Table 1.
tR (min) | m/z | mass accuracy(ppm) | metabolite | fold change compared with controls |
---|---|---|---|---|
3.61 | 512.2651b | 5.77 | sulfolithocholylglycine | 13.1 ↑ |
3.79 | 498.2854b | 6.93 | tauroursodeoxycholic | 11.0 ↑ |
3.82 | 514.2803b | 6.66 | taurocholic acidd | 11.3 ↑ |
4.08 | 455.2476b | 2.17 | sulfolithocholic acid | 20.5 ↑ |
4.26 | 464.298b | 6.64 | glycocholic acidd | 4.3 ↑ |
4.66 | 407.277b | 6.44 | β-muricholic acid | 1.6 ↓ |
5.41 | 542.3245c | 0.50 | LPC C20:5 | 3.6↓ |
8.86 | 544.3402c | 0.40 | LPC C20:4 isomer | 1.5 ↓ |
9.33 | 544.3404c | 0.04 | LPC C20:4 | 1.5 ↓ |
9.41 | 568.3410c | 1.02 | LPC C22:6 | 66.3 ↑ |
10.87 | 522.3545c | 3.01 | LPC C18:1 isomer | 2.1 ↓ |
11.07 | 522.3553c | 1.48 | LPC C18:1 isomer | 2.2 ↑ |
11.81 | 522.3559c | 0.33 | LPC C18:1 | 3.4 ↑ |
12.73 | 319.2277b | 1.56 | hydroxyeicosatetraenoic acid | 2.5 ↓ |
16.13 | 301.2153b | 4.43 | eicosapentaenoic acid | 1.9 ↑ |
16.22 | 277.2145b | 7.69 | linolenic acid | 1.8 ↑ |
Many biomarkers can be detected in both ESI+ and ESI− modes.
↑ means up-regulated in the treated group compared with the control group, while ↓ means down-regulated in the treated group compared with the control group.
Data of compounds are from those detected in ESI- mode while.
Data were from those in ESI+ mode.
Markers confirmed by standard compounds.