Herrero-Martínez José Manuel, Izquierdo Pere, Sales Joaquim, Rosés Martí, Bosch Elisabeth
Departament de Química Analítica, Universitat de Barcelona, Barcelona, Spain.
J Sep Sci. 2008 Oct;31(18):3170-81. doi: 10.1002/jssc.200800278.
The retention behavior of a series of fat-soluble vitamins has been established on the basis of a polarity retention model: log k = (log k)(0) + p (P(m) (N) - P(s) (N)), with p being the polarity of the solute, P(m) (N) the mobile phase polarity, and (log k)(0) and P(m) (N) two parameters for the characterization of the stationary phase. To estimate the p-values of solutes, two approaches have been considered. The first one is based on the application of a QSPR model, derived from the molecular structure of solutes and their log P(o/w), while in the second one, the p-values are obtained from several experimental measurements. The quality of prediction of both approaches has also been evaluated, with the second one giving more accurate results for the most lipophilic vitamins. This model allows establishing the best conditions to separate and determine simultaneously some fat-soluble vitamins in dairy foods.
log k = (log k)(0) + p (P(m) (N) - P(s) (N)),其中p为溶质的极性,P(m) (N)为流动相极性,(log k)(0)和P(s) (N)是用于表征固定相的两个参数。为了估算溶质的p值,考虑了两种方法。第一种方法基于应用从溶质的分子结构及其log P(o/w)推导而来的QSPR模型,而第二种方法中,p值是通过几次实验测量获得的。还评估了两种方法的预测质量,第二种方法对最亲脂性的维生素给出了更准确的结果。该模型有助于确定在乳制品中同时分离和测定某些脂溶性维生素的最佳条件。