Data for (Study ST000992)
(Analysis AN001618)Values for each metabolite have been scaled by dividing by the mean across all factors Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study| Metabolite | F1 | F2 | F3 | F4 | F5 | F6 |
|---|---|---|---|---|---|---|
| 1,3,7-TRIMETHYLURIC ACID (M-H)- | 1.0183 | 1.5335 | 0.9570 | 0.7233 | 1.2600 | 2.4390 |
| 16:0 LYSO PC (M+Cl)- | 0.6920 | 0.5483 | 1.0912 | 1.1473 | 0.7093 | 1.6894 |
| 16:0 LYSO PC (M+HCOO)- | 0.7597 | 0.6193 | 1.0808 | 1.2041 | 0.7190 | 0.4290 |
| 1-METHYLXANTHINE (M-H)- | 0.7904 | 1.2355 | 1.0165 | 1.1218 | 1.0256 | 0.9306 |
| 2-HYDROXY-3-METHYLBUTYRIC ACID (M-H)- | 0.9460 | 0.8012 | 0.9551 | 1.2401 | 1.4616 | 0.3895 |
| 3-(4-HYDROXYPHENYL)LACTATE (M-H)- | 0.8558 | 0.8029 | 1.0389 | 0.9441 | 1.6263 | 0.4245 |
| 3-METHYLXANTHINE (M-H)- | 0.3460 | 0.1793 | 0.9289 | 2.3328 | 1.4786 | 0.6113 |
| 4-ACETAMINOPHEN SULFATE (M-H)- | 1.8500 | 0.4529 | 0.9761 | 0.0068 | 1.4590 | NA |
| 4-NITROPHENOL (M-H)- | 0.9027 | 1.1149 | 1.0294 | 0.9563 | 1.1027 | 0.7118 |
| 4-PYRIDOXATE (M-H)- | 1.6546 | 0.6612 | 0.8941 | 0.8283 | 0.8646 | 0.5436 |
| ADIPIC ACID (M-H)- | 1.1447 | 0.6005 | 0.9904 | 1.0076 | 1.0824 | 0.4372 |
| BENZOATE (M-H)- | 0.9280 | 1.0731 | 1.0726 | 0.7605 | 1.0830 | 0.6061 |
| BILIVERDIN (M-H)- | 0.9462 | 1.0109 | 1.0601 | 0.7565 | 0.9933 | 1.2875 |
| CHOLATE (M+Cl)- | 0.5064 | 0.3975 | 1.0742 | 0.9364 | 1.7398 | NA |
| CIS-7,10,13,16-DOCOSATETRAENOIC ACID (M-H)- | 1.1788 | 1.3962 | 0.9837 | 0.8070 | 0.7627 | 0.7330 |
| CIS-ACONITATE (M-H)- | 1.0000 | 0.9795 | 1.0005 | 0.9691 | 1.0889 | NA |
| CITRULLINE (M-H)- | 1.1065 | 1.0082 | 0.9636 | 0.9664 | 1.2788 | 0.8026 |
| CORTISOL (M+Cl)- | 0.9967 | 1.0268 | 1.0032 | 0.9390 | 1.3209 | 0.4610 |
| CORTISOL (M+HCOO)- | 0.9514 | 1.0907 | 1.0051 | 0.9795 | 1.3049 | 0.4538 |
| CORTISONE (M+Cl)- | 0.8834 | 1.0793 | 1.0159 | 1.0695 | 1.0697 | 0.6260 |
| CORTISONE (M+HCOO)- | 0.8553 | 1.0904 | 1.0091 | 1.1117 | 1.1688 | 0.6953 |
| DEHYDROASCORBATE (M-H)- | 1.0985 | 1.2027 | 0.9826 | 0.7914 | 1.1718 | 0.9319 |
| DEOXYCHOLIC ACID (M+Cl)- | 0.9235 | 0.4727 | 1.1430 | 0.5610 | 0.9680 | 0.2479 |
| EPIBRASSINOLIDE [ISTD] (M+HCOO)- | 0.9785 | 1.0078 | 1.0097 | 0.9921 | 1.0471 | 0.7526 |
| GIBBERELLIC ACID [ISTD] (2M-H)- | 0.9313 | 1.2167 | 1.0107 | 0.9611 | 1.1732 | 0.6692 |
| GIBBERELLIC ACID [ISTD] (M-H)- | 0.9683 | 1.1168 | 1.0049 | 0.9865 | 1.0583 | 0.8207 |
| GLUTARATE (M-H)- | 0.9931 | NA | 1.1309 | 0.5765 | 0.6537 | NA |
| GLYCOCHOLATE (M-H)- | 0.6494 | 0.4770 | 1.1779 | 1.1523 | 0.2973 | 0.2255 |
| GLYCOLITHOCHOLATE (M-H)- | 1.6069 | 1.7703 | 0.7896 | 0.4769 | 0.7099 | 1.6001 |
| GULONO-1,4-LACTONE (M-H)- | 1.0017 | 1.2771 | 1.0084 | 0.8339 | 1.2572 | 0.6283 |
| HIPPURATE (M-H)- | 1.1250 | 0.8762 | 0.9468 | 0.8912 | 1.6692 | 1.3795 |
| HYODEOXYCHOLATE (M-H)- | 0.9206 | 0.6430 | 1.0208 | 1.1209 | 0.8571 | 1.4027 |
| INOSINE 5^-DIPHOSPHATE (M-H)- | 0.9283 | 1.0961 | 1.0005 | 1.1502 | 0.7618 | 0.9032 |
| INOSINE (M-H)- | 2.1364 | 1.1695 | 0.8510 | 0.5792 | 0.6714 | 0.1183 |
| ISOCITRATE (M-H)- | 1.0177 | 1.0716 | 1.0130 | 0.8876 | 1.0339 | 0.9372 |
| ISOLEUCINE (M-H)- | 0.8862 | 1.2894 | 1.0515 | 0.8468 | 0.8769 | 1.2342 |
| L-[15N]ANTHRANILIC ACID [ISTD] (M-H)- | 0.9468 | 0.9393 | 0.9550 | 1.3719 | 0.9610 | 0.4385 |
| LEUCINE (M-H)- | 0.8776 | 1.2629 | 1.0617 | 0.8389 | 0.8261 | 1.2221 |
| L-HISTIDINE (M-H)- | 0.9978 | 1.0192 | 1.0008 | 0.9467 | 1.2097 | 0.7866 |
| LINOLEATE (M-H)- | 1.2121 | 1.3041 | 0.9461 | 0.9016 | 0.9217 | 0.9263 |
| L-TRYPTOPHAN-15N2 [ISTD] (M-H)- | 0.9708 | 1.0747 | 1.0010 | 1.0052 | 1.0904 | 0.8143 |
| MALATE (M-H)- | 1.0296 | 0.8759 | 1.0216 | 0.9384 | 0.9069 | 0.8250 |
| MANDELIC ACID (M-H)- | 1.8245 | 0.6462 | 0.7485 | 1.2483 | 1.2998 | 0.3492 |
| METHYL BETA-D-GALACTOSIDE (M+Cl)- | 1.4202 | 0.7941 | 0.9462 | 0.5922 | 1.2120 | 1.7039 |
| METHYLMALONATE (M-H)- | 0.9533 | 3.9723 | 0.8533 | 0.8882 | 1.0109 | 0.8630 |
| N-ACETYL-D-GLUCOSAMINE (M+Cl)- | 0.8047 | 0.9800 | 1.0468 | 1.0891 | NA | NA |
| N-ACETYL-L-ALANINE (M-H)- | 1.0192 | 1.0006 | 0.9761 | 1.0213 | 1.2799 | 0.7997 |
| ORNITHINE (M-H)- | 1.0607 | 0.7649 | 1.0177 | 1.0132 | 0.7492 | 0.6582 |
| PALMITATE (M-H)- | 1.2430 | 1.2965 | 0.9420 | 0.8949 | 0.9143 | 0.8005 |
| PANTOTHENATE (M-H)- | 1.1441 | 0.9366 | 0.9195 | 1.2281 | 1.0337 | 0.6556 |
| PHENYLALANINE (M-H)- | 0.8966 | 1.1996 | 1.0060 | 0.9293 | 1.4881 | 0.8050 |
| PURINE (M-H)- | 0.4981 | 1.0881 | 1.1226 | 1.0179 | 0.7215 | 1.1005 |
| (S)-3-METHYL-2-OXOPENTANOATE (M-H)- | 0.8142 | 1.0508 | 1.0275 | 1.0223 | 1.3658 | 0.8096 |
| SALICYLATE (M-H)- | 2.3123 | 4.5308 | 0.6418 | 0.0981 | 0.3868 | 0.0888 |
| SEBACIC ACID (M-H)- | 1.0487 | 0.8088 | 1.0117 | 0.9578 | 0.9747 | 0.8263 |
| STEARATE (M-H)- | 1.0836 | 1.0974 | 0.9306 | 1.2942 | 0.7290 | 0.7398 |
| SUBERIC ACID (M-H)- | 0.9701 | 0.9061 | 1.0245 | 1.0140 | 0.8559 | 0.8188 |
| THEOPHYLLINE (M-H)- | 1.0018 | 1.1588 | 0.9974 | 0.8758 | 0.9964 | 1.7535 |
| TRYPTOPHAN (M-H)- | 0.8784 | 0.9353 | 1.0216 | 0.9666 | 1.4480 | 0.8510 |
| TYROSINE (M-H)- | 1.0104 | 1.1008 | 0.9976 | 0.8612 | 1.3884 | 0.8942 |
| URIDINE (M+Cl)- | 0.9452 | 1.2410 | 1.0102 | 0.8640 | 1.4455 | 0.5765 |
| URIDINE (M-H)- | 1.0049 | 1.1776 | 1.0067 | 0.8626 | 1.2852 | 0.6034 |
| URSODIOL (M-H)- | 1.1083 | 0.8279 | 0.9626 | 0.7912 | 1.7097 | 0.5222 |
| URSODIOL (M+HCOO)- | 0.4019 | 0.3246 | 1.3196 | 0.6223 | 0.9298 | 0.0876 |
| XANTHINE (M-H)- | 0.9736 | 1.1189 | 0.9942 | 0.8462 | 1.7321 | 0.6343 |
Factors:
| F1 | Gender:Female | Metabolic syndrome:No | Smoker:No |
| F2 | Gender:Female | Metabolic syndrome:Yes | Smoker:No |
| F3 | Gender:Male | Metabolic syndrome:No | Smoker:No |
| F4 | Gender:Male | Metabolic syndrome:No | Smoker:Yes |
| F5 | Gender:Male | Metabolic syndrome:Yes | Smoker:No |
| F6 | Gender:Male | Metabolic syndrome:Yes | Smoker:Yes |
