TABLE 2.
Groups
|
SEM |
q-values
|
||||||||
Super class | Metabolite names | L | ML | MH | H | Treatment | Linear | Quadratic | Cubic | |
Organic acids and derivatives | Hydroxyurea | 76,048 | 148,881 | 57,813 | 40,464 | 11,734.03 | < 0.01 | <0.001 | 0.12 | 0.05 |
4-Aminobutyric acid | 10,223 | 29,808 | 35,768 | 29,364 | 3,619.94 | 0.06 | 0.36 | 0.32 | 0.02 | |
Isocitric acid | 99,404 | 23,365 | 23,365 | 23,365 | 7,452.25 | < 0.001 | 0.01 | < 0.0001 | <0.0001 | |
3-Hydroxynorvaline | 528,034 | 842,436 | 304,983 | 189,491 | 71,817.96 | < 0.01 | <0.01 | 0.36 | 0.01 | |
Galactonic acid | 45,468 | 63,014 | 62,004 | 94,426 | 6,215.79 | 0.03 | 0.12 | 0.03 | 0.11 | |
L-DOPA | 10,989 | 17,795 | 14,423 | 19,832 | 1,157.32 | 0.02 | 0.76 | 0.01 | 0.18 | |
2-Ketobutyric acid | 105,552 | 144,046 | 103,195 | 98,246 | 5,463.85 | < 0.01 | <0.01 | 0.06 | 0.18 | |
4-Acetamidobutyric acid | 152,770 | 194,089 | 161,726 | 178,094 | 5,554.59 | 0.03 | 0.20 | 0.01 | 0.80 | |
Citrulline | 789,666 | 1,001,945 | 797,397 | 921,408 | 29,234.05 | 0.01 | 0.26 | < 0.01 | 0.79 | |
3-Hydroxybutyric acid | 232,771 | 315,818 | 148,691 | 120,568 | 24,299.88 | 0.01 | 0.01 | 0.49 | 0.02 | |
Glutaric Acid | 342,226 | 476,562 | 275,466 | 217,889 | 32,762.22 | 0.02 | 0.01 | 0.50 | 0.08 | |
N,N-dimethylarginine | 103,615 | 175,289 | 79,589 | 42,687 | 17,504.52 | 0.04 | 0.01 | 0.58 | 0.15 | |
Lipids and lipid-like molecules | Citramalic acid | 360,988 | 507,541 | 396,597 | 416,183 | 18,124.73 | 0.02 | 0.03 | 0.01 | 0.91 |
Thymol | 7,920 | 12,635 | 18,864 | 25,635 | 1,930.52 | < 0.01 | 0.04 | 0.06 | < 0.01 | |
Capric Acid | 146,089 | 205,068 | 160,188 | 154,110 | 8,461.62 | 0.05 | 0.02 | 0.10 | 0.90 | |
Phytanic acid | 8,312 | 21,306 | 6,921 | 24,654 | 2,802.57 | 0.04 | 0.61 | 0.01 | 0.97 | |
Arachidic acid | 33,435 | 50,071 | 33,405 | 47,824 | 2,678.01 | 0.02 | 0.75 | < 0.01 | 0.91 | |
4-Hydroxybutyrate | 40,263 | 49,500 | 24,087 | 23,951 | 3,354.78 | < 0.01 | 0.02 | 0.40 | 0.01 | |
Organic oxygen compounds | Fucose | 288,892 | 478,845 | 394,367 | 363,236 | 32,282.30 | 0.22 | 0.12 | 0.22 | 0.48 |
Digalacturonic acid | 25,798 | 48,880 | 36,775 | 51,166 | 2,921.60 | < 0.01 | 0.83 | < 0.001 | 0.08 | |
Tagatose | 90,442 | 166,477 | 34,926 | 89,045 | 16,462.08 | 0.03 | 0.18 | 0.03 | 0.07 | |
Phenylpropanoids and polyketides | 3-Phenyllactic acid | 298,914 | 341,291 | 304,344 | 83,639 | 30,041.52 | < 0.01 | 0.001 | 0.07 | 0.25 |
Caffeic acid | 10,684 | 22,064 | 15,670 | 19,975 | 1,314.10 | < 0.01 | 0.23 | 0.001 | 0.17 | |
Piceatannol | 10,627,937 | 18,443,030 | 20,191,325 | 22,370,834 | 1425,419 | 0.01 | 0.90 | 0.01 | 0.02 | |
Hesperitin | 74,725 | 185,831 | 201,860 | 248,675 | 24,526.29 | 0.07 | 0.76 | 0.09 | 0.04 | |
Hydrocinnamic acid | 32,692,862 | 44,812,659 | 33,903,201 | 21,915,790 | 2,634,050.14 | 0.01 | 0.002 | 0.99 | 0.33 | |
Dihydrocoumarin | 64,748 | 96,673 | 43,308 | 23,238 | 9,010.95 | 0.02 | 0.01 | 0.70 | 0.05 | |
3-(4-Hydroxyphenyl)propionic acid | 43,016 | 70,843 | 53,067 | 30,230 | 4,297.77 | < 0.01 | <0.001 | 0.70 | 0.72 | |
Benzenoids | Pyrogallol | 870,419 | 1,157,283 | 931,917 | 1,035,939 | 33,836.73 | < 0.01 | 0.09 | < 0.01 | 0.80 |
Noradrenaline | 8,118 | 21,453 | 5,912 | 33,176 | 3,096.49 | 0.001 | 0.08 | < 0.001 | 0.80 | |
Benzoic acid | 494,985 | 752,846 | 480,557 | 307,760 | 47,527.04 | < 0.01 | 0.0006 | 0.57 | 0.15 | |
4-Hydroxybenzoic acid | 12,679 | 14,534 | 9,046 | 7,843 | 810.81 | < 0.01 | 0.01 | 0.80 | 0.01 | |
Organoheterocyclic compounds | Maleimide | 170,704 | 226,584 | 176,306 | 182,508 | 8,172.15 | 0.05 | 0.05 | 0.04 | 0.68 |
Urocanic acid | 2,894 | 5,999 | 1,941 | 5,078 | 457.24 | < 0.001 | 0.54 | < 0.001 | 0.21 | |
Others | Biuret | 57,008 | 40,288 | 9,128 | 5,786 | 6,325.01 | < 0.01 | 0.21 | 0.31 | 0.001 |
D-Erythronolactone | 93,281 | 116,333 | 83,983 | 97,711 | 3,854.94 | 0.01 | 0.12 | 0.01 | 0.12 | |
Mannose | 56,689 | 81,005 | 37,577 | 72,988 | 5,156.19 | 0.01 | 0.89 | < 0.01 | 0.09 | |
Atrazine-2-hydroxy | 284,295 | 389,787 | 269,739 | 237,126 | 20,427.48 | 0.04 | 0.01 | 0.32 | 0.23 | |
9-Fluorenone | 410,981 | 538,037 | 407,150 | 481,150 | 20,307.76 | 0.06 | 0.32 | 0.01 | 0.68 | |
Norleucine | 12,278 | 20,023 | 13,683 | 11,469 | 1,195.13 | 0.04 | < 0.01 | 0.20 | 0.65 | |
1,4-Cyclohexanedione | 163,682 | 142,916 | 228,063 | 88,456 | 14,010.91 | < 0.001 | < 0.001 | 0.81 | 0.04 | |
Allylmalonic acid | 14,826 | 20,897 | 16,422 | 4,032 | 2,077.46 | 0.02 | < 0.01 | 0.38 | 0.45 | |
L-Threose | 361,272 | 641,951 | 339,415 | 203,554 | 55,313.76 | 0.03 | < 0.01 | 0.4541 | 0.25 | |
N,N-Dimethyl-p-phenylenediamine | 12,025 | 25,724 | 11,245 | 6,745 | 2,302.25 | 0.01 | < 0.01 | 0.24 | 0.22 |