Metabolites | Scan mode | Rt (s) | m/z | Adducts | DMD vs. HC | ||||
---|---|---|---|---|---|---|---|---|---|
Log2(FC) | P (T test) | VIP | Trends | ||||||
Amino acids | Glutamic acid | ESI- | 73.431 | 128.036 | M-H2O-H | -1.181 | < 0.001 | 1.955 | ↓ |
Glutamine | ESI+ | 47.218 | 146.080 | M + H | -1.072 | < 0.001 | 1.857 | ↓ | |
Hippuric acid | ESI- | 300.935 | 178.051 | M-H | -0.802 | 0.021 | 1.009 | ↓ | |
Phenylacetyl-glutamine | ESI- | 348.896 | 527.213 | 2 M-H | 1.143 | < 0.001 | 2.008 | ↑ | |
Valine | ESI- | 420.136 | 293.176 | 2 M + Hac-H | 1.072 | 0.005 | 1.263 | ↑ | |
Unsaturated fatty acids | β-Linolenic acid | ESI- | 419.308 | 279.232 | M-H | -0.766 | 0.0001 | 1.582 | ↓ |
Carnitine | Linoleyl carnitine | ESI+ | 435.747 | 424.342 | M + H | -0.784 | < 0.001 | 1.536 | ↓ |
Oleoylcarnitine | ESI+ | 461.927 | 426.358 | M + H | -0.766 | < 0.001 | 1.635 | ↓ | |
Bile acids | Glycocholic acid | ESI- | 372.288 | 464.302 | M-H | 1.121 | 0.005 | 1.122 | ↑ |
Glycodeoxycholic acid | ESI- | 406.477 | 448.307 | M-H | 0.950 | 0.0004 | 1.460 | ↑ | |
Glycoursodeoxycholic acid | ESI+ | 406.026 | 450.322 | M + H | 1.031 | < 0.001 | 1.543 | ↑ | |
Deoxycholic acid | ESI+ | 462.698 | 357.279 | M + H-2H2O | 1.174 | 0.002 | 1.323 | ↑ | |
Lipids | PC 32:0 | ESI+ | 1117.300 | 756.555 | M + Na | 0.712 | 0.006 | 1.058 | ↑ |
PC 32:2 | ESI+ | 730.026 | 730.539 | M + H | 0.872 | 0.029 | 1.018 | ↑ | |
LPE 18:0 | ESI- | 552.975 | 480.310 | M-H | 0.655 | < 0.001 | 2.289 | ↑ | |
LPE 20:1 | ESI- | 590.366 | 506.326 | M-H | 0.748 | < 0.001 | 1.656 | ↑ | |
LPE 20:2 | ESI- | 526.317 | 504.311 | M-H | 0.856 | < 0.001 | 2.269 | ↑ | |
LPE (18:0/0:0) | ESI+ | 574.100 | 482.324 | M + H | 0.785 | < 0.001 | 2.489 | ↑ | |
LPI 20:1 | ESI- | 386.676 | 625.361 | M-H | 0.799 | < 0.001 | 1.997 | ↑ | |
LPE 16:1 | ESI- | 444.569 | 450.263 | M-H | 0.803 | < 0.001 | 1.733 | ↑ | |
LPC 20:3 | ESI- | 405.790 | 590.235 | M + FA-H | 0.976 | < 0.001 | 1.525 | ↑ | |
LPC 15:0 | ESI+ | 487.913 | 504.309 | M + Na | 0.634 | < 0.001 | 1.675 | ↑ | |
SM d34:0 | ESI+ | 1118.730 | 705.591 | M + H | 0.851 | < 0.001 | 1.360 | ↑ | |
SM d36:2 | ESI+ | 812.360 | 729.590 | M + H | 0.983 | 0.002 | 1.203 | ↑ | |
SM 34:1 | ESI+ | 729.672 | 725.557 | M + Na | 1.034 | < 0.001 | 1.383 | ↑ |