Veterinary drug high-throughput clustering analysis method
A cluster analysis, high-throughput technology, applied in the direction of drug reference, testing drug preparations, instruments, etc., can solve the problems of the difficult coexistence of mixed standard solutions, the lack of comprehensive consideration of the grouping method, and the poor linearity of the analyte. The effect of quality and safety testing work efficiency, reducing testing costs, and ensuring reliability
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Embodiment 1
[0038] 18 kinds of macrolides, 3 kinds of lincosamines, 6 kinds of chloramphenicols, 30 kinds of quinolones, 27 kinds of sulfonamides, 11 kinds of tetracyclines, 6 kinds of avermectins, triphenylmethanes 4 types, 31 types of hormones, 8 types of quinoxalines, 2 types of glycopeptides, and 4 types of metabolites of nitrofurans were used as veterinary drug samples for detection. See Table 5 for specific types of veterinary drugs. Since nitrofuran metabolites have no characteristic fragment ions during instrumental analysis, they need to be converted into corresponding derivatives during pretreatment before they can be analyzed on the machine, so nitrofuran metabolites are not used as samples for cluster analysis. After the derivatization is completed, grouping groups similar to its derivatives are added and extracted simultaneously.
[0039] The selected veterinary drug property indicators are polarity, acidity and alkalinity, logKow and matrix binding properties for high-throug...
Embodiment 2
[0078] Ten kinds of quinolones, 11 kinds of tetracyclines, 6 kinds of avermectins, 4 kinds of triphenylmethanes, 10 kinds of sulfonamides and 5 kinds of quinoxalines were used as the veterinary drug samples for detection, and the selected veterinary drug properties were extremely high. According to the method described in Example 1, the polarity, acidity, logKow and matrix binding properties of veterinary drugs were assigned and standardized, specifically See Table 9 for the types and properties of veterinary drugs.
[0079] Table 9 Veterinary drug samples and property data of hierarchical cluster analysis
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[0082] Using the hierarchical clustering method, assuming that each sample is a class, calculate the distance between 46 samples; merge the two classes with the closest distance into a new class according to the calculated distance between the samples; then calculate the new class and other classes The distances of various types are also combined acc...
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