Clustering data with hclust algorithm for (Study ST003484)
Reversed phase POSITIVE ION MODE (Analysis AN005722)| Metabolite | Structure | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 | F13 | F14 | F15 | F16 | F17 | F18 | F19 | F20 | F21 | F22 | F23 | F24 | F25 | F26 | F27 | F28 | F29 | F30 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| acyl-C8 (L-octanoylcarnitine | ME908425 | 13.11 | 0.04 | 0.06 | 0.03 | 0.12 | 0.19 | 0.10 | 0.08 | 0.09 | 0.07 | 0.12 | 0.10 | 0.19 | 0.17 | 0.07 | 13.86 | 0.05 | 0.07 | 0.05 | 0.13 | 0.29 | 0.10 | 0.09 | 0.13 | 0.12 | 0.20 | 0.10 | 0.11 | 0.07 | 0.09 |
| acyl-C4 (butanoyl-l-carnitine) | ME908420 | 11.14 | 0.14 | 0.09 | 0.11 | 0.09 | 0.51 | 0.30 | 0.13 | 0.19 | 0.11 | 0.14 | 0.08 | 0.32 | 0.29 | 0.17 | 12.05 | 0.10 | 0.15 | 0.10 | 0.11 | 0.49 | 0.81 | 0.18 | 0.24 | 0.23 | 0.26 | 0.23 | 0.17 | 0.91 | 0.15 |
| acyl-C6 (hexanoyl-l-carnitine) | ME908424 | 11.29 | 0.09 | 0.10 | 0.12 | 0.11 | 0.42 | 0.24 | 0.09 | 0.18 | 0.10 | 0.20 | 0.11 | 0.42 | 0.28 | 0.23 | 13.57 | 0.10 | 0.13 | 0.09 | 0.11 | 0.42 | 0.25 | 0.15 | 0.20 | 0.13 | 0.18 | 0.11 | 0.25 | 0.11 | 0.21 |
| L-arginine | ME908349 | 0.57 | 0.11 | 0.19 | 0.16 | 0.19 | 0.54 | 0.55 | 0.70 | 0.90 | 0.56 | 0.81 | 0.80 | 0.17 | 1.32 | 0.17 | 0.61 | 0.19 | 0.21 | 0.16 | 0.16 | 0.38 | 0.49 | 0.29 | 0.69 | 0.57 | 10.13 | 6.99 | 0.13 | 1.04 | 0.21 |
| acyl-C2 (acetyl-carnitine) | ME908418 | 5.74 | 0.41 | 0.12 | 0.26 | 0.22 | 2.14 | 1.30 | 0.50 | 0.83 | 0.38 | 0.50 | 0.92 | 0.31 | 1.20 | 0.23 | 6.75 | 0.16 | 0.69 | 0.22 | 0.39 | 1.98 | 0.38 | 0.58 | 0.95 | 0.59 | 0.90 | 0.53 | 0.21 | 0.29 | 0.33 |
| acyl-C10:1 (O-Decenoyl-L-carnitine) | ME908427 | 8.99 | 0.56 | 0.53 | 0.27 | 0.51 | 0.56 | 0.43 | 0.45 | 1.51 | 0.37 | 0.63 | 0.48 | 0.24 | 0.47 | 0.11 | 7.02 | 0.62 | 0.65 | 0.60 | 0.48 | 0.63 | 0.53 | 0.49 | 0.67 | 0.33 | 0.72 | 0.57 | 0.14 | 0.29 | 0.16 |
| Acetylcholine | ME908416 | 7.39 | 0.08 | 0.11 | 0.18 | 0.17 | 0.56 | 0.38 | 0.33 | 0.44 | 0.30 | 0.41 | 0.28 | 0.63 | 0.58 | 0.59 | 7.70 | 0.15 | 0.54 | 0.17 | 0.24 | 0.83 | 1.22 | 0.50 | 0.95 | 0.70 | 0.67 | 1.28 | 0.57 | 1.20 | 0.85 |
| acyl-C3 (propionyl-carnitine) | ME908419 | 8.44 | 0.12 | 0.05 | 0.10 | 0.10 | 2.03 | 0.63 | 0.27 | 0.49 | 0.20 | 0.38 | 0.49 | 0.38 | 0.75 | 0.24 | 7.79 | 0.06 | 0.17 | 0.06 | 0.13 | 1.68 | 1.31 | 0.37 | 0.50 | 0.36 | 0.54 | 0.57 | 0.22 | 1.32 | 0.24 |
| N-formyl kynurenine | ME908408 | 8.56 | 0.08 | 0.12 | 0.09 | 0.28 | 1.83 | 0.68 | 0.17 | 0.57 | 0.32 | 0.75 | 0.45 | 0.49 | 1.23 | 0.38 | 8.98 | 0.06 | 0.20 | 0.14 | 0.43 | 1.10 | 0.52 | 0.13 | 0.29 | 0.28 | 0.51 | 0.19 | 0.03 | 0.26 | 0.08 |
| acyl-C5 (isovalerylcarnitine) | ME908422 | 4.70 | 0.54 | 0.65 | 0.38 | 0.53 | 1.23 | 0.63 | 0.81 | 0.84 | 0.41 | 0.58 | 0.60 | 0.41 | 0.50 | 0.38 | 5.09 | 0.72 | 0.66 | 0.60 | 0.71 | 0.96 | 2.56 | 0.63 | 0.59 | 0.37 | 0.92 | 0.60 | 0.34 | 1.69 | 0.35 |
| 5-Hydroxyindoleacetate | ME908402 | 5.77 | 0.01 | 0.05 | 0.07 | 0.22 | 1.66 | 1.22 | 0.09 | 0.45 | 0.45 | 1.53 | 0.34 | 0.26 | 1.76 | 0.23 | 5.46 | 0.01 | 0.05 | 0.02 | 0.19 | 1.15 | 3.82 | 0.06 | 0.22 | 0.38 | 0.90 | 0.55 | 0.01 | 2.69 | 0.04 |
| kynurenine | ME908407 | 5.82 | 0.03 | 0.03 | 0.07 | 0.20 | 1.57 | 1.23 | 0.09 | 0.40 | 0.47 | 1.48 | 0.32 | 0.27 | 1.77 | 0.23 | 5.91 | 0.03 | 0.05 | 0.03 | 0.18 | 1.14 | 3.61 | 0.06 | 0.18 | 0.32 | 0.88 | 0.54 | 0.02 | 2.69 | 0.06 |
| Indole-3-acetaldehyde | ME908404 | 4.38 | 0.23 | 0.31 | 0.59 | 0.31 | 0.59 | 0.61 | 0.85 | 1.57 | 0.53 | 0.96 | 0.36 | 1.07 | 0.86 | 1.13 | 4.06 | 0.21 | 0.54 | 0.37 | 0.83 | 0.51 | 1.37 | 0.58 | 0.88 | 0.76 | 0.95 | 3.24 | 0.12 | 0.78 | 0.24 |
| L-tryptophan | ME908364 | 5.13 | 0.14 | 0.23 | 0.45 | 0.51 | 0.32 | 0.33 | 0.68 | 1.65 | 0.51 | 0.96 | 0.22 | 1.10 | 0.64 | 1.21 | 4.77 | 0.24 | 0.66 | 0.25 | 0.70 | 0.32 | 1.12 | 0.57 | 0.93 | 0.49 | 1.16 | 3.90 | 0.07 | 0.64 | 0.11 |
| gamma-L-Glutamyl-D-alanine | ME908386 | 4.74 | 0.07 | 0.14 | 0.16 | 0.13 | 0.36 | 0.23 | 0.61 | 0.72 | 0.52 | 0.70 | 0.53 | 0.45 | 0.49 | 0.52 | 5.23 | 0.06 | 0.37 | 0.22 | 0.29 | 1.00 | 1.12 | 1.07 | 2.59 | 2.45 | 1.76 | 0.91 | 0.36 | 1.31 | 0.89 |
| acyl-C4-DC | ME908421 | 3.64 | 0.16 | 0.08 | 0.12 | 0.19 | 0.93 | 0.54 | 0.79 | 0.73 | 0.35 | 0.52 | 0.65 | 0.18 | 0.91 | 0.41 | 4.30 | 0.18 | 0.67 | 0.21 | 0.39 | 0.90 | 2.11 | 0.83 | 1.84 | 1.67 | 1.34 | 1.87 | 0.26 | 2.15 | 0.80 |
| L-aspartate | ME908351 | 5.21 | 0.13 | 0.19 | 0.14 | 0.20 | 0.20 | 0.28 | 0.78 | 1.07 | 0.95 | 1.39 | 0.71 | 0.48 | 1.87 | 0.24 | 4.29 | 0.21 | 0.29 | 0.30 | 0.24 | 0.55 | 0.63 | 0.66 | 1.25 | 1.02 | 1.56 | 1.84 | 0.33 | 2.74 | 0.27 |
| L-alanine | ME908348 | 4.90 | 0.20 | 0.19 | 0.20 | 0.27 | 0.33 | 0.34 | 0.54 | 1.13 | 0.56 | 0.82 | 0.48 | 0.39 | 0.74 | 0.28 | 4.25 | 0.28 | 0.57 | 0.44 | 0.55 | 1.13 | 1.25 | 0.87 | 1.50 | 1.14 | 1.78 | 1.73 | 0.25 | 2.48 | 0.40 |
| L-threonine | ME908363 | 4.15 | 0.10 | 0.16 | 0.14 | 0.18 | 0.45 | 0.36 | 0.61 | 1.06 | 0.66 | 1.13 | 0.95 | 0.68 | 1.22 | 0.54 | 3.49 | 0.21 | 0.47 | 0.32 | 0.33 | 1.35 | 1.02 | 0.79 | 1.58 | 1.06 | 1.62 | 2.08 | 0.37 | 2.38 | 0.54 |
| Uracil | ME908375 | 0.20 | 0.50 | 0.67 | 0.93 | 0.96 | 0.83 | 0.56 | 0.33 | 0.68 | 0.19 | 0.38 | 0.42 | 0.23 | 0.24 | 0.21 | 0.21 | 1.88 | 2.86 | 1.11 | 2.50 | 0.61 | 1.98 | 0.24 | 0.42 | 0.29 | 0.52 | 7.40 | 0.18 | 2.22 | 0.25 |
| Creatinine | ME908396 | 0.52 | 0.05 | 0.05 | 0.05 | 0.07 | 1.36 | 0.36 | 2.74 | 2.39 | 1.15 | 2.52 | 1.82 | 0.06 | 1.66 | 0.06 | 0.45 | 0.06 | 0.10 | 0.06 | 0.08 | 2.23 | 0.26 | 2.57 | 2.73 | 2.10 | 3.15 | 0.95 | 0.04 | 0.32 | 0.07 |
| Indole | ME908403 | 0.39 | 0.08 | 0.09 | 0.07 | 0.08 | 0.64 | 0.36 | 2.67 | 4.86 | 2.10 | 0.67 | 0.49 | 0.08 | 0.46 | 0.07 | 0.29 | 0.08 | 0.09 | 0.09 | 0.08 | 0.69 | 0.68 | 2.49 | 4.94 | 2.58 | 3.48 | 0.82 | 0.05 | 0.50 | 0.04 |
| Putrescine | ME908390 | 0.06 | 0.20 | 0.37 | 0.67 | 0.49 | 5.30 | 1.73 | 0.26 | 0.87 | 0.25 | 0.39 | 2.43 | 0.44 | 1.17 | 0.32 | 0.06 | 0.36 | 1.49 | 0.36 | 0.74 | 1.84 | 3.79 | 0.44 | 0.92 | 0.70 | 1.52 | 1.09 | 0.12 | 1.10 | 0.47 |
| Spermidine | ME908391 | 0.25 | 0.86 | 0.40 | 1.40 | 0.53 | 4.85 | 0.85 | 0.11 | 2.15 | 0.33 | 0.23 | 0.79 | 0.70 | 0.53 | 0.22 | 0.19 | 0.29 | 1.84 | 0.11 | 0.59 | 0.43 | 5.47 | 0.33 | 0.42 | 0.18 | 0.59 | 3.35 | 0.13 | 0.31 | 0.57 |
| Tryptophan 13C11 | ME908428 | 0.00 | NA | NA | NA | 0.19 | NA | NA | NA | NA | NA | 0.70 | NA | 0.09 | 2.99 | 0.15 | 0.00 | 0.20 | 0.69 | 0.18 | 0.27 | 0.90 | 0.45 | 0.53 | 1.04 | 0.72 | 0.47 | 5.82 | 0.77 | 3.16 | 1.68 |
| Indole-Pyruvate 13C11 | ME908429 | 0.17 | NA | NA | NA | 0.09 | NA | NA | NA | NA | NA | 0.08 | NA | 0.19 | 5.05 | 0.14 | 0.15 | 0.10 | 0.08 | 0.08 | 0.11 | 2.67 | 1.81 | 0.10 | 0.07 | 0.10 | 0.09 | 2.51 | 0.12 | 4.85 | 0.22 |
| Kynurenine 13C10 | ME908431 | 0.00 | NA | NA | NA | 0.25 | NA | NA | NA | NA | NA | 1.78 | NA | 0.09 | 2.79 | 0.11 | 0.00 | 0.03 | 0.12 | 0.11 | 0.75 | 0.42 | 2.71 | 0.19 | 1.55 | 1.56 | 1.06 | 3.11 | 0.14 | 3.85 | 0.36 |
| L-Formylkynurenine 13C11 | ME908430 | NA | NA | NA | NA | 0.08 | NA | NA | NA | NA | NA | 1.13 | NA | 0.01 | 3.89 | 0.02 | NA | 0.07 | 0.13 | 0.06 | 0.16 | 0.42 | 2.23 | 0.14 | 0.52 | 0.55 | 0.37 | 3.28 | 0.04 | 4.50 | 0.10 |
| Homocarnosine | ME908394 | 0.22 | 0.78 | 0.55 | 0.47 | 0.57 | 1.58 | 0.99 | 0.65 | 1.43 | 0.99 | 1.86 | 1.35 | 1.38 | 1.90 | 0.32 | 0.63 | 0.39 | 0.14 | 0.57 | 0.27 | 1.12 | 0.70 | 1.11 | 0.60 | 0.44 | 0.92 | 1.27 | 3.87 | 0.99 | 0.65 |
| L-cystine | ME908367 | 0.72 | 0.29 | 0.72 | 0.81 | 0.80 | 0.63 | 0.50 | 0.61 | 0.74 | 0.43 | 0.57 | 0.22 | 4.55 | 0.51 | 1.77 | 0.78 | 0.58 | 0.68 | 0.62 | 0.66 | 0.54 | 1.03 | 0.60 | 1.10 | 1.30 | 1.28 | 0.75 | 3.08 | 0.64 | 2.23 |
| Spermine | ME908392 | 0.78 | 2.25 | 1.45 | 0.85 | 0.67 | 1.79 | 0.92 | 0.28 | 3.97 | 0.98 | 0.79 | 0.36 | 2.00 | 0.44 | 0.69 | 0.38 | 0.50 | 2.14 | 0.17 | 0.72 | 0.49 | 1.28 | 0.37 | 0.92 | 0.42 | 1.19 | 2.14 | 0.15 | 0.25 | 0.43 |
| Allantoate | ME908378 | 1.17 | 0.83 | 0.50 | 0.43 | 0.98 | 0.64 | 0.41 | 0.71 | 3.56 | 0.33 | 0.71 | 0.54 | 0.90 | 1.05 | 0.51 | 1.44 | 0.17 | 1.70 | 1.02 | 2.67 | 1.11 | 1.16 | 0.89 | 0.93 | 0.62 | 2.98 | 0.37 | 0.70 | 0.41 | 0.61 |
| Ornithine | ME908389 | 0.37 | 0.75 | 0.31 | 0.28 | 0.54 | 0.30 | 0.48 | 0.61 | 4.89 | 0.94 | 1.20 | 1.00 | 0.35 | 1.04 | 0.13 | 0.40 | 0.46 | 1.05 | 1.35 | 1.99 | 0.91 | 0.65 | 2.77 | 0.76 | 0.47 | 3.93 | 1.11 | 0.21 | 0.56 | 0.16 |
| L-cysteine | ME908352 | 0.13 | 1.33 | 1.20 | 0.91 | 1.31 | 0.95 | 1.30 | 1.15 | 1.38 | 1.39 | 1.32 | 1.51 | 0.01 | 1.14 | 0.00 | 0.10 | 1.47 | 1.21 | 1.56 | 1.11 | 1.25 | 0.94 | 1.43 | 1.04 | 1.06 | 1.19 | 1.40 | 0.01 | 1.18 | 0.02 |
| Hypoxanthine | ME908377 | 0.03 | 0.96 | 0.42 | 0.60 | 0.58 | 1.47 | 0.66 | 0.77 | 2.84 | 0.74 | 0.79 | 0.53 | 0.16 | 0.36 | 0.14 | 0.08 | 0.87 | 2.10 | 1.50 | 2.78 | 1.52 | 2.21 | 0.57 | 0.87 | 1.78 | 2.16 | 0.66 | 0.21 | 0.88 | 0.75 |
| Nicotinamide | ME908381 | 0.64 | 0.64 | 0.36 | 0.68 | 0.51 | 0.95 | 0.65 | 0.89 | 1.89 | 0.79 | 0.82 | 0.81 | 0.59 | 0.87 | 0.43 | 0.74 | 0.92 | 2.86 | 1.15 | 1.97 | 0.91 | 1.58 | 0.76 | 1.40 | 1.25 | 1.04 | 1.17 | 0.64 | 1.48 | 0.61 |
| dTMP | ME908374 | 0.74 | 0.18 | 0.35 | 0.32 | 0.41 | 2.56 | 0.71 | 0.35 | 1.13 | 0.61 | 2.03 | 0.42 | 0.71 | 0.59 | 0.41 | 0.74 | 0.79 | 0.76 | 0.19 | 0.57 | 0.86 | 3.68 | 3.69 | 1.48 | 1.28 | 1.53 | 0.80 | 0.44 | 0.99 | 0.69 |
| Glutathione disulfide | ME908384 | 2.46 | 0.10 | 0.21 | 0.40 | 0.32 | 1.26 | 0.24 | 0.54 | 0.90 | 0.58 | 0.72 | 0.29 | 2.65 | 0.42 | 1.99 | 3.12 | 0.19 | 0.58 | 0.22 | 0.47 | 0.59 | 1.23 | 2.17 | 1.16 | 1.07 | 0.90 | 0.26 | 1.67 | 0.54 | 2.74 |
| L-Methionine S-oxide | ME908401 | 2.37 | 0.52 | 0.55 | 2.48 | 0.69 | 1.33 | 1.69 | 0.59 | 0.55 | 0.43 | 0.31 | 0.27 | 1.54 | 0.55 | 1.65 | 3.15 | 0.32 | 0.88 | 0.53 | 1.81 | 0.71 | 1.12 | 0.39 | 0.69 | 0.68 | 0.36 | 0.21 | 0.97 | 0.61 | 2.06 |
| 2-Aminomuconate | ME908410 | 1.97 | 0.25 | 0.47 | 1.04 | 0.64 | 1.56 | 0.79 | 0.60 | 0.80 | 0.63 | 0.66 | 0.92 | 1.62 | 0.47 | 0.91 | 2.16 | 0.25 | 1.53 | 0.49 | 0.76 | 1.40 | 1.14 | 0.79 | 1.17 | 1.04 | 1.10 | 1.64 | 0.94 | 0.82 | 1.38 |
| acyl-C8:1 (octenoyl-l-carnitine) | ME908426 | 3.46 | 0.84 | 1.04 | 0.56 | 0.87 | 1.00 | 0.73 | 0.83 | 1.26 | 0.72 | 1.20 | 1.08 | 0.41 | 0.66 | 0.41 | 3.04 | 1.01 | 1.04 | 0.96 | 0.69 | 0.95 | 0.96 | 0.93 | 1.05 | 0.71 | 1.00 | 1.16 | 0.43 | 0.71 | 0.30 |
| N-Methylethanolamine phosphate | ME908415 | 3.28 | 1.95 | 0.78 | 0.58 | 0.69 | 0.72 | 0.54 | 0.58 | 0.63 | 0.59 | 0.61 | 0.52 | 1.22 | 0.66 | 0.77 | 2.92 | 0.48 | 1.06 | 1.08 | 1.33 | 1.20 | 0.71 | 0.32 | 0.67 | 0.97 | 0.85 | 1.08 | 1.00 | 1.26 | 0.97 |
| 8-Methoxykynurenate | ME908411 | NA | 0.19 | 0.24 | 0.09 | 0.15 | 2.36 | 1.32 | 0.48 | 0.70 | 0.92 | 1.76 | 2.34 | 0.06 | 1.82 | 0.07 | NA | 0.21 | 0.18 | 0.16 | 0.16 | 2.26 | 2.26 | 0.58 | 1.27 | 0.63 | 1.04 | 2.11 | 0.07 | 1.70 | 0.08 |
| N-Glycoloyl-neuraminate | ME908393 | 0.01 | NA | NA | NA | NA | 1.73 | 1.31 | 0.15 | 0.38 | 0.89 | 1.60 | 1.43 | NA | 1.78 | NA | NA | NA | NA | 0.01 | NA | 1.68 | 1.76 | 0.22 | 0.40 | 0.28 | 0.30 | 1.35 | NA | 1.74 | NA |
| Cytosine | ME908373 | 1.12 | 0.45 | 0.62 | 0.78 | 0.62 | 0.57 | 0.70 | 0.73 | 0.48 | 0.69 | 0.77 | 0.94 | 1.15 | 0.75 | 0.85 | 1.19 | 0.61 | 1.03 | 0.60 | 0.88 | 0.58 | 1.61 | 0.33 | 0.90 | 0.85 | 0.70 | 3.57 | 1.49 | 3.65 | 0.78 |
| Ethanolamine phosphate | ME908414 | 0.92 | 0.12 | 0.19 | 0.19 | 0.23 | 0.33 | 0.33 | 0.99 | 1.11 | 1.52 | 1.67 | 1.25 | 1.46 | 2.11 | 1.42 | 0.80 | 0.20 | 0.36 | 0.24 | 0.24 | 0.68 | 0.70 | 0.55 | 1.66 | 1.44 | 1.59 | 2.01 | 1.29 | 2.97 | 1.43 |
| Guanidinoacetate | ME908397 | 0.49 | 0.08 | 0.24 | 0.22 | 0.28 | 0.55 | 0.61 | 1.21 | 1.35 | 1.01 | 1.93 | 1.20 | 0.27 | 1.99 | 0.40 | 0.45 | 0.20 | 0.49 | 0.28 | 0.32 | 0.64 | 1.57 | 1.29 | 2.14 | 1.50 | 2.02 | 2.31 | 0.23 | 4.08 | 0.67 |
| Indolepyruvate | ME908405 | 2.90 | 0.10 | 0.24 | 0.56 | 0.48 | 1.32 | 0.93 | 0.52 | 1.42 | 0.41 | 0.78 | 0.29 | 0.54 | 0.78 | 0.65 | 3.79 | 0.32 | 1.23 | 0.27 | 0.76 | 1.21 | 3.68 | 0.60 | 1.47 | 0.87 | 1.12 | 0.56 | 0.23 | 1.27 | 0.70 |
| L-valine | ME908366 | 2.57 | 0.90 | 0.33 | 0.34 | 0.37 | 0.64 | 0.69 | 0.76 | 1.18 | 0.78 | 0.93 | 0.56 | 0.78 | 1.36 | 0.65 | 2.53 | 0.33 | 0.72 | 0.42 | 0.61 | 0.94 | 1.77 | 0.83 | 1.32 | 1.11 | 1.31 | 1.25 | 0.65 | 2.58 | 0.81 |
| L-methionine | ME908359 | 3.27 | 0.08 | 0.18 | 0.31 | 0.25 | 0.77 | 1.00 | 0.72 | 1.20 | 0.72 | 1.03 | 0.54 | 0.41 | 1.56 | 0.35 | 3.49 | 0.19 | 0.67 | 0.22 | 0.45 | 1.11 | 2.31 | 0.82 | 1.51 | 1.03 | 1.11 | 1.04 | 0.17 | 3.03 | 0.45 |
| L-tyrosine | ME908365 | 2.58 | 0.12 | 0.24 | 0.37 | 0.39 | 0.83 | 0.83 | 0.63 | 1.47 | 0.62 | 1.07 | 0.43 | 0.48 | 1.04 | 0.51 | 2.74 | 0.28 | 0.89 | 0.30 | 0.61 | 1.22 | 2.83 | 0.74 | 1.74 | 1.16 | 1.39 | 1.12 | 0.24 | 2.59 | 0.54 |
| L-leucine/L-isoleucine | ME908357 | 2.67 | 0.14 | 0.27 | 0.36 | 0.43 | 1.02 | 0.96 | 0.68 | 1.48 | 0.57 | 1.14 | 0.47 | 0.45 | 1.21 | 0.43 | 2.52 | 0.32 | 1.03 | 0.33 | 0.67 | 1.18 | 3.44 | 0.77 | 1.54 | 0.90 | 1.17 | 1.03 | 0.23 | 2.14 | 0.46 |
| L-phenylalanine | ME908360 | 2.29 | 0.12 | 0.23 | 0.41 | 0.41 | 0.93 | 1.02 | 0.71 | 1.60 | 0.58 | 1.04 | 0.41 | 0.42 | 1.11 | 0.42 | 2.38 | 0.32 | 1.02 | 0.31 | 0.66 | 1.12 | 3.48 | 0.68 | 1.58 | 0.98 | 1.40 | 1.15 | 0.22 | 2.55 | 0.45 |
| L-lysine | ME908358 | 2.14 | 0.29 | 0.33 | 0.33 | 0.42 | 1.02 | 1.00 | 1.20 | 2.30 | 1.06 | 1.46 | 1.32 | 0.49 | 2.01 | 0.47 | 2.00 | 0.35 | 0.49 | 0.41 | 0.56 | 0.75 | 0.97 | 0.81 | 1.00 | 0.91 | 1.62 | 2.21 | 0.21 | 1.61 | 0.26 |
| L-serine | ME908362 | 2.84 | 0.34 | 0.22 | 0.16 | 0.30 | 0.30 | 0.28 | 0.68 | 2.24 | 0.79 | 1.22 | 1.04 | 0.63 | 1.14 | 0.45 | 2.52 | 0.52 | 0.53 | 1.03 | 0.61 | 1.15 | 0.59 | 1.87 | 1.35 | 0.76 | 2.21 | 1.83 | 0.38 | 1.63 | 0.39 |
| NAD+ | ME908382 | 1.26 | 0.14 | 0.32 | 0.35 | 0.29 | 0.89 | 0.70 | 1.26 | 1.85 | 1.10 | 1.18 | 0.94 | 0.82 | 1.53 | 0.83 | 1.47 | 0.18 | 0.51 | 0.19 | 0.31 | 1.11 | 1.16 | 1.02 | 2.29 | 1.67 | 1.63 | 1.25 | 0.64 | 2.18 | 0.91 |
| glycine | ME908355 | 1.53 | 0.48 | 0.51 | 0.46 | 0.52 | 0.51 | 0.46 | 0.61 | 0.88 | 0.76 | 1.11 | 1.33 | 0.70 | 1.23 | 0.79 | 1.40 | 0.50 | 0.59 | 0.50 | 0.49 | 1.52 | 1.11 | 0.89 | 1.48 | 1.14 | 1.61 | 2.68 | 0.64 | 2.55 | 1.03 |
| Hypotaurine | ME908400 | 3.12 | 0.11 | 0.29 | 0.17 | 0.30 | 0.32 | 0.21 | 1.09 | 1.13 | 1.46 | 1.92 | 0.95 | 0.50 | 1.52 | 0.25 | 2.66 | 0.37 | 0.46 | 0.33 | 0.25 | 1.26 | 0.98 | 0.83 | 1.88 | 1.44 | 1.75 | 1.77 | 0.25 | 2.16 | 0.27 |
| L-glutamate | ME908353 | 2.53 | 0.13 | 0.23 | 0.22 | 0.26 | 0.27 | 0.35 | 1.12 | 1.28 | 1.43 | 1.84 | 0.59 | 0.93 | 1.53 | 0.55 | 2.11 | 0.19 | 0.37 | 0.25 | 0.25 | 0.74 | 0.93 | 0.87 | 1.78 | 1.61 | 1.92 | 1.84 | 0.64 | 2.67 | 0.58 |
| L-histidine | ME908356 | 2.34 | 0.18 | 0.20 | 0.22 | 0.28 | 0.32 | 0.51 | 0.91 | 1.73 | 1.16 | 1.17 | 0.69 | 0.46 | 1.69 | 0.44 | 2.34 | 0.38 | 0.45 | 0.44 | 0.39 | 1.07 | 1.03 | 1.15 | 1.58 | 1.16 | 1.78 | 1.68 | 0.42 | 3.33 | 0.51 |
| L-proline | ME908361 | 1.92 | 0.16 | 0.24 | 0.22 | 0.26 | 0.50 | 0.55 | 1.07 | 1.40 | 0.82 | 1.23 | 0.62 | 0.57 | 1.20 | 0.48 | 1.86 | 0.26 | 0.69 | 0.44 | 0.54 | 1.32 | 1.47 | 0.88 | 2.00 | 1.50 | 1.91 | 2.05 | 0.39 | 2.79 | 0.68 |
| Creatine | ME908395 | 2.64 | 0.14 | 0.25 | 0.33 | 0.33 | 0.83 | 0.72 | 0.76 | 0.85 | 0.73 | 0.97 | 0.89 | 0.34 | 1.51 | 0.37 | 2.54 | 0.25 | 0.66 | 0.29 | 0.43 | 1.73 | 1.81 | 0.62 | 1.62 | 1.33 | 1.43 | 2.13 | 0.20 | 2.80 | 0.49 |
| L-glutamine | ME908354 | 2.40 | 0.11 | 0.14 | 0.14 | 0.16 | 0.55 | 0.44 | 0.77 | 1.02 | 1.05 | 1.50 | 1.27 | 0.51 | 1.76 | 0.42 | 2.16 | 0.18 | 0.43 | 0.28 | 0.26 | 1.35 | 1.07 | 0.75 | 1.63 | 1.22 | 1.53 | 2.62 | 0.52 | 3.07 | 0.70 |
| Pantetheine | ME908399 | 0.90 | 0.30 | 0.19 | 0.48 | 0.51 | 1.27 | 0.87 | 0.59 | 3.16 | 0.57 | 0.98 | 0.71 | 0.52 | 0.67 | 0.51 | 0.93 | 1.47 | 1.14 | 0.52 | 1.45 | 1.47 | 2.74 | 0.71 | 1.49 | 0.77 | 1.51 | 1.65 | 0.21 | 2.16 | 0.46 |
| L-Adrenaline | ME908412 | 0.61 | 0.20 | 0.32 | 0.64 | 0.58 | 2.10 | 0.84 | 0.71 | 1.25 | 0.63 | 0.90 | 0.94 | 0.64 | 1.05 | 0.50 | 0.59 | 0.41 | 1.37 | 0.38 | 0.68 | 2.26 | 3.05 | 0.72 | 1.66 | 1.07 | 1.14 | 2.25 | 0.39 | 1.52 | 0.60 |
| Pantothenol | ME908398 | 0.63 | 0.14 | 0.32 | 0.63 | 0.57 | 2.02 | 0.89 | 0.73 | 1.20 | 0.62 | 0.96 | 0.98 | 0.67 | 0.94 | 0.57 | 0.69 | 0.38 | 1.37 | 0.36 | 0.71 | 2.20 | 2.94 | 0.68 | 1.63 | 1.16 | 1.13 | 2.09 | 0.43 | 1.59 | 0.75 |
| Pyridoxal | ME908380 | 0.75 | 0.16 | 0.18 | 0.41 | 0.23 | 1.49 | 1.37 | 1.07 | 1.64 | 1.25 | 0.85 | 0.47 | 0.72 | 1.47 | 0.54 | 1.03 | 0.20 | 0.49 | 0.20 | 0.43 | 1.27 | 2.90 | 1.05 | 2.09 | 1.89 | 1.12 | 1.35 | 0.43 | 2.14 | 0.81 |
| gamma-Glutamyl-gamma-aminobutyrate | ME908387 | 1.00 | 0.06 | 0.12 | 0.26 | 0.16 | 1.66 | 1.13 | 1.00 | 1.19 | 0.66 | 1.25 | 1.00 | 0.13 | 1.47 | 0.23 | 1.02 | 0.34 | 0.51 | 0.16 | 0.40 | 1.79 | 2.40 | 1.03 | 1.84 | 1.70 | 1.67 | 1.96 | 0.05 | 2.94 | 0.25 |
| Cys-Gly | ME908385 | 1.07 | 0.11 | 0.33 | 0.60 | 0.44 | 1.32 | 1.30 | 0.95 | 1.27 | 0.89 | 1.05 | 1.24 | 0.25 | 1.58 | 0.19 | 0.98 | 0.26 | 1.10 | 0.36 | 0.67 | 1.77 | 2.16 | 0.54 | 2.22 | 1.52 | 1.43 | 1.71 | 0.13 | 2.24 | 0.31 |
| Glutathione | ME908383 | 1.26 | 0.13 | 0.34 | 0.61 | 0.48 | 1.31 | 1.26 | 0.94 | 1.24 | 0.86 | 1.08 | 1.25 | 0.29 | 1.55 | 0.21 | 1.17 | 0.29 | 1.07 | 0.38 | 0.71 | 1.78 | 2.18 | 0.56 | 2.12 | 1.44 | 1.42 | 1.62 | 0.14 | 2.00 | 0.34 |
| S-Adenosyl-L-homocysteine | ME908388 | 1.13 | 0.21 | 0.58 | 1.19 | 0.79 | 1.40 | 1.01 | 0.58 | 0.78 | 0.52 | 0.55 | 0.50 | 0.91 | 0.70 | 0.80 | 1.66 | 0.47 | 1.68 | 0.66 | 1.40 | 0.92 | 2.68 | 0.77 | 1.32 | 1.09 | 0.99 | 1.18 | 0.61 | 1.74 | 1.11 |
| Choline | ME908417 | 0.46 | 0.28 | 0.72 | 1.09 | 1.08 | 2.42 | 1.60 | 0.60 | 1.04 | 0.62 | 0.81 | 1.23 | 0.90 | 1.21 | 0.59 | 0.42 | 0.76 | 1.79 | 0.79 | 1.10 | 1.22 | 1.71 | 0.49 | 0.96 | 0.87 | 0.87 | 1.73 | 0.61 | 1.38 | 0.66 |
| dAMP | ME908369 | 1.15 | 0.14 | 0.68 | 1.22 | 1.13 | 2.27 | 1.54 | 0.85 | 1.02 | 0.60 | 1.04 | 1.10 | 0.31 | 1.03 | 0.21 | 1.19 | 0.49 | 2.12 | 0.60 | 1.42 | 1.37 | 2.73 | 0.41 | 1.22 | 0.95 | 0.91 | 0.78 | 0.15 | 0.92 | 0.44 |
| 6-Hydroxykynurenic acid | ME908406 | 0.36 | 0.24 | 0.21 | 0.77 | 0.49 | 2.11 | 1.24 | 0.91 | 0.78 | 0.57 | 0.41 | 1.67 | 0.08 | 0.99 | 0.20 | 0.44 | 0.14 | 0.69 | 1.64 | 0.70 | 1.51 | 2.23 | 1.07 | 2.40 | 1.77 | 1.76 | 2.87 | 0.06 | 0.93 | 0.34 |
| L-asparagine | ME908350 | 0.91 | 0.11 | 0.29 | 0.25 | 0.30 | 1.36 | 0.86 | 0.66 | 1.36 | 0.67 | 1.04 | 0.88 | 0.38 | 0.93 | 0.31 | 0.92 | 0.46 | 1.03 | 0.43 | 0.45 | 1.67 | 1.82 | 0.82 | 2.11 | 1.43 | 1.52 | 4.10 | 0.28 | 2.07 | 0.57 |
| Picolinic acid | ME908409 | 1.10 | 0.28 | 0.34 | 0.30 | 0.42 | 1.20 | 0.75 | 1.26 | 2.66 | 0.87 | 1.53 | 0.91 | 0.46 | 1.40 | 0.35 | 0.78 | 0.48 | 0.85 | 0.38 | 0.44 | 1.10 | 0.93 | 1.24 | 1.72 | 1.58 | 1.74 | 3.49 | 0.24 | 0.87 | 0.33 |
| 3^,5^-Cyclic AMP | ME908379 | 0.33 | 0.02 | 0.07 | 0.14 | 0.13 | 0.64 | 0.62 | 0.19 | 0.43 | 0.15 | 0.23 | 0.20 | 0.30 | 0.36 | 0.27 | 0.33 | 0.23 | 1.43 | 0.33 | 0.68 | 3.94 | 5.57 | 1.87 | 3.15 | 1.93 | 1.80 | 1.79 | 0.44 | 1.82 | 0.62 |
| AMP | ME908368 | 1.29 | 0.31 | 0.65 | 0.78 | 0.67 | 0.43 | 1.00 | 0.29 | 0.27 | 0.48 | 0.24 | 0.42 | 1.54 | 0.31 | 1.13 | 1.96 | 0.64 | 1.17 | 0.66 | 0.87 | 0.79 | 3.06 | 0.05 | 0.55 | 0.45 | 0.29 | 2.16 | 1.33 | 5.22 | 0.99 |
| GMP | ME908372 | 0.75 | 0.40 | 0.96 | 1.31 | 1.18 | 0.59 | 1.30 | 0.18 | 0.28 | 0.28 | 0.26 | 0.33 | 0.85 | 0.23 | 0.56 | 0.97 | 0.80 | 2.14 | 0.71 | 1.35 | 0.73 | 4.81 | 0.06 | 0.53 | 0.42 | 0.32 | 1.73 | 0.65 | 4.74 | 0.58 |
| acyl-C5-OH | ME908423 | 0.63 | 0.05 | 0.10 | 0.21 | 0.17 | 1.92 | 0.92 | 0.73 | 0.81 | 0.51 | 0.64 | 1.08 | 0.14 | 1.65 | 0.43 | 0.67 | 0.13 | 0.58 | 0.13 | 0.34 | 1.44 | 3.85 | 0.57 | 1.46 | 1.17 | 1.08 | 3.23 | 0.12 | 4.52 | 0.70 |
| Ectoine | ME908413 | 0.32 | 0.18 | 0.24 | 0.65 | 0.45 | 0.75 | 1.12 | 0.83 | 1.22 | 0.74 | 0.94 | 0.50 | 0.26 | 0.95 | 0.24 | 0.35 | 0.35 | 1.31 | 0.32 | 0.59 | 1.37 | 4.91 | 0.99 | 2.27 | 1.53 | 0.64 | 1.24 | 0.28 | 4.14 | 0.32 |
| IMP | ME908376 | 0.02 | 0.22 | 0.54 | 0.73 | 0.65 | 2.86 | 0.81 | 0.41 | 0.12 | 0.31 | 0.35 | 0.54 | 0.14 | 0.28 | 0.24 | 0.02 | 1.43 | 4.04 | 1.25 | 2.22 | 1.28 | 4.00 | 0.23 | 1.00 | 1.02 | 0.84 | 1.60 | 0.22 | 1.78 | 0.52 |
| Adenine | ME908371 | 0.07 | 0.33 | 0.92 | 1.71 | 1.45 | 0.96 | 1.05 | 0.15 | 0.26 | 0.14 | 0.18 | 0.28 | 0.08 | 0.11 | 0.07 | 0.08 | 1.19 | 4.26 | 1.25 | 2.67 | 0.33 | 5.24 | 0.07 | 0.23 | 0.17 | 0.15 | 1.98 | 0.06 | 4.47 | 0.10 |
| Adenosine | ME908370 | 0.05 | 0.38 | 0.85 | 1.84 | 1.35 | 0.95 | 1.22 | 0.10 | 0.21 | 0.11 | 0.09 | 0.23 | 0.06 | 0.07 | 0.05 | 0.08 | 1.10 | 4.12 | 1.18 | 2.85 | 0.29 | 5.33 | 0.02 | 0.14 | 0.14 | 0.10 | 2.07 | 0.04 | 4.87 | 0.10 |
Factors:
| F1 | Growth condition:Attached | time (h):0 | treatment:none |
| F2 | Growth condition:Attached | time (h):24 | treatment:10µM 68c091 |
| F3 | Growth condition:Attached | time (h):24 | treatment:10µM AT0174 |
| F4 | Growth condition:Attached | time (h):24 | treatment:1µM AT0174 |
| F5 | Growth condition:Attached | time (h):24 | treatment:DMSO |
| F6 | Growth condition:Attached | time (h):24 | treatment:NFkB cocktail 10 ng/ml IL1b + 10 ng/ml TNFa |
| F7 | Growth condition:Attached | time (h):24 | treatment:Vehicle |
| F8 | Growth condition:Attached | time (h):48 | treatment:10µM 68c091 |
| F9 | Growth condition:Attached | time (h):48 | treatment:10µM AT0174 |
| F10 | Growth condition:Attached | time (h):48 | treatment:1µM AT0174 |
| F11 | Growth condition:Attached | time (h):48 | treatment:DMSO |
| F12 | Growth condition:Attached | time (h):48 | treatment:NFkB cocktail 10 ng/ml IL1b + 10 ng/ml TNFa |
| F13 | Growth condition:Attached | time (h):48 | treatment:none |
| F14 | Growth condition:Attached | time (h):48 | treatment:Vehicle |
| F15 | Growth condition:Attached | time (h):72 | treatment:none |
| F16 | Growth condition:Suspension | time (h):0 | treatment:none |
| F17 | Growth condition:Suspension | time (h):24 | treatment:10µM 68c091 |
| F18 | Growth condition:Suspension | time (h):24 | treatment:10µM AT0174 |
| F19 | Growth condition:Suspension | time (h):24 | treatment:1µM AT0174 |
| F20 | Growth condition:Suspension | time (h):24 | treatment:DMSO |
| F21 | Growth condition:Suspension | time (h):24 | treatment:NFkB cocktail 10 ng/ml IL1b + 10 ng/ml TNFa |
| F22 | Growth condition:Suspension | time (h):24 | treatment:Vehicle |
| F23 | Growth condition:Suspension | time (h):48 | treatment:10µM 68c091 |
| F24 | Growth condition:Suspension | time (h):48 | treatment:10µM AT0174 |
| F25 | Growth condition:Suspension | time (h):48 | treatment:1µM AT0174 |
| F26 | Growth condition:Suspension | time (h):48 | treatment:DMSO |
| F27 | Growth condition:Suspension | time (h):48 | treatment:NFkB cocktail 10 ng/ml IL1b + 10 ng/ml TNFa |
| F28 | Growth condition:Suspension | time (h):48 | treatment:none |
| F29 | Growth condition:Suspension | time (h):48 | treatment:Vehicle |
| F30 | Growth condition:Suspension | time (h):72 | treatment:none |