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. 2021 Jun 30;18:69. doi: 10.1186/s12986-021-00595-8

Table 1.

Potential biomarkers in liver based on the UPLC-Q-TOF/MS analysis between the obese and lean mice

Ionization mode RT(s) m/z Metabolites Metabolic pathway VIP Fold change p value
ESI (+) 788.63 198.0517674 sn-Glycerol 3-Phosphoethanolaminesn Glycerophospholipid metabolism 1.95 1.94 0.001
ESI (+) 780.035 104.1058352 Choline Glycerophospholipid metabolism 1.29 1.38 0.0009
ESI (+) 878.204 489.1135327 Gytidine 5’-diphosphocholine Glycerophospholipid metabolism 1.84 2.13 0.032
ESI (+) 915.7575 142.0254256 O-Phosphoethanolamine Glycerophospholipid metabolism 1.02 1.71 0.002
ESI (+) 862.561 258.1094388 Glycerophosphocholine Glycerophospholipid metabolism 1.45 2.13 0.014
ESI (+) 315.6605 756.5520133 PC(16:0/16:0) Glycerophospholipid metabolism 1.91 0.46 0.013
ESI (−) 717.05 242.0794821 Phosphorylcholine Glycerophospholipid metabolism 1.62 2.39 0.012
ESI (+) 363.218 285.22 Eicosapentaenoic acid Biosynthesis of unsaturated fatty acids 2.00 0.30 0.011
ESI (−) 69.324 327.2320636 (4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,1 6,19-Docosahexaenoic acid Biosynthesis of unsaturated fatty acids 12.62 0.62 0.0058
ESI (−) 356.1175 281.2478597 Oleic acid Biosynthesis of unsaturated fatty acids 4.70 3.89 0.029
ESI (−) 73.247 277.2171703 Alpha-linolenic acid Biosynthesis of unsaturated fatty acids 5.06 0.67 0.039
ESI (−) 302.251 391.2844083 Chenodeoxycholic acid Primary bile acid biosynthesis 6.08 35.94 2.9E−05
ESI (+) 413.101 516.2991879 Taurocholic acid Primary bile acid biosynthesis 1.80 0.35 0.034
ESI (+) 592.106 126.0208716 Taurine Primary bile acid biosynthesis 10.12 0.41 0.002
ESI (−) 267.2065 498.2881509 Taurochenodeoxycholic acid Primary bile acid biosynthesis 21.0 24.36 0.005
ESI (−) 351.388 407.2790416 Cholic acid Primary bile acid biosynthesis 2.96 0.62 0.035
ESI (+) 316.61 517.3294166 Taurodeoxycholic acid 1.37 5.88 0.004
ESI (+) 326.4925 482.2922443 Tauroursodeoxycholic acid 4.31 18.71 0.011
ESI (−) 73.91 482.2933108 Taurolithocholic acid 1.60 4.36 0.003

ESI+ electrospray ionization in positive ion mode, ESI− electrospray ionization in negative ion mode, RT retention time, VIP variance importance for projection, PC phosphatidylcholine