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. 2016 Mar 31;21(4):435. doi: 10.3390/molecules21040435

Table 2.

Representative differential metabolites of liver that contributed to the separation among dextrose-, alcohol- and NTs-treated rats derived from UPLC-TOF-MS analysis (n 6 per group).

Compounds RT(min)_m/z VIP Peak Area Intensity Pathway
Dextrose Control Alcohol Control 0.04% NTs 0.16% NTs
Glycocholic acid 7.7237_464.3005 5.59 8463.81 ± 7415.40 31,624.49 ± 15,933.73 ** 26,484.27 ± 18,211.81 31,964.50 ± 15,863.17 Primary bile acid biosynthesis; Secondary bile acid biosynthesis; Bile secretion
Chenodeoxyglycocholic acid 7.4877_448.3058 2.20 143.49 ± 278.14 5104.29 ± 833.33 ** 1725.13 ± 1099.87 ## 2587.23 ± 725.60 ## Primary bile acid biosynthesis; Secondary bile acid biosynthesis; Bile secretion
Taurodeoxycholic acid 7.057_462.2852 3.57 498.07 ± 915.56 10,764.23 ± 2193.21 ** 5839.72 ± 1832.43 ## 9480.95 ± 2332.42 Primary bile acid biosynthesis; Secondary bile acid biosynthesis; Bile secretion
Stearic acid 9.0998_283.2622 3.18 970.48 ± 1097.17 7191.91 ± 1879.98 ** 2026.56 ± 1676.70 ## 1543.03 ± 758.30 ## Fatty acid biosynthesis; Biosynthesis of unsaturated fatty acids
Palmitic acid 8.8195_255.2323 3.04 3510.95 ± 3186.85 9469.90 ± 3202.26 ** 5350.94 ± 3418.26 # 3445.33 ± 1681.00 ## Fatty acid metabolism; Fatty acid elongation; Biosynthesis of unsaturated fatty acids
Oleic acid 8.9027_281.248 2.87 1951.77 ± 1228.59 5639.40 ± 2538.87 ** 2738.06 ± 2399.18 1113.86 ± 1067.94 Fatty acid biosynthesis; Biosynthesis of unsaturated fatty acids
LysoPE(16:0) 8.8334_452.2774 2.87 575.73 ± 509.70 5241.31 ± 925.57 ** 1375.93 ± 1208.68 ## 723.85 ± 558.81 ## NUM
LysoPE(18:0) 9.0983_480.3084 2.31 95.30 ± 152.35 3245.92 ± 340.42 ** 356.80 ± 402.64 ## 248.25 ± 262.90 ## NUM
PC(36:4) 10.5958_782.5688 3.02 4685.98 ± 7215.85 19,441.81 ± 14,285.09 * 5760.80 ± 7153.05# 4855.63 ± 3996.21 # Glycerophospholipid metabolism; Linoleic acid metabolism; Arachidonic acid metabolism; alpha-Linolenic acid metabolism; Biosynthesis of secondary metabolites
Valyl-Leucine 4.0200_231.1707 4.23 82,347.30 ± 15,277.29 56,815.96 ± 11,255.82 * 82,653.81 ± 17,597.53 # 55,640.86 ± 20,887.14 NUM
l-Leucine 2.4894_132.1022 3.98 77,270.19 ± 19,282.77 46,539.18 ± 11,543.08 * 72,540.58 ± 23,121.88 # 63,797.58 ± 28,472.31 Valine, leucine and isoleucine biosynthesis and degradation; Biosynthesis of secondary metabolites; Biosynthesis of amino acids; Protein digestion and absorption; ABC transporters
Alanyl-Leucine 3.4595_203.1393 3.12 30,881.02 ± 5469.33 20,193.62 ± 6616.19 * 33,593.60 ± 11,567.90 # 24,107.26 ± 10,181.59 NUM
l-Phenylalanine 3.3547_166.0865 3.20 62,390.84 ± 10,449.98 50,789.46 ± 5932.05 66,602.95 ± 17,891.97 # 51,682.26 ± 10,729.99 Phenylalanine metabolism; Phenylalanine, tyrosine and tryptophan biosynthesis; Biosynthesis of secondary metabolites; Biosynthesis of amino acids; ABC transporters; Protein digestion and absorption
l-Phenylalanine (Fragment) 3.3594_120.081 3.81 52,558.23 ± 8271.70 45,012.33 ± 5773.60 61,986.71 ± 16,794.77 # 51,397.55 ± 9687.96
Glutathione 1.6432_308.0917 8.02 123,866.59 ± 72,656.44 53,551.25 ± 36,343.10 * 62,413.02 ± 38,243.30 78,404.52 ± 52,299.03 Cysteine and methionine metabolism; Glutathione metabolism; Metabolic pathways; ABC transporters; Bile secretion

Peak area intensity were presented as mean ± standard deviation; RT, retention time; m/z, mass to charge ration; VIP, variable importance in partial least squares project; PC, Phosphatidylcholine; LysoPE, Lysophosphatidylethanolamine. Mean values were significantly different from those of the dextrose control group: *p < 0.05, **p < 0.01. Mean values were significantly different from those of the alcohol control group: # p < 0.05, ## p < 0.01.