Compound | Biological process# | Feature name | Chromatography/ ionization mode | Formula | m/z (Da) | R-H, % C | R-L/M, % C | Corrected P-value* |
---|---|---|---|---|---|---|---|---|
Isobutyryl carnitine ↑ | 1 | M232T96_RPPOS | RP/+ | C11H21NO4 | 232.2967 | 1615b | 969c | 6.78E−3 |
Pivaloylcarnitine ↑ | 1 | M246T150_RPPOS | RP/+ | C12H23NO4 | 245.3153 | 1128b | 664c | 5.72E−3 |
2-methylbutyroylcarnitine ↑ | 1 | M246T155_RPPOS | RP/+ | C12H23NO4 | 246.3233 | 955b | 470c | 1.42E−2 |
Myristoylcarnitine ↑ | 1 | M372T767_RPPOS | RP/+ | C21H41NO4 | 372.5625 | 303b | 127a | 3.37E−2 |
(c18:1)oylcarnitine ↓ | 1 | M426T788_RPPOS | RP/+ | C25H47NO4 | 426.3571 | 32b | 36b | 6.21E−03 |
Oxoadipic acid ↑ | 2 | M159T74_RPNEG | RP/− | C6H8O5 | 159.1168 | 4704b | 8660c | 1.63E−2 |
Leucinic acid ↑ | 2 | M131T254_RPNEG | RP/− | C6H12O3 | 131.1497 | 949b | 632c | 1.39E−2 |
γ -Glu-Val ↑ | 2 | M247T94_RPPOS | RP/+ | C10H18N2O5 | 247.2683 | 402b | 202c | 7.33E−3 |
γ-Glu-Ile ↑ | 2 | M261T171_RPPOS | RP/+ | C11H20N2O5 | 259.2790 | 343b | 255b | 2.60E−2 |
Creatine ↑ | 3 | M132T73_RPPOS | RP/+ | C4H9N3O2 | 132.1411 | 425b | 245c | 1.26E−2 |
Inosine ↓ | 4 | M267T72_RPNEG | RP/− | C10H12N4O | 203.2205 | 94a | 77b | 2.37E−2 |
Guanosine ↓ | 4 | M282T73_RPNEG | RP/− | C10H13N5O5 | 282.2328 | 70a | 58b | 4.42E−2 |
LysoPC(20:4) ↓ | 5 | M544T874_RPPOS | RP/+ | C28H50NO7P | 543.6729 | 67b | 46b | 6.13E−2 |
LysoPE(18:2) ↑ | 5 | M478T906_RPNEG | RP/− | C23H44NO7P | 476.5638 | 199b | 106a | 1.31E−2 |
LysoPE(16:0) ↑ | 5 | M452T895_RPNEG | RP/− | C21H44NO7P | 454.5583 | 259b | 143b | 4.05E−3 |
LysoPE(18:1) ↑ | 5 | M480T944_RPNEG | RP/− | C23H46NO7P | 480.5855 | 185b | 123a | 2.14E−2 |
Biotin (vitamin B7) ↓ | 6 | M245T223_RPPOS | RP/+ | C10H16N2O3S | 245.3186 | 28b | 66c | 2.69E−2 |
Pantothenic acid (vitamin B5)↓ | 6 | M220T115_RPPOS | RP/+ | C9H17NO5 | 220.2429 | 27b | 71c | 3.56E−2 |
Delta-valerolactam ↓ | 6 | M100T100_RPPOS | RP/+ | C5H9NO | 100.1390 | 16b | 38c | 6.72E−3 |
p-aminobenzoic acid (PABA) ↑ | 6 | M138T94_RPPOS | RP/+ | C7H7NO2 | 137.0474 | 177b | 215b | 1.44E−2 |