Feature IDa | m/zb | RTc | Molecular formula | Annotation pathway leveld | Annotation superclass leveld | Annotation class leveld | Differencee | q-valuef |
---|---|---|---|---|---|---|---|---|
Higher accumulation in CD-Loc versus TD-Loc | ||||||||
1 | 200.2375 | 7.58 | unknowng | unknown | unknown | unknown | -3.04 | 0.009 |
2 | 246.1449 | 3.21 | unknown | unknown | unknown | unknown | -1.99 | 0.010 |
3 | 446.1592 | 1.24 | unknown | unknown | unknown | unknown | -1.66 | 0.013 |
4 | 248.1242 | 2.18 | unknown | unknown | unknown | unknown | -1.87 | 0.014 |
5 | 172.0606 | 3.36 | unknown | unknown | unknown | unknown | -2.35 | 0.014 |
6 | 233.0423 | 1.83 | unknown | unknown | unknown | unknown | -2.81 | 0.015 |
7 | 474.2924 | 5.33 | C21H39N5O7 | Amino acids and peptides | Small peptides | Tripeptides | -2.38 | 0.015 |
8 | 207.1381 | 7.08 | C13H18O2 | Terpenoids | Monoterpenoids | Menthane terpenoids | -0.86 | 0.016 |
9 | 307.0938 | 4.45 | unknown | unknown | unknown | unknown | -1.02 | 0.018 |
10 | 190.0712 | 3.36 | unknown | unknown | unknown | unknown | -2.46 | 0.018 |
11 | 212.1396 | 1.98 | unknown | unknown | unknown | unknown | -2.09 | 0.019 |
12 | 202.0870 | 6.64 | unknown | unknown | unknown | unknown | -0.73 | 0.019 |
13 | 178.1341 | 5.97 | C10H15N3 | Alkaloids | Nicotinic acid alkaloids | Pyridine alkaloids | -4.16 | 0.019 |
14 | 130.0500 | 3.35 | unknown | unknown | unknown | unknown | -1.73 | 0.019 |
15 | 89.0419 | 3.53 | unknown | unknown | unknown | unknown | -1.58 | 0.020 |
16 | 237.1234 | 6.12 | unknown | unknown | unknown | unknown | -1.93 | 0.023 |
17 | 247.0578 | 1.22 | unknown | unknown | unknown | unknown | -1.91 | 0.027 |
18 | 258.1178 | 1.23 | unknown | unknown | unknown | unknown | -1.47 | 0.027 |
19 | 312.0950 | 5.34 | C11H15N5O6 | Carbohydrates | Nucleosides | Pyrimidine nucleosides | -0.77 | 0.028 |
20 | 258.1101 | 1.23 | C8H20NO6P | Fatty acids | Glycerophospholipids | Glycerophosphocholines | -1.66 | 0.028 |
21 | 129.1274 | 7.46 | unknown | unknown | unknown | unknown | -0.93 | 0.029 |
22 | 164.0741 | 5.36 | unknown | unknown | unknown | unknown | -1.01 | 0.029 |
23 | 225.1486 | 7.08 | unknown | unknown | unknown | unknown | -0.71 | 0.029 |
24 | 260.1970 | 2.58 | unknown | unknown | unknown | unknown | -1.10 | 0.029 |
25 | 69.0336 | 1.85 | unknown | unknown | unknown | unknown | -1.40 | 0.030 |
26 | 263.0165 | 1.85 | unknown | unknown | unknown | unknown | -1.94 | 0.030 |
27 | 260.1970 | 4.58 | unknown | unknown | unknown | unknown | -1.21 | 0.031 |
28 | 162.0763 | 1.89 | unknown | unknown | unknown | unknown | -1.84 | 0.031 |
29 | 232.1293 | 2.04 | unknown | unknown | unknown | unknown | -1.39 | 0.034 |
30 | 258.1024 | 1.23 | unknown | unknown | unknown | unknown | -3.30 | 0.036 |
31 | 460.2039 | 2.19 | unknown | unknown | unknown | unknown | -1.55 | 0.038 |
32 | 188.9119 | 1.16 | unknown | unknown | unknown | unknown | -1.48 | 0.038 |
33 | 244.0929 | 3.15 | C9H13N3O5 | Carbohydrates | Nucleosides | Pyrimidine nucleosides | -1.02 | 0.038 |
34 | 112.0506 | 3.14 | C4H5N3O | Alkaloids | Histidine alkaloids | Imidazole alkaloids | -1.00 | 0.039 |
35 | 106.0499 | 1.17 | unknown | unknown | unknown | unknown | -1.44 | 0.041 |
36 | 245.1861 | 6.62 | unknown | unknown | unknown | unknown | -1.16 | 0.042 |
37 | 226.1310 | 1.85 | unknown | unknown | unknown | unknown | -0.97 | 0.045 |
38 | 262.1400 | 4.91 | unknown | unknown | unknown | unknown | -1.98 | 0.045 |
39 | 180.0868 | 1.82 | C6H13NO5 | Amino acids and peptides | (Small peptides) | Aminosugars | -1.48 | 0.045 |
Higher accumulation in TD-Loc versus CD-Loc | ||||||||
40 | 317.2110 | 7.14 | C20H28O3 | Terpenoids | Diterpenoids | Colensane and clerodane diterpenoids | 3.39 | 0.009 |
41 | 721.3299 | 7.13 | unknown | unknown | unknown | unknown | 3.28 | 0.011 |
42 | 299.2005 | 7.12 | C20H26O2 | Terpenoids | Diterpenoids | Kaurane and phyllocladane diterpenoids | 3.57 | 0.012 |
43 | 761.3249 | 7.08 | unknown | unknown | unknown | unknown | 4.20 | 0.012 |
44 | 182.0539 | 6.00 | unknown | unknown | unknown | unknown | 2.19 | 0.013 |
45 | 473.0393 | 5.99 | unknown | unknown | unknown | unknown | 2.28 | 0.014 |
46 | 513.2705 | 7.13 | unknown | unknown | unknown | unknown | 3.10 | 0.014 |
47 | 455.0809 | 5.99 | C19H20O13 | (Shikimates and phenylpropanoids) Terpenoids | Monoterpenoids | Iridoids monoterpenoids | 2.57 | 0.014 |
48 | 85.2736 | 5.99 | unknown | unknown | unknown | unknown | 2.13 | 0.019 |
49 | 404.0834 | 5.98 | unknown | unknown | unknown | unknown | 2.45 | 0.019 |
50 | 360.1289 | 5.98 | unknown | unknown | unknown | unknown | 2.48 | 0.020 |
51 | 699.3196 | 7.13 | C29H56O16 | Fatty acids | Glycerolipids | (Acyclic monoterpenoids) | 1.88 | 0.020 |
52 | 181.0497 | 5.99 | C9H8O4 | Shikimates and phenylpropanoids | Phenylpropanoids C6-C3 | Cinnamic acids and derivatives | 2.15 | 0.020 |
53 | 441.0131 | 6.00 | unknown | unknown | unknown | unknown | 3.16 | 0.020 |
54 | 341.0877 | 5.99 | C15H18O9 | Shikimates and phenylpropanoids | Coumarins | Simple coumarins | 2.52 | 0.021 |
55 | 805.3310 | 7.40 | C33H54N8O11S | Amino acids and peptides | Oligopeptides | Tripeptides | 3.33 | 0.023 |
56 | 645.2921 | 7.57 | unknown | unknown | unknown | unknown | 3.00 | 0.026 |
57 | 449.1782 | 6.81 | unknown | unknown | unknown | unknown | 1.89 | 0.026 |
58 | 289.0895 | 4.43 | unknown | unknown | unknown | unknown | 2.01 | 0.026 |
59 | 229.1911 | 6.59 | unknown | unknown | unknown | unknown | 2.46 | 0.027 |
60 | 221.1900 | 7.15 | unknown | unknown | unknown | unknown | 2.89 | 0.028 |
61 | 220.1535 | 6.69 | C8H19N4O3 | Alkaloids | Ornithine alkaloids | Polyamines | 4.85 | 0.029 |
62 | 203.1796 | 7.12 | unknown | unknown | unknown | unknown | 2.76 | 0.030 |
63 | 148.0815 | 1.21 | unknown | unknown | unknown | unknown | 5.10 | 0.030 |
64 | 805.3289 | 7.56 | unknown | unknown | unknown | unknown | 3.06 | 0.031 |
65 | 205.1588 | 7.12 | unknown | unknown | unknown | unknown | 1.85 | 0.037 |
66 | 309.1191 | 6.48 | unknown | unknown | unknown | unknown | 1.85 | 0.045 |
67 | 285.1308 | 7.01 | C18H20OS | Shikimates and phenylpropanoids | (Sesquiterpenoids) | Chalcones | 1.25 | 0.045 |
68 | 187.1486 | 7.13 | unknown | unknown | unknown | unknown | 2.44 | 0.049 |