SeqIndex | HMDB_ID | Compound | RI | a||b||c | Intercept(High||Low) | Slope(High||Low) | rsq | adjrsq | Src | Concentration_threshold(uM) |
---|---|---|---|---|---|---|---|---|---|---|
1 | HMDB0000190 | L-Lactic acid | 1092.2 | NA||NA||NA | 0.10565||0.0 | 1.63304||10.0 | 0.99 | 0.9866 | Mix2_022015 | 0 |
2 | HMDB0000115 | Glycolic acid | 1103.4 | NA||NA||NA | 0.0132||NA | 0.39929||NA | 0.991 | 0.9891 | Mix1_022015 | 0 |
3 | HMDB0000883 | Valine | 1111.5 | NA||NA||NA | -0.02843||NA | 4.13494||NA | 0.9989 | 0.9986 | Mix2_022015 | 0 |
4 | HMDB0000161 | Alanine | 1131 | NA||NA||NA | 0.07012||NA | 0.30307||NA | 0.951 | 0.9387 | Mix4_022015 | 0 |
5 | HMDB0000123 | Glycine | 1147.3 | NA||NA||NA | 0.11612||NA | 3.84509||NA | 0.9867 | 0.9834 | Mix2_022015 | 0 |
6 | HMDB0002329 | Oxalic acid | 1167.5 | NA||NA||NA | 0.00034||NA | 0.00048||NA | 0.9909 | 0.9818 | Mix3_022015 | 0 |
7 | HMDB0000687 | Leucine | 1175.6 | NA||NA||NA | -0.07462||NA | 7.42599||NA | 0.9947 | 0.9934 | Mix2_022015 | 0 |
8 | HMDB0000162 | Proline | 1188 | NA||NA||NA | -0.05581||NA | 1.88282||NA | 0.9909 | 0.9886 | Mix1_022015 | 0 |
9 | HMDB0000172 | Isoleucine | 1192.1 | NA||NA||NA | -0.04133||NA | 3.53337||NA | 0.997 | 0.9964 | Mix4_022015 | 0 |
10 | HMDB0000294 | Urea | 1260.1 | NA||NA||NA | -0.03582||NA | 1.36987||NA | 0.995 | 0.9937 | Mix3_022015 | 0 |
11 | HMDB0002142 | Phosphoric acid | 1292.8 | NA||NA||NA | 0.02109||NA | 4.1356||NA | 0.9807 | 0.9758 | NMix1_022015 | 0 |
12 | HMDB0000254 | Succinic acid | 1327.8 | NA||NA||NA | -0.00155||NA | 0.72309||NA | 0.9951 | 0.9941 | NMix1_022015 | 0 |
13 | HMDB0000187 | Serine (3TMS) | 1381.2 | NA||NA||NA | -0.09061||NA | 2.47778||NA | 0.9977 | 0.9971 | Mix3_022015 | 0 |
14 | HMDB0000167 | Threonine (3TMS) | 1406.6 | NA||NA||NA | -0.01896||NA | 0.97133||NA | 0.9935 | 0.9918 | Mix4_022015 | 0 |
15 | HMDB0000191 | Aspartic acid | 1434.9 | NA||NA||NA | 0.06377||NA | 2.76143||NA | 0.9839 | 0.9807 | Mix1_022015 | 0 |
16 | HMDB0000744 | Malic acid | 1507.7 | NA||NA||NA | 0.05931||NA | 1.00801||NA | 0.9885 | 0.9857 | Mix1_022015 | 0 |
17 | HMDB0000267 | Pyroglutamic acid | 1534.3 | NA||NA||NA | -0.16671||NA | 4.08641||NA | 0.9986 | 0.9982 | Mix2_022015 | 0 |
18 | HMDB0000562 | Creatinine | 1569.5 | NA||NA||NA | -0.2246||NA | 2.06975||NA | 0.9978 | 0.9956 | Mix4_022015 | 0 |
19 | HMDB0000943 | Threonic acid | 1587.9 | NA||NA||NA | 0.02698||NA | 1.86989||NA | 0.9864 | 0.9837 | Mix3_022015 | 0 |
20 | HMDB0000694 | 2-Hydroxyglutaric acid | 1593.2 | NA||NA||NA | 0.1056||NA | 2.3124||NA | 0.9677 | 0.9569 | NMix1_022015 | 0 |
21 | HMDB0000214 | Ornithine | 1629.9 | NA||NA||NA | -0.12736||NA | 1.68131||NA | 0.9993 | 0.9989 | Mix3_022015 | 0 |
22 | HMDB0000148 | Glutamic acid | 1638.1 | NA||NA||NA | -0.00543||NA | 1.25887||NA | 0.9898 | 0.9864 | Mix1_022015 | 0 |
23 | HMDB0000159 | Phenylalanine | 1638.8 | NA||NA||NA | -0.10299||NA | 2.90288||NA | 0.9982 | 0.9976 | Mix2_022015 | 0 |
24 | HMDB0000182 | Lysine | 1722.8 | NA||NA||NA | -0.2455||NA | 1.99302||NA | 0.9959 | 0.9918 | Mix3_022015 | 0 |
25 | HMDB0000508 | Ribitol (ISTD) | 1759.8 | NA||NA||NA | NA||NA | NA||NA | NA | NA | NA | 0 |
26 | HMDB0000226 | Orotic acid | 1766.1 | NA||NA||NA | -0.08352||NA | 2.14175||NA | 0.9335 | 0.9002 | NMix1_022015 | 0 |
27 | HMDB0000094 | Citric acid | 1848.8 | NA||NA||NA | 0.06465||NA | 2.44501||NA | 0.9858 | 0.9823 | Mix1_022015 | 0 |
28 | HMDB0000158 | Tyrosine | 1899.6 | NA||NA||NA | -0.54981||NA | 3.85593||NA | 0.9989 | 0.9978 | Mix5_022015 | 0 |
29 | HMDB0000660 | D-Fructose | 1911.9 | NA||NA||NA | 0.05247||NA | 3.9305||NA | 0.9875 | 0.9844 | NMix1_022015 | 0 |
30 | HMDB0000169 | D-Mannose | 1926.6 | NA||NA||NA | 0.07158||NA | 2.84891||NA | 0.9781 | 0.9727 | NMix1_022015 | 0 |
31 | HMDB0000143 | Galactose | 1931.8 | NA||NA||NA | 0.07865||NA | 1.82363||NA | 0.9834 | 0.9801 | Mix1_022015 | 0 |
32 | HMDB0000122 | Glucose | 1938.8 | NA||NA||NA | 0.26855||NA | 2.66942||NA | 0.9708 | 0.9562 | Mix2_022015 | 0 |
33 | HMDB0000220 | Palmitic acid | 2053.8 | NA||NA||NA | -0.06616||NA | 1.17447||NA | 0.9454 | 0.9181 | Mix4_022015 | 0 |
34 | HMDB0000215 | N-Acetyl-D-glucosamine | 2124.3 | NA||NA||NA | -0.07544||NA | 1.52204||NA | 0.9977 | 0.9969 | NMix1_022015 | 0 |
35 | HMDB0000211 | Myo-Inositol | 2132.2 | NA||NA||NA | 0.30464||NA | 2.6672||NA | 0.9053 | 0.8816 | Mix2_022015 | 0 |
36 | HMDB0000673 | Linoleic acid | 2210 | NA||NA||NA | NA||NA | NA||NA | NA | NA | Mix4_022015 | 0 |
37 | HMDB0000207 | Oleic acid | 2221 | NA||NA||NA | NA||NA | NA||NA | NA | NA | 0 | |
38 | HMDB0000827 | Stearic acid | 2248 | NA||NA||NA | NA||NA | NA||NA | NA | NA | 0 | |
39 | HMDB0000186 | Lactose | 2765.249 | NA||NA||NA | -0.16721||NA | 3.00871||NA | 0.9921 | 0.9882 | NMix1_022015 | 0 |
40 | HMDB0000163 | Maltose | 2817.5 | NA||NA||NA | -0.32754||NA | 3.52203||NA | 0.9955 | 0.9932 | Mix3_022015 | 0 |
41 | HMDB0000067 | Cholesterol | 3161.9 | NA||NA||NA | -0.0392||NA | 0.85958||NA | 1 | NA | Mix5_022015 | 0 |