and analysed for the presence of four components in the relaxation curve. T2 values were interpreted on the basis of the diffusive and chemical exchange model that provided evidence for extra granular bulk water and three more water populations whose relaxation rate is governed by diffusive and chemical exchange with starch components. The analysis of relaxation data provided information on dynamics of water molecules as well as on the size and dispersion of diffusive domains. Furthermore, by measuring solid to liquid ratio, transverse and longitudinal relaxation curves of starch-water mixtures at increasing temperatures - from 20 to 77°C - swelling and gelatinisation processes were monitored.

Metabolomic Characterization of Italian Sweet Pepper (Capsicum annum L.) by Means of HRMAS-NMR Spectroscopy and Multivariate Analysis

HRMAS-NMR spectroscopy was used to assess the metabolic profile of sweet pepper (Capsicum Annum L.). One-dimensional and two-dimensional NMR spectra, performed directly on sample pieces of few milligrams, hence without any chemical and/or physical manipulation, allowed the assignment of several compounds. Organic acids, fatty acids, amino acids, and minor compounds such as trigonelline, C4-substituted pyridine, choline, and cinnamic derivatives were observed with a single experiment. A significant discrimination between the two sweet pepper varieties was found by using partial least-squares projections to latent structures discrimination analysis (PLS-DA). The metabolites contributing predominantly to such differentiation were sugars and organic and fatty acids. Also a partial separation according to the geographical origin was obtained always by analyzing the NMR data with PLS-DA. Some of the discriminating molecules are peculiar for pepper and contribute to define the overall commercial and organoleptic quality so that HRMAS-NMR proved to be a complementary analysis to standard tools used in food science and, in principle, can be applied to any foodstuff.

The HRMAS-NMR tool in foodstuff characterisation.

High resolution magic angle spinning, that is, HRMAS, is a quite novel tool in NMR spectroscopy; it offers the almost unique opportunity of measuring intact tissues disguised as suspended or swollen in a deuterated solvent. The feasibility of 1H–HRMAS–NMR in foodstuff characterisation has been exploited, but in spite of this, its applications are still limited. Metabolic profiling and biopolymer composition and aggregation are the topics investigated until now for raw vegetables, meat and processed foodstuff. Almost all known studies are reported in the next pages. Copyright

HRMAS-NMR spectroscopy and multivariate analysis meat characterisation.

¹H-High resolution magic angle spinning-nuclear magnetic resonance spectroscopy was employed to gain the metabolic profile of longissimus dorsi and semitendinosus muscles of four different breeds: Chianina, Holstein Friesian, Maremmana and Buffalo. Principal component analysis, partial least squares projection to latent structure - discriminant analysis and orthogonal partial least squares projection to latent structure - discriminant analysis were used to build models capable of discriminating the muscle type according to the breed. Data analysis led to an excellent classification for Buffalo and Chianina, while for Holstein Friesian the separation was lower. In the case of Maremmana the use of intelligent bucketing was necessary due to some resonances shifting allowed improvement of the discrimination ability. Finally, by using the Variable Importance in Projection values the metabolites relevant for the classification were identified.

Traceability of Italian garlic (Allium sativum L.) by means of HRMAS-NMR spectroscopy and multivariate data analysis.

(1)H High Resolution Magic Angle Spinning-Nuclear Magnetic Resonance (HRMAS-NMR) spectroscopy was used to analyse garlic (Allium sativum L.) belonging to red and white varieties and collected in different Italian regions, in order to address the traceability issue. 1D and 2D NMR spectra, performed directly on untreated small pieces of garlic, so without any sample manipulation, allowed the assignment of several compounds: organic acids, sugars, fatty acids, amino acids and the nutritionally important fructo-oligosaccharides and allyl-organosulphur compounds. Application of Partial Least Squares projections to latent structures-Discrimination Analysis provided an excellent model for the discrimination of both the variety and, most important, the place origin, allowing the identification of the metabolites contributing to such classifications. The presence of organosulphurs, allicin and some allyl-organosulphurs found by HRMAS-NMR, was confirmed also by SPME-GC-MS; 11 molecules were identified, containing from one up to three sulphur atoms and with and without allyl moieties.

NMR-based metabolomics for organic farming traceability of early potatoes.

(1)H HRMAS-NMR spectroscopy was successfully used to determine the metabolic profiles of 78 tubers obtained from three early genotypes grown under organic and conventional management. The variation in total hydrogen, carbon, and nitrogen contents was also assessed. A PLS-DA multivariate statistical analysis provided good discrimination among the varieties and cropping systems (100% unknown samples placed in a cross-validation blind test), suggesting that this method is a powerful and rapid tool for tracing organic potatoes. As a result of the farming system, the nitrogen content decreased by 11-14% in organic tubers, whereas GABA and lysine accumulated in the organic tubers of all clones. Clear variations in primary metabolites are discussed to provide a better understanding of the metabolic pathway modifications resulting from agronomical practices.

PGI chicory (Cichorium intybus L.) traceability by means of HRMAS‐NMR spectroscopy: a preliminary study

BACKGROUND Analytical traceability of PGI and PDO foods (Protected Geographical Indication and Protected Denomination Origin respectively) is one of the most challenging tasks of current applied research. RESULTS Here we proposed a metabolomic approach based on the combination of (1)H high-resolution magic angle spinning-nuclear magnetic resonance (HRMAS-NMR) spectroscopy with multivariate analysis, i.e. PLS-DA, as a reliable tool for the traceability of Italian PGI chicories (Cichorium intybus L.), i.e. Radicchio Rosso di Treviso and Radicchio Variegato di Castelfranco, also known as red and red-spotted, respectively. The metabolic profile was gained by means of HRMAS-NMR, and multivariate data analysis allowed us to build statistical models capable of providing clear discrimination among the two varieties and classification according to the geographical origin. CONCLUSION Based on Variable Importance in Projection values, the molecular markers for classifying the different types of red chicories analysed were found accounting for both the cultivar and the place of origin.

Soil microbial biomass influence on strontium availability in mine soil

Abstract The main aim of our work was to assess whether strontium (Sr) affects soil microbial biomass size and activity, and the involvement of said biomass in the availability process of the metal. In addition, information concerning the distribution and mobility of the stable element within ecosystems may allow the prediction of the behaviour of its radioisotope counterpart, 90Sr. Samples were collected in the surroundings of a strontium mine and characterised for total and diethylene triamine pentaacetic acid (DTPA)-extractable Sr, total organic C (TOC), microbial biomass C (MBC), MBC/TOC ratio and metabolic quotient (qCO2). Moreover, MBC and DTPA-extractable Sr were measured during a 45-day incubation experiment of samples soils amended with maize. Overall, increased levels of total Sr had a negative effect on both TOC and MBC. DTPA-extractable Sr was significantly correlated to MBC/TOC suggesting a possible role of soil microbial biomass in the mobilisation of the element. The synthesis of new microbial biomass after soil amendment was negatively affected by the initial content of DTPA-extractable Sr. Conversely, there was a linear positive relationship between newly formed MBC and DTPA-extractable Sr during the incubation, indicating that soil microbial biomass may promote the mobilisation of Sr. These findings indicate that soil amendment with easily degradable organic substrate significantly increases Sr mobility and availability.