IVAS 2022 banner
IVES 9 IVES Conference Series 9 IVAS 9 IVAS 2022 9 Multivariate data analysis applied on Fourier Transform Infrared spectroscopy for the prediction of tannins levels during red wine fermentation

Multivariate data analysis applied on Fourier Transform Infrared spectroscopy for the prediction of tannins levels during red wine fermentation

Abstract

Red wine is a beverage with one of the highest polyphenol concentration, which are extracted during the maceration step of the winemaking process. Sensory perception such as astringency and bitterness are mainly related to tannin concentration and composition. However, quick analytical measurement of polyphenolic compounds can be a real challenge for monitoring their extraction during fermentation. Many methods were developed to analyzed polyphenols in wine, but they are time-consuming and require chemistry skills and equipment, not suitable for a rapid routine analysis. Thus, development of predictive models
using Fourier transform infrared (FTIR) spectroscopy coupled with chemometrics analysis appears to be a reliable and rapid method to determine polyphenolic content during wines fermentation.

For this purpose, this work sought to determine correlation between FTIR analysis and regular quantification methods for tannins, for different samples, covering three different vintages with two different grape varieties, from the beginning to the end of the extraction process. The search for diversity was highlighted during the selection of samples, to provide the best representation of the winemaking process. Total tannin concentration was analyzed by protein and polysaccharide precipitation. Flavanol composition was obtained by HPLC-UV after phloroglucinolysis reaction. FTIR spectra were registered between 925 and 5011 cm-1 using Winescan. Correlation between spectral analyzes and the various analytical information obtained were sought with partial least squares (PLS) multivariate regression analysis, for designing prediction models. The different models were tested with cross validation, and validation with an external set of samples to the calibration. For the external validation, the dataset was split into calibration and validation using Kennard-Stone algorithm.

The objective of this study was to demonstrate the interest of FTIR with PLS multivariate regression analysis to predict tannins concentration during winemaking. Correlations obtained show relevant results for the studied parameters, with models coefficients for cross validation higher than 0.8 for flavanol content (except for epigallocatechin) and higher than 0.9 for total tannins concentrations. The results with external validation are slightly lower for total tannins concentrations, with coefficient of prediction around 0.87, and show a more important decrease for flavanol content, with coefficient of prediction close to 0.7. If models for total tannins already show a high robustness and prediction, models for flavanol content must be improve with other samples. However, the results are encouraging and an
increase of the robustness could allow following flavanol content during winemaking. This work is the first step for the construction of predictive models to quantify different flavanol parameters in red wine fermentation by FTIR spectroscopy.

DOI:

Publication date: June 23, 2022

Issue: IVAS 2022

Type: Article

Authors

Miramont Clément¹, Jourdes Michaël¹, Selberg Torben³, Winther J∅rgensenKasper³, Thiis Heide Søren³and Teissèdre Pierre-Louis¹

¹UR Œnologie EA 4577, Université de Bordeaux, ISVV
²USC 1366 INRAE, IPB, INRAE, ISVV
³FOSS Analytical A/

Contact the author

Keywords

Tannins, Flavanol, Partial least squares regression, Fourier Transform InfraRed

Tags

IVAS 2022 | IVES Conference Series

Citation

Related articles…

Chemical and sensory evolution of total and partial dealcoholized wine in a can

In recent years, wine consumption has been evolving towards new trends. On the one hand, awareness of health and responsible consumption has been growing, and with it, the demand for wines with lower or without alcohol content [1].

Carbon isotope labeling to detect source-sink relationships in grapevines upon drought stress and re-watering

Kinetics of carbon allocation in the different plant sinks (root-shoot-fruit) competing in drought stressed and rehydrated grapevines have been investigated.

Prediction of sauvignon blanc quality gradings with static headspace−gas chromatography−ion mobility spectrometry (SHS−GC−IMS) and machine learning

The main goal of the current study is the development of a cost-effective and easy-to-use method suitable for use in the laboratory of commercial wineries to analyze wine aroma. Additionally, this study attempted to establish a prediction model for wine quality gradings based on their aroma, which could reveal the important aroma compounds that correlate well with different grades of perceived quality METHODS: Parameters of the SHS−GC−IMS instrument were first optimized to acquire the most desirable chromatographic resolution and signal intensities. Method stability was then exhibited by repeatability and reproducibility. Subsequently, compound identification was conducted. After method development, a total of 143 end-ferment wine samples of three different quality gradings from vintage 2020 were analyzed with the SHS−GC−IMS instrument. Six machine learning methods were employed to process the results and construct a quality prediction model. Techniques that aim to explain the model to extract useful insights were also applied.

Description of the effect of the practical management in the characterization of « terroir effect »

The characterization of « the soil effect » in vine growing is often limited to the description of the physical components of the terroir. Many works were done in this direction and corresponded to geological, pedological or agronomical approaches. However, if the physical environment influences the vine and its grapes, its effect becomes limited at the scale of exploitation. Thus, it could be important to consider how the viticulturist « translated » the potential.

Differential responses of red and white grape cultivars trained to a single trellis system – the VSP

Commercial grape production relies on training grapevine cultivars onto a variety of trellis systems. Training allows for well-lit leaves and clusters, maximizing fruit quality in addition to facilitating cultivation, harvesting, and diseases control. Although grapevines can be trained onto an infinite variety of trellis systems, most red and white cultivars are trained to the standard VSP (Vertical Shoot Positioning) system. However, red and white cultivars respond differently to VSP in fruit composition and growth characteristics, which are yet to be fully understood. Therefore, the objective of this study was to examine the influence of the VSP trellis system on fruit composition of three red, Cabernet Sauvignon, Merlot and Syrah, and three white, Chardonnay, Riesling, and Gewurztraminer cultivars grown under uniform growing conditions in the same vineyard. All cultivars were monitored for maturity and harvested at their physiologically maximum possible sugar concentration to compare various fruit quality attributes such as Brix, pH, TA, malic and tartaric acids, glucose and fructose, potassium, YAN, and phenolic compounds including total anthocyanins, anthocyanin profile, and tannins. A distinct pattern in fruit composition was observed in each cultivar. In regards to growth characteristics, Syrah grew vigorously with the highest cluster weight. Although all cultivars developed pyriform seeds, the seed size and weight varied among all cultivars. Also varied were mesocarp cell viability, brush morphology, and cane structure. This knowledge of the canopy architectural characteristics assessed by the widely employed fruit compositional attributes and growth characteristics will aid the growers in better management of the vines in varied situations.