Target lipidomics method based on modelling-predicting strategy
A lipid group and strategy technology, applied in the field of medicine, can solve problems such as the difficulty of obtaining reference substances for lipids and the difficulty of accurate quantification of lipids
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Embodiment 1
[0039] (1) First, the carbon chain length (x1) and the number of double bonds (x2) are taken as independent variables, and the declustering voltage (DP), collision energy (CE), retention time (RT), and response factor (RF) are taken as dependent variables Establish multiple linear regression model (Table 3), summarize LPC(13:0), LPC(14:0), LPC(15:0), LPC(17:0)LPC(18:1)LPC(19:0) The parameters of the liquid phase mass spectrometry of the LPC (20:0) reference substance are regular, and then use this equation to predict the corresponding parameters of the LPC that cannot obtain the reference substance. For the specific process, see figure 1 .
[0040] Table 3 Multiple reproducibility regression equation of liquid phase mass spectrometry parameters
[0041]
[0042] (2) Plasma sample pretreatment: Take 100 μl of plasma sample in EP tube, add 10 μl of methanol, 50 μl of internal standard solution, vortex mix for 30 s, add 400 μl of acetonitrile, vortex mix for 3 min, sonicate i...
Embodiment 2
[0047] (1) First, the carbon chain length (x1) and the number of double bonds (x2) are taken as independent variables, and the declustering voltage (DP), collision energy (CE), retention time (RT), and response factor (RF) are taken as dependent variables Establish multiple linear regression model (Table 3), summarize LPC(13:0), LPC(14:0), LPC(15:0), LPC(17:0)LPC(18:1)LPC(19:0) The parameters of the liquid phase mass spectrometry of the LPC (20:0) reference substance are regular, and then use this equation to predict the corresponding parameters of the LPC that cannot obtain the reference substance. For the specific process, see figure 1 .
[0048] (2) Plasma sample pretreatment: Take 100 μl of plasma sample in EP tube, add 10 μl of methanol, 50 μl of internal standard solution, vortex mix for 30 s, add 400 μl of acetonitrile, vortex mix for 3 min, sonicate in ice bath for 10 min, centrifuge at 4 °C ( 12000r / min) for 5min, the supernatant was taken for LC-MS analysis.
[004...
Embodiment 3
[0053] (1) First, the carbon chain length (x1) and the number of double bonds (x2) are used as independent variables, and the declustering voltage (DP), collision energy (CE), retention time (RT), and response factor (RF) are used as dependent variables Establish multiple linear regression model (Table 3), summarize LPC(13:0), LPC(14:0), LPC(15:0), LPC(17:0)LPC(18:1)LPC(19:0) The parameters of the liquid phase mass spectrometry of the LPC (20:0) reference substance are regular, and then use this equation to predict the corresponding parameters of the LPC that cannot obtain the reference substance. For the specific process, see figure 1 .
[0054](2) Plasma sample pretreatment: Take 100 μl of plasma sample in EP tube, add 10 μl of methanol, 50 μl of internal standard solution, vortex mix for 30 s, add 400 μl of acetonitrile, vortex mix for 3 min, sonicate in ice bath for 10 min, centrifuge at 4 °C ( 12000r / min) for 5min, the supernatant was taken for LC-MS analysis.
[0055] ...
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