SMA library for metabolites identification and quantification in cheese whey permeate (CWP)

Published: 14 December 2022| Version 1 | DOI: 10.17632/xn5ntwbtjz.1
Contributors:
,

Description

Metabolite library built from NMR spectra for metabolomic analysis of cheese whey permeate (CWP) using the Simple Mixture Analysis (SMA) tool implemented in MestreNova 14.3 software. Metabolites included: 2,3-Butandiol, Acetate, Alanine, Betaine, Choline, Citrate, Creatine, Creatinine, Ethanol, Fumarate, Hippurate, Lactate, Lactose, Orotate, Succinate, α-D-Galactose, β-D-Galactose Sample CWP in PB 10 mM (10% D2O) pH 7.4, TSP (1mM), Diluition Factor (10%) File included: SMA library .exp files and optimized .cmp files

Files

Steps to reproduce

Sample preparation: CWP sample + 10% v/v PB 100 mM, TSP 10 mM Final: CWP in PB 10 mM (10% D2O) pH 7.4, TSP (1mM), Diluition Factor (10%)

Institutions

University of Milano-Bicocca

Departments

Department of Biotechnology and Biosciences

Categories

Analytical Chemistry, Organic Chemistry, Nuclear Magnetic Resonance, Functional Foods

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