Estimating the sensory-associated metabolites profiling of matcha based on PDO attributes as elucidated by NIRS and MS approaches

Matcha has been globally valued by consumers for its distinctive fragrance and flavor since ancient times. Currently, the protected designation of origin (PDO) certified matcha, characterized by unique sensory attributes, has garnered renewed interest from consumers and the industry. Given the challenges associated with assessing sensory perceptions, the origin of PDO-certified matcha samples from Guizhou was determined using NIRS and LC-MS platforms. Notably, the accuracy of our established attribute models, based on informative wavelengths selected by the CARS-PLS method, exceeds 0.9 for five sensory attributes, particularly the particle homogeneity attribute (with a validation correlation coefficient of 0.9668). Moreover, an LC-MS method was utilized to analyze non-target matcha metabolites to identify the primary flavor compounds associated with each flavor attribute and to pinpoint the key constituents responsible for variations in grade and flavor intensity. Additionally, high three-way intercorrelations between descriptive sensory attributes, metabolites, and the selected informative wavelengths were observed through network analysis, with correlation coefficients calculated to quantify these relationships. In this research, the integration of matcha chemical composition and sensory panel data was utilized to develop predictive models for assessing the flavor profile of matcha based on its chemical properties.