Data for (Study ST001048)
(Analysis AN001717)Values have been normalized by dividing by the sample mean across all metabolites for each experimental condition Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study View Normalized data as text| Metabolite | F1 | F2 | F3 | F4 |
|---|---|---|---|---|
| 10-Hydroxydecanoate | 0.0251 | 0.0172 | 0.0178 | 0.0206 |
| 2,3-Dihydroxybenzoate | 0.0208 | 0.0101 | 0.0158 | 0.0122 |
| 2-Hydroxy-4-(Methylthio)Butanoate | 0.0633 | 0.0620 | 0.0948 | 0.0638 |
| 2-Hydroxybutyrate | 0.3129 | 0.2048 | 0.3553 | 0.1956 |
| 2-Hydroxyphenylacetate | 0.0638 | 0.0592 | 0.0694 | 0.0566 |
| 2-Methylglutarate | 0.1030 | 0.0930 | 0.1170 | 0.0821 |
| 2-Methylmaleate | 0.5478 | 0.2618 | 0.8048 | 0.1918 |
| 2OH-MBP (Mono(2-hydroxy-isobutyl)phthalate) / 3OH-MBP (Mono-(3-hydroxy-n-butyl) phthalate) | 0.0256 | 0.0205 | 0.0147 | 0.0231 |
| 3-(2-Hydroxyphenyl)Propanoate | 0.1390 | 0.1236 | 0.1119 | 0.1136 |
| 3-Hydroxybenzoate | 0.0533 | 0.0576 | 0.1257 | NA |
| 3-Methoxy-4-Hydroxymandelate | 0.2136 | 0.1435 | 0.1566 | 0.2152 |
| 3-Methoxytyramine | 0.4807 | 0.4677 | 0.7106 | 0.4481 |
| 3-Methyglutarate | 0.1725 | 0.3652 | 0.2481 | 0.1088 |
| 3-Methyl-2-Oxindole | 0.0514 | 0.0349 | 0.0337 | 0.0520 |
| 3-Methyl-2-Oxovalerate | 0.0956 | 0.0270 | 0.0783 | 0.0790 |
| 4-Aminobenzoate | 0.0816 | 0.0570 | 0.0318 | 0.0827 |
| 4-Coumarate | 0.0178 | 0.0084 | 0.0082 | 0.0103 |
| 4-Hydroxybenzoate | 0.0693 | 0.0342 | 0.0331 | 0.0590 |
| 4-Quinolinecarboxylate | 0.0268 | 0.0613 | 0.0563 | 0.0279 |
| 6-Carboxyhexanoate | 0.4102 | 0.4331 | 0.4441 | 0.2986 |
| Acetyl-L-Leucine | 0.0486 | 0.0412 | 0.0309 | 0.0482 |
| Adipate | 0.1848 | 0.3651 | 0.2510 | 0.1107 |
| Anthranilate | 0.0816 | 0.0570 | 0.0318 | 0.0827 |
| Azelate | 1.6056 | 1.2805 | 0.7948 | 2.2208 |
| Benzylamine | 1.0239 | 1.1936 | 1.4785 | 1.0467 |
| Biotin | 0.0149 | 0.0266 | 0.0261 | 0.0166 |
| Bisphenol S | 0.1421 | 1.5181 | 1.1018 | 0.0697 |
| Butyl Paraben | 0.0432 | 0.0466 | 0.0603 | 0.0404 |
| Caffeate | 0.0211 | 0.0291 | 0.0244 | 0.0135 |
| Caprylate | 0.0669 | 0.0520 | 0.0450 | 0.0798 |
| Cholate | 0.2855 | 0.2645 | 0.3805 | 0.2624 |
| Cis-Resveratrol | 0.0082 | NA | NA | 0.0021 |
| Cortisol | 0.0103 | 0.0097 | 0.0068 | 0.0097 |
| Cortisone | 0.0205 | 0.0240 | 0.0348 | 0.0185 |
| cx-MiDP (MCNP) (Mono(2,7-dimethyl-7-carboxyheptyl) phthalate / Monocarboxyisodecyl phthalate ) | 0.1878 | 5.5880 | 4.7345 | 0.1424 |
| Deoxycholate | 0.0025 | 0.0028 | 0.0021 | 0.0014 |
| Dihydroxyacetone Phosphate | 0.0173 | 0.0169 | 0.0280 | 0.0160 |
| Dodecanedioic Acid | 0.0484 | 0.0445 | 0.0357 | 0.0628 |
| Elaidate / Oleate /Petroselinate | 0.0080 | 0.0073 | 0.0095 | 0.0058 |
| Estriol | 2.6756 | 2.2988 | 3.0168 | 2.7098 |
| Ethylmalonate | 0.0514 | 0.0547 | 0.1060 | 0.0378 |
| Ferulate | 0.0097 | 0.0205 | 0.0277 | 0.0086 |
| Glycochenodeoxycholate | 0.0052 | 0.0021 | 0.0033 | 0.0040 |
| Glycocholate | 0.0214 | 0.0123 | 0.0106 | 0.0200 |
| Guaiacol | 0.0516 | 0.0498 | 0.0499 | 0.0504 |
| Hippurate | 23.9964 | 27.6480 | 34.9249 | 25.0840 |
| Homogentisate | 0.1216 | 0.0665 | 0.0540 | 0.0888 |
| Homovanillate | 0.1054 | 0.0698 | 0.0536 | 0.1073 |
| Hydroquinone | 0.0339 | 0.1737 | 0.2419 | 0.0322 |
| Hydroxyphenyllactate | 0.9250 | 1.1213 | 1.0130 | 0.9095 |
| Indole-3-Acetate | 0.0340 | 0.0380 | 0.0246 | 0.0344 |
| Indole-3-Carboxylic Acid | 0.0079 | 0.0192 | 0.0028 | 0.0047 |
| Indole-3-Ethanol | 0.0307 | 0.0320 | 0.0214 | 0.0294 |
| Indoleacetaldehyde | 0.0082 | 0.0053 | 0.0051 | 0.0049 |
| Indoxyl Sulfate | 32.6657 | 31.7806 | 24.3128 | 36.1094 |
| Itaconate | 0.5202 | 0.2690 | 0.7871 | 0.1989 |
| Lumichrome | 0.0080 | 0.0053 | NA | 0.0072 |
| Mandelate | 0.0673 | 0.0573 | 0.0263 | 0.0651 |
| m-Coumaric acid | 0.0390 | 0.0270 | 0.0167 | 0.0235 |
| MCPP (Mono (3-carboxpropyl) phthalate) | 0.0025 | 0.0041 | 0.0043 | NA |
| MECPP (Mono-2-ethyl-5-carboxypentyl phthalate) | 0.0224 | 0.0137 | 0.0296 | 0.0200 |
| MEHHP (Mono-2-ethyl-5-hydroxyhexyl phthalate) | 0.0169 | 0.0055 | 0.0106 | 0.0091 |
| MEP (Mono-ethyl phthalate) | 0.0189 | 0.0414 | 0.0245 | 0.0164 |
| Methyl Paraben | 0.0051 | 0.0046 | 0.0041 | NA |
| MMP (Mono-methyl phthalate) | 0.0086 | 0.0025 | 0.0019 | 0.0036 |
| N-Acetylphenylalanine | 0.0345 | 0.0357 | 0.0255 | 0.0329 |
| N-Formyl-L-Methionine | 0.0099 | 0.0087 | 0.0131 | 0.0096 |
| Normetanephrine | 0.0065 | 0.0063 | 0.0102 | 0.0061 |
| OH-MiNP (7-OH-(Mono-methyl-octyl) phthalate / Mono-(4-methyl-7-hydroxyloctyl) phthalate) | 0.0085 | 0.0140 | 0.0037 | NA |
| Oxoadipate | 0.1314 | 0.1236 | 0.1622 | 0.1263 |
| Oxoglutarate | 0.3561 | 0.1090 | 0.3719 | 0.4656 |
| Palmitate | 0.0508 | 0.0363 | 0.0499 | 0.0331 |
| Phenylacetate | 0.9288 | 1.1438 | 1.0277 | 0.9231 |
| P-Hydroxyphenylacetate | 0.0642 | 0.0689 | 0.0695 | 0.0569 |
| Pregnenolone Sulfate | 0.0385 | 0.0245 | 0.0233 | 0.0360 |
| Riboflavin | 0.0860 | 0.0243 | 0.0204 | 0.0734 |
| Rosmarinate | 0.0078 | 0.0084 | 0.0093 | 0.0080 |
| Salicylate | 0.0352 | 0.1742 | 0.2454 | 0.0321 |
| Salsolinol | 0.3795 | 0.3618 | 0.5167 | 0.3518 |
| Sebacic Acid | 0.2079 | 0.1481 | 0.2271 | 0.2772 |
| S-Hexyl-Glutathione | NA | 0.0116 | NA | NA |
| Sorbate | 0.0512 | 0.0402 | 0.0543 | 0.0495 |
| Stearic Acid | 0.0757 | 0.0582 | 0.0700 | 0.0494 |
| Suberate | 0.5552 | 0.5899 | 0.7217 | 0.6333 |
| Trans-Resveratrol | 0.0060 | 0.0070 | NA | 0.0036 |
Factors:
| F1 | Analysis type:CHEAR 2016-1407 Study Sample |
| F2 | Analysis type:CHEAR Pooled Urine |
| F3 | Analysis type:NIST Smoker''s Urine |
| F4 | Analysis type:Study Pooled QC |