Clustering data with hclust algorithm for (Study ST001940)
Reversed phase NEGATIVE ION MODE (Analysis AN003157)| Metabolite | Structure | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 |
|---|---|---|---|---|---|---|---|---|---|
| cholate | ME447175 | 0.53 | 0.15 | 0.09 | 0.49 | 1.96 | 4.82 | 6.28 | 4.24 |
| 12-dehydrocholate | ME446878 | 0.50 | 0.23 | 0.13 | 0.75 | 4.05 | 2.95 | 5.53 | 0.95 |
| spermidine | ME447647 | 0.75 | 0.46 | 0.65 | 0.49 | 2.92 | 3.19 | 3.15 | 2.53 |
| taurocholate | ME447669 | 0.04 | 0.18 | 3.19 | 0.38 | 0.23 | 2.75 | 5.17 | 0.75 |
| 13-HODE + 9-HODE | ME446879 | 0.40 | 0.81 | 0.99 | 0.85 | 4.36 | 0.40 | 9.67 | 0.51 |
| phenol sulfate | ME447572 | 0.25 | 0.33 | 1.88 | 1.24 | 0.68 | 0.17 | 8.39 | 0.11 |
| 1-stearoyl-GPS (18:0)* | ME446926 | 0.97 | 0.55 | 0.99 | 1.01 | 0.21 | 1.02 | 7.40 | 1.12 |
| 2-oleoylglycerol (18:1) | ME446965 | 1.04 | 0.60 | 0.75 | 0.87 | 0.86 | 0.33 | 8.56 | 0.73 |
| docosahexaenoate (DHA; 22:6n3) | ME447231 | 0.45 | 0.97 | 0.63 | 0.94 | 1.51 | 0.65 | 6.71 | 0.82 |
| norvaline | ME447521 | 0.44 | 1.72 | 0.43 | 0.36 | 1.05 | 0.51 | 6.19 | 0.88 |
| 1-methyladenine | ME446891 | 0.77 | 0.61 | 0.66 | 0.93 | 2.99 | 0.49 | 6.69 | 0.75 |
| 1-oleoylglycerol (18:1) | ME446901 | 0.92 | 0.53 | 0.85 | 0.92 | 2.14 | 0.36 | 7.69 | 0.74 |
| 1,2,3-benzenetriol sulfate (2) | ME446864 | 0.05 | 6.12 | 0.06 | 3.51 | 0.07 | 0.18 | 0.19 | 0.06 |
| 1-linoleoylglycerol (18:2) | ME446888 | 0.79 | 0.57 | 0.89 | 0.91 | 4.37 | 0.27 | 6.50 | 0.37 |
| 1-palmitoyl-2-oleoyl-GPE (16:0/18:1) | ME446914 | 0.86 | 0.60 | 0.79 | 0.59 | 6.74 | 1.58 | 5.11 | 1.18 |
| uridine-2^,3^-cyclic monophosphate | ME447708 | 0.56 | 0.84 | 0.98 | 0.90 | 5.28 | 0.82 | 5.15 | 0.83 |
| 1-palmitoyl-2-linoleoyl-GPC (16:0/18:2) | ME446910 | 0.76 | 0.47 | 1.71 | 0.40 | 6.44 | 0.49 | 5.55 | 0.40 |
| 1-palmitoyl-2-oleoyl-GPC (16:0/18:1) | ME446913 | 0.97 | 0.49 | 1.41 | 0.54 | 6.06 | 0.45 | 5.35 | 0.23 |
| gamma-glutamylalanine | ME447270 | 0.48 | 0.54 | 0.62 | 1.01 | 8.05 | 0.68 | 2.98 | 0.86 |
| sarcosine | ME447632 | 0.87 | 0.55 | 0.66 | 0.88 | 8.27 | 0.36 | 4.40 | 0.70 |
| 1-stearoyl-2-linoleoyl-GPC (18:0/18:2)* | ME446920 | 1.18 | 0.58 | 1.05 | 0.72 | 5.65 | 0.49 | 3.61 | 0.24 |
| arginine | ME447120 | 0.87 | 0.29 | 1.80 | 0.66 | 6.48 | 0.52 | 2.57 | 1.04 |
| linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]* | ME447392 | 0.84 | 0.44 | 1.56 | 0.57 | 9.66 | 0.73 | NA | 0.89 |
| agmatine | ME447089 | 0.62 | 0.28 | 0.28 | 1.01 | 7.89 | 0.38 | 1.03 | 1.44 |
| ornithine | ME447547 | 0.70 | 0.68 | 0.95 | 0.80 | 7.70 | 0.70 | 1.26 | 1.05 |
| linoleoyl-linoleoyl-glycerol (18:2/18:2) [2]* | ME447397 | 0.81 | 0.61 | 1.18 | 0.96 | 7.77 | 0.51 | 0.27 | 0.46 |
| 1-stearoyl-GPC (18:0) | ME446922 | 1.15 | 0.40 | 1.39 | 0.73 | 8.01 | 0.40 | 1.42 | 0.44 |
| oleoyl-linoleoyl-glycerol (18:1/18:2) [1] | ME447543 | 0.79 | 0.45 | 1.06 | 1.15 | 8.47 | 0.31 | 0.90 | 0.22 |
| indoleacetylaspartate | ME447354 | 0.18 | 0.19 | 0.12 | 1.91 | 7.01 | 0.38 | 0.11 | 0.40 |
| 1-linoleoyl-GPE (18:2)* | ME446890 | 1.24 | 0.63 | 2.40 | 0.49 | 5.66 | 0.34 | 0.56 | 0.76 |
| choline phosphate | ME447584 | 0.73 | 0.30 | 1.23 | 1.23 | 6.79 | 0.26 | 0.91 | 0.87 |
| oleoyl-oleoyl-glycerol (18:1/18:1) [1]* | ME447545 | 0.73 | 0.38 | 1.04 | 1.62 | 5.89 | 0.31 | 0.89 | 0.12 |
| linoleoyl-linoleoyl-glycerol (18:2/18:2) [1]* | ME447396 | 1.02 | 0.63 | 1.17 | 1.01 | 6.18 | 0.36 | 0.58 | 0.39 |
| oleoyl-linoleoyl-glycerol (18:1/18:2) [2] | ME447544 | 0.85 | 0.57 | 1.22 | 1.11 | 6.17 | 0.49 | 0.65 | 0.33 |
| 2,8-quinolinediol | ME446933 | 0.57 | 1.26 | 1.11 | 0.63 | 3.23 | 0.93 | 0.35 | 1.11 |
| gamma-glutamyltyrosine | ME447281 | 0.67 | 0.89 | 0.94 | 0.94 | 3.33 | 1.00 | 0.65 | 1.97 |
| imidazole lactate | ME447348 | 0.63 | 0.56 | 1.34 | 0.76 | 3.85 | 1.08 | 0.61 | 2.37 |
| guanidinoacetate | ME447319 | 0.89 | 0.25 | 1.48 | 0.93 | 4.37 | 0.19 | 0.77 | 1.97 |
| succinate | ME447659 | 1.57 | 0.57 | 1.04 | 0.75 | 4.57 | 0.27 | 0.50 | 2.62 |
| 1-linoleoyl-GPC (18:2) | ME446889 | 1.61 | 0.50 | 1.89 | 0.43 | 3.95 | 0.30 | 1.06 | 0.94 |
| maltotetraose | ME447413 | 1.03 | 0.74 | 1.99 | 0.38 | 4.07 | 0.52 | NA | 1.29 |
| nervonate (24:1n9)* | ME447497 | 0.64 | 0.85 | 0.46 | 1.69 | 2.76 | 0.21 | 1.20 | 0.05 |
| 1-oleoyl-GPC (18:1) | ME446902 | 1.16 | 0.68 | 1.04 | 0.88 | 5.62 | 0.29 | 2.24 | 0.26 |
| behenate (22:0)* | ME447127 | 0.82 | 0.85 | 0.62 | 1.20 | 5.07 | 0.28 | 1.77 | 0.19 |
| 1-oleoyl-2-linoleoyl-GPC (18:1/18:2)* | ME446900 | 1.84 | 0.61 | 1.20 | 0.56 | 4.70 | 0.47 | 2.38 | 0.25 |
| 1-stearoyl-GPE (18:0) | ME446923 | 1.33 | 0.57 | 1.05 | 0.94 | 4.52 | 0.57 | 1.44 | 0.68 |
| tryptophan betaine | ME447697 | 1.61 | 0.62 | 0.57 | 0.81 | 4.09 | 0.53 | 1.82 | 0.30 |
| 1-oleoyl-GPE (18:1) | ME446903 | 1.40 | 0.62 | 0.98 | 1.01 | 3.48 | 0.68 | 1.36 | 0.63 |
| argininosuccinate | ME447121 | 1.31 | 0.43 | 1.11 | 0.62 | 3.17 | 0.41 | 1.44 | 0.34 |
| 1-(1-enyl-oleoyl)-GPE (P-18:1)* | ME446860 | 1.30 | 0.80 | 0.88 | 0.95 | 3.43 | 0.64 | 0.79 | 0.95 |
| 1-(1-enyl-stearoyl)-GPE (P-18:0)* | ME446862 | 1.21 | 0.52 | 1.17 | 0.88 | 3.82 | 0.81 | 1.22 | 1.39 |
| N-acetylmethionine sulfoxide | ME447473 | 0.90 | 0.81 | 0.76 | 1.06 | 3.49 | 0.78 | 1.59 | 1.09 |
| gamma-glutamylglutamate | ME447273 | 1.09 | 0.75 | 0.84 | 0.91 | 3.59 | 1.27 | 2.91 | 1.29 |
| cytidine 2^,3^-cyclic monophosphate | ME447196 | 0.96 | 0.76 | 0.99 | 0.81 | 3.93 | 0.91 | 2.35 | 1.05 |
| histidine | ME447337 | 0.69 | 0.79 | 1.26 | 0.73 | 3.75 | 1.19 | 1.96 | 1.26 |
| glycerol | ME447297 | 0.90 | 0.68 | 1.15 | 0.87 | 4.28 | 0.36 | 3.29 | 0.67 |
| 1-stearoyl-2-oleoyl-GPC (18:0/18:1) | ME446921 | 1.08 | 0.79 | 0.92 | 0.89 | 4.07 | 0.69 | 2.46 | 0.33 |
| palmitoyl sphingomyelin (d18:1/16:0) | ME447559 | 0.69 | 0.67 | 0.97 | 1.28 | 3.99 | 0.52 | 2.28 | 0.43 |
| phenylacetylglycine | ME447576 | 0.32 | NA | 1.12 | 0.71 | 4.77 | NA | NA | 0.39 |
| oleoyl-oleoyl-glycerol (18:1/18:1) [2]* | ME447546 | 0.84 | 0.50 | 1.13 | 1.42 | 4.65 | 0.50 | 0.77 | 0.21 |
| 4-hydroxycinnamate | ME447030 | 0.39 | 0.73 | 0.92 | 1.77 | 4.05 | 0.44 | 1.47 | 0.53 |
| palmitoleoyl-linoleoyl-glycerol (16:1/18:2) [1]* | ME447556 | 0.47 | 0.61 | 0.59 | 2.07 | 4.01 | 0.42 | 0.64 | 0.87 |
| pyridoxine (Vitamin B6) | ME447612 | 1.21 | 0.84 | 0.61 | 0.88 | 4.12 | 1.27 | 0.19 | 0.66 |
| theanine | ME447675 | 0.91 | 0.83 | 0.56 | 0.90 | 4.84 | 1.43 | 0.98 | 0.41 |
| lactosyl-N-nervonoyl-sphingosine (d18:1/24:1)* | ME447372 | 0.48 | 1.18 | 0.63 | 0.87 | 4.56 | 0.96 | 0.54 | 0.80 |
| lactosyl-N-palmitoyl-sphingosine (d18:1/16:0) | ME447373 | 0.48 | 1.00 | 0.69 | 0.85 | 5.34 | 1.13 | 0.90 | 1.08 |
| 5-aminovalerate | ME447061 | 0.96 | 0.46 | 0.68 | 0.75 | 4.81 | 1.92 | 0.42 | 2.88 |
| betaine | ME447137 | 0.35 | 0.43 | 2.58 | 0.45 | 4.07 | 0.34 | 0.64 | 3.05 |
| creatine | ME447187 | 0.29 | 0.08 | 2.51 | 0.57 | 4.19 | 0.71 | 2.06 | 3.27 |
| 2,3-dihydroxy-2-methylbutyrate | ME446928 | 0.87 | 0.51 | 0.84 | 0.24 | 0.09 | 1.56 | 2.01 | 4.67 |
| palmitoleate (16:1n7) | ME447554 | 0.52 | 0.82 | 0.57 | 0.91 | 0.34 | 1.16 | 3.05 | 3.64 |
| phenyllactate (PLA) | ME447580 | 0.57 | 0.63 | 0.59 | 0.62 | 0.71 | 1.49 | 4.57 | 3.84 |
| allantoin | ME447092 | 0.14 | 0.42 | 2.78 | 0.32 | 1.07 | 0.41 | 0.85 | 3.71 |
| galactonate | ME447267 | 0.28 | 0.19 | 2.85 | 0.28 | 0.33 | 1.12 | 0.08 | 5.78 |
| ribonate | ME447623 | 0.41 | 0.22 | 2.71 | 0.37 | 0.33 | 0.65 | 0.61 | 5.44 |
| phenethylamine | ME447571 | 0.42 | 1.11 | 0.33 | 0.42 | 0.26 | 1.56 | 0.24 | 6.47 |
| apigenin | ME447111 | 0.86 | 0.17 | 0.16 | 0.24 | 1.02 | 0.58 | 0.29 | 5.81 |
| 1,2-dilinolenoyl-digalactosylglycerol (18:3/18:3) | ME446865 | 1.08 | 0.21 | 0.14 | 0.92 | 0.20 | 0.05 | 0.39 | 5.35 |
| 1,2-dilinolenoyl-galactosylglycerol (18:3/18:3)* | ME446866 | 0.77 | 0.11 | 0.10 | 0.97 | 0.20 | 0.05 | 0.15 | 6.45 |
| hesperetin | ME447327 | 0.64 | 0.10 | 1.08 | 0.15 | 0.23 | 0.63 | 0.09 | 4.89 |
| N-acetylglucosamine 6-sulfate | ME447462 | 0.29 | 0.31 | 1.11 | 1.29 | NA | 0.18 | NA | 5.57 |
| chrysoeriol | ME447179 | 0.13 | 0.07 | NA | 0.42 | 1.42 | NA | 0.14 | 4.56 |
| 1-linoleoyl-2-linolenoyl-galactosylglycerol (18:2/18:3)* | ME446887 | 0.80 | 0.43 | 1.03 | 0.35 | 1.70 | 0.34 | 0.48 | 5.00 |
| naringenin | ME447488 | 0.65 | 0.33 | 1.51 | 0.24 | 1.80 | 0.84 | 0.50 | 5.84 |
| glycocholenate sulfate* | ME447308 | 0.51 | 0.07 | 4.03 | 0.09 | 0.26 | 1.14 | 0.01 | 0.80 |
| acetylcarnitine (C2) | ME447083 | 0.13 | 0.08 | 4.20 | 0.17 | 0.38 | 0.90 | 0.09 | 2.11 |
| arabonate/xylonate | ME447114 | 0.24 | 0.13 | 4.83 | 0.15 | 0.80 | 0.28 | 0.30 | 2.21 |
| laurylcarnitine (C12) | ME447377 | 0.47 | 0.16 | 3.47 | 0.19 | 0.43 | 0.76 | 0.72 | 2.62 |
| pyroglutamine* | ME447613 | 0.59 | 0.28 | 3.77 | 0.33 | 0.42 | 0.30 | 0.71 | 2.45 |
| 5-(2-Hydroxyethyl)-4-methylthiazole | ME447042 | 0.71 | 1.02 | 3.41 | 0.52 | 0.30 | 0.24 | 0.38 | 1.83 |
| gluconate | ME447287 | 0.75 | 0.35 | 3.86 | 0.39 | 0.38 | 0.68 | 0.17 | 1.20 |
| sucrose | ME447663 | 0.46 | 0.44 | 3.85 | 0.47 | 0.20 | 0.47 | 0.14 | 1.74 |
| hesperidin | ME447328 | 0.28 | NA | 1.96 | 0.03 | NA | NA | NA | 1.74 |
| 2,8-quinolinediol sulfate | ME446934 | NA | NA | 2.51 | NA | 0.80 | 0.47 | NA | 0.22 |
| oleoyl-linolenoyl-glycerol (18:1/18:3) [2]* | ME447542 | 0.87 | 0.61 | 2.45 | 1.04 | 0.03 | 0.05 | 0.03 | 0.82 |
| linoleoyl-linolenoyl-glycerol (18:2/18:3) [1]* | ME447394 | 0.82 | 0.61 | 2.68 | 1.06 | 0.60 | 0.11 | 0.05 | 0.28 |
| linoleoyl-linolenoyl-glycerol (18:2/18:3) [2]* | ME447395 | 0.74 | 0.73 | 2.78 | 0.90 | 0.38 | 0.18 | 0.02 | 0.46 |
| palmitoyl-linolenoyl-glycerol (16:0/18:3) [2]* | ME447562 | 0.63 | 0.61 | 2.74 | 0.86 | 0.26 | 0.24 | 0.06 | 0.41 |
| linolenoyl-linolenoyl-glycerol (18:3/18:3) [1]* | ME447389 | 1.02 | 0.47 | 3.42 | 0.48 | 0.02 | 0.02 | 0.01 | 0.09 |
| thiamin (Vitamin B1) | ME447678 | 1.20 | 0.88 | 2.92 | 0.44 | 0.06 | 0.15 | 0.07 | 0.52 |
| dopamine 3-O-sulfate | ME447235 | NA | 0.35 | 3.69 | 0.72 | NA | NA | NA | 0.17 |
| 3-(N-acetyl-L-cystein-S-yl) acetaminophen | ME446978 | 0.63 | 0.13 | 3.00 | 0.86 | NA | 0.11 | NA | NA |
| 4-acetaminophen sulfate | ME447023 | 0.11 | 0.02 | 3.16 | 0.51 | NA | NA | NA | NA |
| loperamide | ME447401 | NA | 0.09 | 2.36 | NA | 0.01 | NA | 0.19 | NA |
| ranitidine | ME447619 | 0.21 | 0.64 | 2.99 | 0.12 | NA | 0.00 | NA | 0.01 |
| 2-hydroxyibuprofen | ME446955 | 0.67 | 1.52 | 2.88 | 0.29 | 1.32 | NA | 0.47 | 0.37 |
| tauroursodeoxycholate | ME447673 | 0.81 | 0.51 | 2.91 | 0.25 | 1.09 | 1.73 | 1.13 | 1.08 |
| glucuronate | ME447289 | 0.55 | 0.37 | 3.65 | 0.73 | 1.05 | 0.62 | 0.32 | 0.87 |
| gamma-glutamylisoleucine* | ME447277 | 0.35 | 0.39 | 3.33 | 0.53 | 1.28 | 0.38 | 0.55 | 1.57 |
| taurocholenate sulfate | ME447670 | 0.55 | 0.28 | 2.80 | 0.33 | 1.17 | 0.81 | 0.17 | 1.25 |
| 2-oxoarginine* | ME446969 | 0.40 | 0.65 | 3.25 | 0.54 | 1.25 | 0.61 | 1.12 | 0.35 |
| taurochenodeoxycholate | ME447668 | 0.08 | 0.18 | 2.89 | 0.36 | 1.69 | 0.86 | 0.99 | 1.00 |
| 4-acetamidophenol | ME447021 | 1.30 | 0.32 | 5.71 | 0.74 | 0.02 | 0.25 | NA | 0.14 |
| mannitol/sorbitol | ME447415 | 0.05 | 0.06 | 6.49 | 0.04 | 0.05 | 0.07 | 0.05 | 0.09 |
| glycochenodeoxycholate | ME447306 | 0.04 | 0.08 | 5.80 | 0.18 | 0.58 | 0.13 | 0.14 | 0.14 |
| ferulic acid 4-sulfate | ME447256 | NA | 0.26 | 5.49 | 0.04 | 0.06 | 0.08 | NA | 0.06 |
| glycocholate | ME447307 | 0.02 | 0.05 | 5.72 | 0.10 | 0.01 | 0.05 | 0.01 | 0.05 |
| linolenoyl-linolenoyl-glycerol (18:3/18:3) [2]* | ME447390 | 0.82 | 0.44 | 4.20 | 0.33 | 0.01 | 0.02 | 0.01 | 0.14 |
| glycodeoxycholate | ME447309 | 0.12 | 0.16 | 5.18 | 0.35 | 0.63 | 0.20 | 0.15 | 0.13 |
| glycoursodeoxycholate | ME447314 | 0.05 | 0.24 | 4.85 | 0.27 | 0.23 | 0.25 | 0.11 | 0.18 |
| citrate | ME447184 | 0.36 | 0.17 | 4.45 | 0.27 | 0.08 | 0.51 | 0.08 | 0.31 |
| glycolithocholate sulfate* | ME447310 | 0.45 | 0.15 | 5.08 | 0.12 | 0.05 | 0.25 | 0.05 | 0.31 |
| taurolithocholate 3-sulfate | ME447672 | 0.64 | 0.22 | 4.79 | 0.27 | 0.16 | 0.05 | NA | 0.19 |
| threonate | ME447680 | 0.28 | 0.21 | 4.96 | 0.16 | 0.43 | 0.19 | 0.42 | 1.23 |
| cystine | ME447194 | 0.35 | 0.20 | 5.01 | 0.28 | 0.43 | 0.36 | 1.09 | 0.38 |
| tartarate | ME447666 | 0.71 | 0.32 | 5.42 | 0.48 | 0.22 | 0.56 | 0.44 | 0.70 |
| 4-methylthio-2-oxobutanoate | ME447039 | 0.53 | 0.80 | 4.05 | 1.38 | 0.24 | 0.25 | 1.58 | 0.74 |
| urate | ME447706 | 0.25 | 0.24 | 4.71 | 0.40 | 0.67 | 0.21 | 2.08 | 0.14 |
| N-acetyl-aspartyl-glutamate (NAAG) | ME447457 | 2.12 | 0.14 | 0.12 | 0.13 | NA | 4.68 | 0.09 | 0.31 |
| 7-ketolithocholate | ME447075 | 1.75 | 0.32 | 1.09 | 0.41 | 1.31 | 4.62 | 1.24 | 0.84 |
| isoursodeoxycholate | ME447363 | 0.92 | 0.79 | 0.26 | 0.67 | 1.47 | 4.30 | 2.15 | 1.20 |
| ursodeoxycholate | ME447710 | 0.85 | 0.60 | 0.21 | 0.56 | 1.07 | 4.08 | 2.07 | 2.09 |
| (15:0)-anacardic acid | ME446857 | NA | 0.71 | 1.27 | 0.46 | NA | 2.51 | NA | 0.88 |
| 3-hydroxyoctanoate | ME446998 | 0.53 | 0.54 | 0.44 | 0.46 | 0.41 | 4.12 | 0.76 | 1.17 |
| feruloylputrescine | ME447257 | 0.52 | 0.91 | 0.60 | 0.49 | 1.07 | 4.37 | 0.72 | 1.13 |
| adipate (C6-DC) | ME447088 | 0.65 | 0.98 | 0.47 | 1.20 | 0.03 | 3.37 | 0.34 | 0.61 |
| I-urobilinogen | ME447366 | 0.74 | 0.96 | 0.83 | 0.65 | 0.72 | 3.51 | 0.17 | 1.02 |
| syringic acid | ME447665 | 0.59 | 1.13 | 0.47 | 0.40 | 0.85 | 2.80 | 0.51 | 2.22 |
| 5alpha-androstan-3alpha,17beta-diol monosulfate (1) | ME447048 | 0.60 | 0.64 | 0.46 | 1.03 | 0.37 | 2.69 | 0.39 | 1.53 |
| N-acetyltaurine | ME447482 | 0.98 | 0.88 | 0.71 | 0.88 | 0.09 | 3.24 | 0.93 | 2.01 |
| liquiritigenin | ME447398 | 0.13 | 0.53 | 1.20 | 0.64 | 0.96 | 3.44 | 0.04 | 2.25 |
| succinylcarnitine (C4-DC) | ME447661 | 0.48 | 0.55 | 0.41 | 1.12 | 0.50 | 4.15 | 0.12 | 2.07 |
| piperine | ME447593 | 0.24 | 0.96 | 0.15 | 0.81 | 0.14 | 5.68 | 0.90 | 0.63 |
| carnosine | ME447161 | 0.41 | 0.40 | 0.17 | 0.37 | NA | 4.79 | 1.24 | 3.32 |
| 2-piperidinone | ME446971 | 1.20 | 0.66 | 0.68 | 0.58 | 0.26 | 5.34 | 0.12 | 1.95 |
| 7-ketodeoxycholate | ME447074 | 1.18 | 0.19 | 0.29 | 0.23 | 0.66 | 6.37 | 0.60 | 2.56 |
| acesulfame | ME447082 | 0.21 | 1.91 | 0.14 | 1.42 | 0.15 | 0.06 | 1.48 | 0.07 |
| N-palmitoyltaurine | ME447526 | 0.39 | 1.47 | 0.14 | 1.54 | NA | 0.59 | 2.91 | 0.35 |
| N-stearoyltaurine | ME447531 | 0.43 | 1.68 | 0.27 | 0.98 | NA | 0.48 | 2.50 | NA |
| N-methylhydantoin | ME447512 | 1.23 | 0.71 | 0.45 | 0.83 | 1.33 | 0.24 | 4.49 | 0.88 |
| arachidate (20:0) | ME447115 | 0.87 | 0.93 | 0.95 | 1.11 | 0.94 | 0.27 | 4.70 | 0.20 |
| eicosenoate (20:1) | ME447240 | 0.65 | 0.94 | 1.01 | 0.99 | 1.18 | 0.78 | 4.79 | 0.42 |
| valerylphenylalanine | ME447715 | 0.53 | 0.43 | 0.50 | 0.88 | 0.29 | NA | 4.97 | NA |
| 3-hydroxyvalerate | ME447005 | 0.78 | 0.68 | NA | 0.54 | NA | 0.45 | 4.01 | 0.40 |
| glycosyl-N-stearoyl-sphingosine (d18:1/18:0) | ME447313 | 0.95 | 1.46 | 0.69 | 0.92 | 0.16 | 0.48 | 4.60 | 0.24 |
| N-acetylputrescine | ME447478 | 0.68 | 1.09 | 0.65 | 0.52 | 0.27 | 1.90 | 4.06 | 2.42 |
| heptanoate (7:0) | ME447326 | 1.09 | 0.96 | 0.71 | 1.04 | 0.10 | 0.31 | 3.36 | 2.31 |
| N-(2-hydroxypalmitoyl)-sphingosine (d18:1/16:0(2OH)) | ME447440 | 0.69 | 0.84 | 0.60 | 1.01 | 0.61 | 1.55 | 3.43 | 1.76 |
| 1-palmitoyl-GPI (16:0) | ME446918 | 1.59 | 0.64 | 1.02 | 0.66 | 0.12 | 1.21 | 3.19 | 1.69 |
| N-propionylmethionine | ME447528 | 1.34 | 0.95 | 0.89 | 0.65 | 0.67 | 0.92 | 3.21 | 2.00 |
| methionine sulfone | ME447421 | 0.46 | 1.67 | 0.52 | 0.34 | 0.34 | 0.62 | 3.55 | 1.06 |
| alpha-hydroxyisovalerate | ME447096 | 0.28 | 2.16 | 0.35 | 0.38 | 0.72 | 0.31 | 2.82 | 1.87 |
| N-acetylleucine | ME447471 | 0.58 | 1.81 | 0.54 | 0.54 | 1.53 | 0.41 | 2.97 | 0.84 |
| N-acetylisoleucine | ME447470 | 0.65 | 1.78 | 0.53 | 0.60 | 0.98 | 0.42 | 2.38 | 1.42 |
| N-acetylvaline | ME447486 | 0.95 | 1.71 | 0.64 | 0.56 | 0.64 | 0.72 | 2.27 | 0.99 |
| oleanolate | ME447537 | 0.63 | 0.64 | 1.59 | 1.39 | 0.05 | 0.25 | 3.37 | 0.06 |
| N-stearoyl-sphingosine (d18:1/18:0)* | ME447530 | 0.73 | 1.08 | 0.53 | 1.07 | 0.33 | 1.21 | 2.78 | 1.37 |
| ceramide (d18:1/20:0, d16:1/22:0, d20:1/18:0)* | ME447169 | 0.90 | 0.92 | 0.67 | 1.11 | 0.47 | 0.89 | 3.20 | 1.12 |
| hexadecadienoate (16:2n6) | ME447329 | 0.59 | 1.26 | 0.63 | 1.09 | 0.37 | 0.72 | 2.86 | 1.01 |
| 1-palmitoyl-GPG (16:0)* | ME446917 | 0.91 | 0.73 | 1.57 | 0.97 | 0.36 | 0.68 | 2.72 | 0.85 |
| margarate (17:0) | ME447417 | 0.86 | 0.88 | 1.25 | 1.17 | 0.34 | 0.35 | 3.06 | 0.49 |
| linoleate (18:2n6) | ME447386 | 0.82 | 1.01 | 1.01 | 1.07 | 0.58 | 0.56 | 2.91 | 0.74 |
| nonadecanoate (19:0) | ME447520 | 0.72 | 1.07 | 1.03 | 1.17 | 0.39 | 0.44 | 2.82 | 0.51 |
| arachidonate (20:4n6) | ME447116 | 0.55 | 0.98 | 0.99 | 0.99 | 1.02 | 1.40 | 3.44 | 0.66 |
| 10-heptadecenoate (17:1n7) | ME446874 | 0.47 | 0.81 | 0.83 | 1.38 | 0.36 | 0.99 | 3.89 | 0.76 |
| docosapentaenoate (n3 DPA; 22:5n3) | ME447232 | 0.44 | 0.85 | 0.42 | 1.50 | 0.35 | 1.28 | 3.50 | 0.98 |
| 3-methyl-2-oxobutyrate | ME447008 | 0.82 | 0.64 | 1.36 | 1.58 | 1.22 | 0.42 | 3.83 | 0.39 |
| 17-methylstearate (i19:0) | ME446883 | 0.82 | 0.85 | 0.94 | 1.27 | 0.33 | 0.36 | 3.60 | 0.73 |
| 8-hydroxyguanine | ME447079 | 1.16 | 0.63 | 0.61 | 1.22 | 0.68 | 0.87 | 3.77 | 0.78 |
| trans-nonadecenoate (tr 19:1)* | ME447687 | 1.27 | 0.75 | 0.71 | 1.09 | 0.85 | 0.43 | 4.02 | 0.61 |
| putrescine | ME447608 | 1.30 | 0.96 | 1.08 | 0.19 | 0.44 | 0.86 | 5.15 | 2.05 |
| hyocholate | ME447345 | 0.96 | 0.74 | 0.72 | 0.98 | 1.19 | 1.59 | 4.71 | 1.29 |
| O-sulfo-L-tyrosine | ME447550 | 0.94 | 0.97 | 1.06 | 0.33 | 1.54 | 2.14 | 5.04 | 1.45 |
| valylglutamine | ME447719 | 0.71 | 0.81 | 0.69 | 0.97 | 1.47 | 2.99 | 2.28 | 0.58 |
| indolepropionate | ME447356 | 0.72 | 0.82 | 0.87 | 0.84 | 2.55 | 2.03 | 3.16 | 0.85 |
| phenylalanylalanine | ME447578 | 1.11 | 0.76 | 0.61 | 0.84 | 1.69 | 2.20 | 3.08 | 0.80 |
| N-methyl-GABA | ME447510 | 0.72 | 0.52 | 0.72 | 0.78 | 0.73 | 3.68 | 4.26 | 1.03 |
| dihomo-linoleate (20:2n6) | ME447216 | 0.39 | 0.99 | 0.62 | 1.04 | 0.70 | 2.34 | 4.40 | 0.47 |
| 3-dehydrocholate | ME446988 | 1.31 | 0.45 | 0.24 | 0.41 | 0.50 | 2.40 | 2.89 | 0.94 |
| anserine | ME447109 | 1.35 | 0.96 | 0.29 | 0.79 | 0.38 | 2.17 | 3.55 | 0.67 |
| 2-palmitoylglycerol (16:0) | ME446970 | 0.67 | 0.94 | 0.66 | 0.78 | 0.32 | 2.47 | 3.01 | 0.67 |
| 3-methylhistidine | ME447013 | 0.78 | 0.81 | 0.13 | 1.23 | 0.35 | 2.56 | 3.35 | 0.64 |
| glycyrrhetinate | ME447318 | 0.32 | 0.08 | NA | NA | 2.35 | NA | 3.55 | NA |
| 2-hydroxydecanoate | ME446952 | 0.56 | 1.05 | 0.75 | 0.76 | 2.86 | 1.34 | 3.36 | 1.04 |
| N6-formyllysine | ME447449 | 0.59 | 0.82 | 1.00 | 0.75 | 3.32 | 1.25 | 4.00 | 1.05 |
| ceramide (d18:2/24:1, d18:1/24:2)* | ME447170 | 0.92 | 0.78 | 0.62 | 0.98 | 1.99 | 0.75 | 4.05 | 1.15 |
| 2-linoleoylglycerol (18:2) | ME446961 | 0.69 | 0.96 | 1.01 | 0.99 | 2.10 | 0.32 | 3.97 | 0.51 |
| N-acetylphenylalanine | ME447476 | 0.99 | 1.07 | 0.82 | 0.72 | 2.59 | 0.40 | 3.64 | 0.93 |
| dehydrolithocholate | ME447201 | 0.94 | 0.60 | 0.67 | 1.29 | 3.16 | 0.79 | 5.02 | 0.98 |
| 1,2-dilinoleoyl-digalactosylglycerol (18:2/18:2)* | ME446867 | 0.76 | 0.68 | 1.00 | 0.58 | 3.88 | 0.55 | 4.49 | 1.72 |
| gamma-glutamylhistidine | ME447276 | 0.65 | 0.99 | 1.17 | 0.48 | 3.87 | 0.66 | 4.43 | 1.29 |
| creatinine | ME447188 | 1.71 | 0.20 | 1.04 | 0.90 | 1.75 | 0.29 | 4.11 | 1.94 |
| 1-palmitoyl-2-linoleoyl-GPE (16:0/18:2) | ME446911 | 1.51 | 0.52 | 0.89 | 0.67 | 1.76 | 1.51 | 2.78 | 2.05 |
| 1-linoleoyl-2-linolenoyl-digalactosylglycerol (18:2/18:3)* | ME446886 | 0.87 | 0.62 | 1.15 | 0.55 | 2.47 | 0.48 | 3.29 | 2.73 |
| 1-palmitoyl-2-linoleoyl-digalactosylglycerol (16:0/18:2)* | ME446908 | 0.78 | 0.85 | 0.87 | 0.87 | 2.37 | 0.62 | 2.47 | 2.08 |
| gamma-glutamylphenylalanine | ME447280 | 0.53 | 0.85 | 0.91 | 0.91 | 2.72 | 0.64 | 3.08 | 2.20 |
| S-carboxymethyl-L-cysteine | ME447633 | 0.47 | 0.53 | 1.34 | 0.47 | 1.95 | 1.10 | 4.00 | 3.46 |
| argininate* | ME447119 | 0.62 | 0.68 | 0.81 | 0.66 | 3.10 | 1.05 | 4.37 | 2.50 |
| salicylate | ME447630 | 1.22 | 0.64 | 0.63 | 0.60 | 2.34 | 1.27 | 4.26 | 2.17 |
| alpha-hydroxyisocaproate | ME447095 | 0.09 | 3.34 | 0.10 | 0.23 | 0.67 | 0.08 | 0.80 | 2.46 |
| chiro-inositol | ME447174 | 0.46 | 2.17 | 0.92 | 0.17 | 0.79 | 0.19 | 0.10 | 2.30 |
| fucitol | ME447262 | 0.78 | 3.96 | 1.72 | 0.57 | 0.80 | 0.48 | 0.41 | 1.22 |
| 2-hydroxy-3-methylvalerate | ME446948 | 0.24 | 2.98 | 0.18 | 0.38 | 0.51 | 0.19 | 1.71 | 1.35 |
| 3-(3-hydroxyphenyl)propionate sulfate | ME446974 | 0.47 | 3.17 | 0.43 | 0.57 | NA | 0.32 | 1.18 | 0.18 |
| eicosapentaenoate (EPA; 20:5n3) | ME447239 | 0.20 | 2.69 | 0.33 | 0.29 | 0.21 | 0.45 | 1.61 | 0.41 |
| N(1)-acetylspermine | ME447438 | 0.78 | 4.27 | 0.41 | 1.74 | NA | 0.28 | 0.61 | 0.31 |
| 4-acetamidobenzoate | ME447019 | 0.38 | 3.39 | 0.28 | 0.29 | 0.24 | 0.17 | 0.11 | 0.27 |
| secoisolariciresinol | ME447635 | 0.08 | 3.26 | 0.55 | 1.23 | NA | 0.11 | NA | 0.55 |
| alpha-tocopherol acetate | ME447100 | 3.36 | 0.01 | 2.25 | 0.05 | NA | 0.03 | 0.00 | 0.00 |
| 2^-deoxyadenosine | ME446942 | 2.91 | 0.58 | 0.75 | 0.46 | 1.04 | 1.29 | 1.06 | 0.83 |
| 5-hydroxylysine | ME447065 | 4.37 | 0.44 | 0.44 | 0.79 | 0.41 | 0.58 | 1.07 | 1.03 |
| 6-hydroxynicotinate | ME447070 | 3.50 | 0.31 | 0.45 | 0.63 | 0.32 | 0.86 | 0.41 | 0.91 |
| butyrylglycine | ME447148 | 3.09 | 0.44 | NA | 1.10 | 1.00 | NA | NA | 1.16 |
| 3-indoxyl sulfate | ME447006 | 2.62 | NA | 0.42 | 1.15 | NA | 0.10 | 0.05 | 0.03 |
| N-(2-furoyl)glycine | ME447439 | 3.68 | 0.08 | 0.13 | 1.07 | 0.07 | 0.06 | 0.06 | 0.06 |
| androstenediol (3beta,17beta) monosulfate (2) | ME447107 | 3.17 | 1.28 | 0.29 | 0.53 | NA | NA | NA | 0.08 |
| 1-methyl-beta-carboline-3-carboxylic acid | ME446893 | 2.38 | 0.96 | 0.49 | 1.42 | 0.05 | 0.04 | 0.09 | 0.05 |
| androstenediol (3alpha, 17alpha) monosulfate (2) | ME447103 | 2.20 | 1.38 | 0.52 | 1.03 | NA | 0.26 | 0.12 | 0.22 |
| 1,2-dilinoleoyl-galactosylglycerol (18:2/18:2)* | ME446868 | 0.78 | 0.71 | 1.14 | 0.56 | 2.17 | 0.59 | 1.11 | 3.43 |
| 2-hydroxybutyrate/2-hydroxyisobutyrate | ME446951 | 0.79 | 0.67 | 0.89 | 0.68 | 1.84 | 1.13 | 1.92 | 3.63 |
| 4-ethylphenylsulfate | ME447025 | NA | 0.88 | NA | 0.41 | 0.58 | 1.12 | NA | 2.00 |
| glycitein | ME447305 | 0.12 | 0.52 | NA | NA | 0.80 | 1.00 | NA | 1.87 |
| dexlansoprazole | ME447207 | NA | 0.08 | NA | 0.34 | NA | 2.21 | NA | 2.28 |
| metoprolol acid metabolite* | ME447428 | 0.53 | 0.24 | 0.50 | 0.32 | NA | 2.26 | NA | 2.15 |
| 1-(1-enyl-palmitoyl)-GPE (P-16:0)* | ME446861 | 1.33 | 0.47 | 1.22 | 0.69 | 1.69 | 1.52 | 0.45 | 2.85 |
| genistein | ME447284 | 0.97 | 0.21 | 1.33 | 0.47 | 1.00 | 1.50 | 0.24 | 3.38 |
| tyramine | ME447699 | 1.23 | 1.10 | 0.79 | 0.52 | 0.91 | 1.38 | 0.12 | 2.69 |
| 21-hydroxypregnenolone disulfate | ME446936 | 0.69 | 0.57 | 0.60 | 0.68 | 0.81 | 1.88 | NA | 3.18 |
| androstenediol (3beta,17beta) disulfate (1) | ME447104 | 1.05 | 0.71 | 0.52 | 0.73 | 0.40 | 2.09 | 0.39 | 2.67 |
| stachydrine | ME447651 | 0.70 | 1.01 | 0.53 | 0.68 | 0.33 | 1.19 | 0.90 | 4.52 |
| 1-palmitoyl-GPS (16:0)* | ME446919 | 1.05 | 0.37 | 0.44 | 1.01 | NA | 1.32 | 0.63 | 3.78 |
| 3-(4-hydroxyphenyl)lactate | ME446975 | 1.16 | 0.62 | 0.77 | 0.87 | 0.38 | 0.79 | 0.85 | 3.99 |
| xylose | ME447728 | 0.98 | 0.80 | 1.15 | 0.77 | 0.58 | 0.85 | 0.55 | 3.82 |
| gamma-glutamylglycine | ME447275 | 1.29 | 0.25 | 1.19 | 0.74 | 0.59 | NA | 0.28 | 3.38 |
| 1-palmitoyl-2-linoleoyl-galactosylglycerol (16:0/18:2)* | ME446909 | 0.79 | 0.85 | 0.71 | 1.00 | 0.71 | 0.76 | 0.90 | 2.91 |
| dihydroferulic acid | ME447221 | 0.83 | 0.87 | 0.78 | 1.03 | 0.53 | 0.71 | 0.64 | 3.06 |
| furaneol sulfate | ME447265 | 0.45 | 1.01 | 0.88 | 0.97 | 0.27 | 1.11 | NA | 2.82 |
| thioproline | ME447679 | 0.63 | 1.06 | 0.54 | 1.11 | 0.91 | 0.61 | NA | 2.77 |
| 2-aminophenol sulfate | ME446941 | 1.07 | 0.51 | 0.86 | 1.29 | NA | 0.85 | 0.14 | 2.94 |
| 11-ketoetiocholanolone sulfate | ME446876 | 1.17 | 0.51 | 1.67 | 0.69 | 0.29 | 1.07 | 0.32 | 3.08 |
| 2-keto-3-deoxy-gluconate | ME446960 | 1.13 | 0.60 | 1.41 | 0.82 | 0.40 | 1.11 | 0.60 | 2.65 |
| daidzein | ME447198 | 0.67 | 0.52 | 0.92 | 0.68 | 1.04 | 2.98 | 0.20 | 4.25 |
| 2-(4-hydroxyphenyl)propionate | ME446927 | 0.31 | 1.25 | 0.24 | 0.36 | NA | 2.09 | NA | 3.48 |
| tryptamine | ME447695 | 1.35 | 0.80 | 0.27 | 0.46 | NA | 1.71 | NA | 3.59 |
| vanillactate | ME447722 | 0.91 | 0.72 | 0.60 | 0.56 | NA | 2.07 | NA | 4.13 |
| 1,2-dipalmitoyl-GPC (16:0/16:0) | ME446870 | 0.75 | 0.47 | 2.67 | 0.51 | 2.69 | 0.87 | 1.72 | 0.56 |
| cadaverine | ME447149 | 3.26 | 0.27 | 1.89 | 0.19 | 0.50 | 0.32 | 2.04 | 0.47 |
| 3-(4-hydroxyphenyl)propionate | ME446976 | 2.33 | 0.39 | 1.39 | 0.56 | 2.40 | 0.48 | 1.94 | 0.64 |
| N1,N12-diacetylspermine | ME447441 | 1.88 | 0.45 | 1.44 | 0.77 | 1.37 | 0.64 | 2.01 | 0.97 |
| eriodictyol | ME447246 | 0.94 | 0.42 | NA | NA | 0.33 | 2.37 | NA | NA |
| oleoylcholine | ME447541 | 1.82 | NA | NA | 0.60 | 0.97 | 1.43 | 0.18 | NA |
| 1-palmitoyl-2-linolenoyl-digalactosylglycerol (16:0/18:3) | ME446907 | 1.24 | 0.32 | 0.37 | 0.92 | 0.52 | 0.16 | 2.07 | 3.59 |
| caproate (6:0) | ME447155 | 0.60 | 0.66 | 0.48 | 1.47 | 0.47 | 0.67 | 2.11 | 2.70 |
| phytanate | ME447587 | 0.32 | 0.74 | 0.54 | 1.95 | 0.22 | 0.23 | 1.67 | 1.67 |
| pristanate | ME447599 | 0.60 | 0.99 | 0.38 | 1.26 | 0.37 | 0.32 | 2.26 | 1.72 |
| ponciretin | ME447594 | 1.50 | 0.09 | 1.35 | 0.16 | 0.25 | 2.21 | 0.52 | 1.49 |
| 2^-deoxycytidine | ME446944 | 1.40 | 0.52 | 1.70 | 0.50 | 0.50 | 2.22 | 0.92 | 1.83 |
| 4-acetamidobutanoate | ME447020 | 1.39 | 0.56 | 1.80 | 0.60 | 0.47 | 2.00 | 0.66 | 1.35 |
| nicotinate ribonucleoside | ME447507 | 1.03 | 0.69 | 1.49 | 0.69 | 0.80 | 1.81 | 0.20 | 2.16 |
| prolylglycine | ME447601 | 1.03 | 0.70 | 1.85 | 0.59 | 0.82 | 1.37 | 1.07 | 2.11 |
| piperidine | ME447592 | 1.71 | 0.83 | 1.51 | 0.57 | 0.11 | 0.64 | 0.16 | 1.98 |
| epicatechin | ME447244 | 2.16 | 0.41 | 0.84 | 0.30 | NA | 1.10 | 0.32 | 2.19 |
| nicotianamine | ME447503 | 1.94 | 0.59 | 1.24 | 0.56 | 0.69 | 1.20 | 0.34 | 2.60 |
| 3-methylglutaconate | ME447011 | 1.67 | NA | 1.27 | 0.45 | NA | 1.26 | NA | 0.89 |
| 2-methylcitrate/homocitrate | ME446963 | 1.09 | 0.83 | 1.25 | 0.86 | 0.12 | 1.77 | 0.17 | 1.26 |
| alpha-CEHC sulfate | ME447094 | 0.73 | 0.66 | 1.15 | 0.99 | NA | 1.47 | NA | 1.26 |
| 2-aminophenol | ME446940 | 1.30 | 0.62 | 1.12 | 1.04 | 0.24 | 1.27 | 0.32 | 1.91 |
| N-acetylaspartate (NAA) | ME447456 | 1.43 | 0.75 | 1.05 | 0.92 | 0.01 | 1.39 | 0.02 | 1.53 |
| xanthurenate | ME447727 | 1.85 | 0.86 | 0.86 | 0.94 | 0.16 | 1.27 | NA | 1.62 |
| thymidine 5^-monophosphate | ME447686 | 2.02 | 0.84 | 0.93 | 1.11 | 2.07 | 0.16 | 0.96 | 0.27 |
| 2^-deoxyadenosine 5^-monophosphate | ME446943 | 1.32 | 0.79 | 0.91 | 1.47 | 1.91 | 0.14 | 0.58 | 0.21 |
| 2^-deoxycytidine 5^-monophosphate | ME447199 | 1.21 | 0.83 | 0.86 | 1.43 | 2.25 | 0.15 | 0.80 | 0.37 |
| 1,2-dilinoleoyl-GPC (18:2/18:2) | ME446869 | 1.59 | 0.69 | 1.74 | 0.74 | 1.95 | 0.27 | 0.96 | 0.32 |
| 4-hydroxycyclohexylcarboxylic acid | ME447031 | 0.75 | 1.33 | 1.45 | 0.72 | 2.07 | 0.47 | 0.79 | 0.27 |
| 3b-hydroxy-5-cholenoic acid | ME446985 | 0.98 | 1.46 | 0.57 | 0.93 | 1.54 | 0.47 | 0.90 | 0.54 |
| N-acetyl-1-methylhistidine* | ME447451 | 0.94 | 1.42 | 0.41 | 1.05 | 1.46 | 0.84 | 0.31 | 0.55 |
| 3,4-dihydroxyphenylacetate | ME446980 | 0.88 | 1.07 | 1.12 | 1.20 | 1.49 | 0.53 | NA | 0.23 |
| ibuprofen | ME447347 | 0.65 | 1.29 | 1.10 | 1.07 | 1.80 | NA | 0.32 | 0.12 |
| adenosine 5^-monophosphate (AMP) | ME447102 | 0.69 | 1.02 | 0.84 | 1.47 | 1.37 | 0.44 | 0.76 | 0.46 |
| phosphate | ME447583 | 1.01 | 0.90 | 0.95 | 1.55 | 0.87 | 0.43 | 0.29 | 0.20 |
| palmitoyl-linoleoyl-glycerol (16:0/18:2) [1]* | ME447563 | 1.12 | 0.64 | 1.33 | 1.16 | 2.36 | 0.83 | 0.76 | 0.45 |
| palmitoyl-oleoyl-glycerol (16:0/18:1) [2]* | ME447565 | 0.87 | 0.54 | 1.07 | 1.46 | 1.86 | 1.32 | 0.55 | 0.62 |
| tyrosol | ME447702 | 0.90 | 0.73 | 0.59 | 1.45 | 2.21 | 0.99 | 0.94 | 0.49 |
| glucose | ME447288 | 0.72 | 0.82 | 1.52 | 0.81 | 1.46 | 1.79 | 0.49 | 1.25 |
| dihydrocaffeate | ME447220 | 1.00 | 0.98 | 1.00 | 1.00 | 1.78 | 1.36 | 0.59 | 0.58 |
| isocaproate (i6:0) | ME447360 | 0.92 | 0.94 | 0.91 | 0.88 | 1.50 | 1.84 | 0.80 | 0.64 |
| bilirubin (Z,Z) | ME447140 | 1.20 | 0.97 | 0.71 | 1.13 | 1.20 | 1.11 | 0.04 | 1.04 |
| biliverdin | ME447143 | 1.33 | 0.97 | 0.97 | 0.93 | 1.12 | 1.08 | 0.13 | 0.75 |
| kynurenine | ME447368 | 1.43 | 0.89 | 1.04 | 0.76 | 1.55 | 0.89 | 0.91 | 1.25 |
| N1-Methyl-2-pyridone-5-carboxamide | ME447442 | 1.69 | 0.92 | 0.91 | 0.85 | 1.56 | 0.92 | 1.07 | 0.91 |
| palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]* | ME447564 | 1.09 | 0.73 | 1.38 | 1.09 | 1.54 | 0.95 | 0.44 | 0.70 |
| glycerol 3-phosphate | ME447298 | 1.21 | 0.86 | 1.03 | 1.23 | 1.56 | 0.45 | 0.43 | 0.52 |
| N-delta-acetylornithine | ME447495 | 1.33 | 0.97 | 1.00 | 0.99 | 1.48 | 0.53 | 0.91 | 0.59 |
| 2-isopropylmalate | ME446959 | 1.28 | 0.22 | 2.85 | 0.47 | 0.34 | 1.59 | 0.42 | 1.66 |
| lactobionate | ME447370 | 1.11 | 0.61 | 2.24 | 0.55 | 0.28 | 0.93 | 0.24 | 1.70 |
| carnitine | ME447160 | 0.65 | 0.65 | 2.64 | 0.75 | 0.35 | 0.95 | 0.66 | 1.03 |
| fructose | ME447261 | 0.61 | 0.54 | 2.92 | 0.50 | 0.51 | 1.02 | 0.54 | 1.75 |
| N-acetylthreonine | ME447483 | 0.33 | 0.99 | 1.75 | 0.83 | 0.58 | 1.14 | 0.76 | 1.39 |
| glutarate (C5-DC) | ME447295 | 0.63 | 1.02 | 2.05 | 0.81 | 0.09 | 1.25 | 0.39 | 0.83 |
| maltose | ME447412 | 1.00 | 0.73 | 1.99 | 0.79 | 0.58 | 1.62 | 0.32 | 0.63 |
| myristoylcarnitine (C14) | ME447436 | 1.16 | 1.03 | 1.72 | 0.42 | 0.47 | 1.36 | 0.32 | 0.92 |
| 4-hydroxyhippurate | ME447033 | 1.06 | 0.12 | 1.95 | 1.36 | 0.59 | 0.37 | NA | 1.65 |
| cinnamate | ME447181 | 1.33 | 0.49 | 1.64 | 1.97 | 0.52 | 0.64 | 0.36 | 1.04 |
| 15-methylpalmitate (i17:0) | ME446881 | 1.33 | 0.86 | 1.51 | 1.01 | 0.36 | 0.27 | 1.52 | 0.50 |
| glycosyl ceramide (d18:1/20:0, d16:1/22:0)* | ME447311 | 0.92 | 1.05 | 1.85 | 1.00 | NA | 0.33 | 1.60 | 0.29 |
| 2-hydroxybehenate | ME446950 | 0.99 | 1.14 | 1.08 | 1.22 | 0.49 | 0.27 | 0.85 | 0.27 |
| N-methylpipecolate | ME447515 | 1.35 | 0.96 | 1.13 | 1.12 | 0.42 | 0.35 | 0.75 | 0.52 |
| N-acetylpyrraline | ME447479 | 0.92 | 1.16 | 1.64 | 1.23 | 0.34 | 0.49 | 0.40 | 0.16 |
| trigonelline (N^-methylnicotinate) | ME447693 | 0.91 | 0.83 | 1.69 | 1.22 | 0.43 | 0.26 | 1.01 | 0.28 |
| taurodeoxycholate | ME447671 | 0.35 | 0.80 | 1.62 | 1.21 | NA | 0.06 | NA | 0.75 |
| catechol sulfate | ME447165 | 0.55 | 1.05 | 1.83 | 1.37 | NA | 0.36 | 0.22 | 0.23 |
| serotonin | ME447639 | 0.40 | 0.67 | 2.08 | 1.41 | 0.08 | 0.57 | 0.09 | 0.26 |
| galacturonate | ME447268 | 1.35 | 0.52 | 2.26 | 0.93 | 0.09 | 0.47 | 0.43 | 0.70 |
| oxalate (ethanedioate) | ME447551 | 1.32 | 0.81 | 2.38 | 0.62 | 0.14 | 0.79 | 0.31 | 0.38 |
| p-cresol | ME447569 | 1.42 | 0.90 | 1.91 | 0.75 | 0.50 | 0.80 | 0.40 | 0.68 |
| 2,3-dihydroxyisovalerate | ME446929 | 1.27 | 0.63 | 1.99 | 0.92 | 0.75 | 0.54 | 0.53 | 0.61 |
| 2-oxo-1-pyrrolidinepropionate | ME446968 | 1.21 | 0.84 | 1.80 | 0.97 | 0.59 | 0.65 | 0.63 | 0.44 |
| 1-linolenoylglycerol (18:3) | ME446885 | 1.37 | 0.78 | 1.75 | 0.99 | 0.18 | 0.24 | 0.71 | 0.63 |
| laurate (12:0) | ME447376 | 1.77 | 0.74 | 1.86 | 0.67 | 0.12 | 0.57 | 0.63 | 0.59 |
| dihydoxyphenylalanine (L-DOPA) | ME447219 | 0.93 | 0.90 | 2.09 | 0.97 | 0.17 | 0.54 | 0.33 | 0.87 |
| 13-HOTrE | ME446880 | 0.99 | 1.12 | 1.94 | 0.78 | NA | 0.23 | 0.54 | 0.62 |
| linolenate [alpha or gamma; (18:3n3 or 6)] | ME447387 | 0.82 | 0.95 | 1.86 | 1.08 | 0.06 | 0.23 | 0.39 | 0.71 |
| 2-oxindole-3-acetate | ME446967 | 1.42 | 1.15 | 1.73 | 0.65 | 0.07 | 0.40 | 0.03 | 1.05 |
| indole | ME447350 | 1.16 | 1.15 | 1.81 | 0.71 | NA | 0.65 | NA | 0.36 |
| carboxyibuprofen | ME447159 | 0.86 | 0.91 | 1.98 | 1.16 | 0.87 | NA | 0.16 | 0.30 |
| arabitol/xylitol | ME447113 | 0.66 | 0.41 | 2.29 | 1.01 | 0.88 | 0.40 | 0.43 | 1.33 |
| diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1])* | ME447211 | 0.75 | 0.63 | 1.87 | 1.30 | 0.77 | 0.55 | 0.41 | 0.74 |
| erythrose | ME447250 | 0.80 | 0.75 | 2.12 | 0.96 | 0.71 | 0.50 | 0.37 | 1.03 |
| diacetylchitobiose | ME447210 | 0.29 | 0.94 | 0.28 | 1.45 | NA | NA | NA | 2.26 |
| diosmetin | ME447226 | 0.34 | NA | NA | 1.49 | 0.40 | 0.14 | 0.12 | 2.08 |
| S-allylcysteine | ME447631 | NA | 0.60 | 0.26 | 1.20 | NA | 0.92 | NA | 1.61 |
| protoporphyrin IX | ME447604 | 0.98 | 0.83 | 0.52 | 1.56 | 0.03 | 0.65 | 0.11 | 1.37 |
| 2,4-dihydroxyhydrocinnamate | ME446932 | 1.32 | 0.75 | 0.57 | 1.18 | NA | 0.58 | NA | 1.99 |
| orotate | ME447548 | 1.24 | 0.92 | 0.65 | 1.23 | 0.19 | 0.65 | 0.30 | 1.69 |
| L-urobilin | ME447403 | 0.66 | 1.06 | 0.78 | 1.14 | NA | 0.79 | 0.02 | 2.04 |
| N-methylproline | ME447516 | 0.66 | 1.03 | 0.43 | 1.54 | 0.33 | 0.68 | 0.29 | 1.75 |
| N-stearoyl-sphinganine (d18:0/18:0)* | ME447529 | 0.54 | 1.15 | 0.45 | 1.40 | 0.22 | 1.05 | 0.50 | 1.63 |
| 3-hydroxypyridine | ME447001 | 1.36 | 0.78 | 0.72 | 1.31 | 0.86 | 0.57 | 1.94 | 0.53 |
| 3-methyl-2-oxovalerate | ME447009 | 0.80 | 0.69 | 1.39 | 1.60 | 0.40 | 0.51 | 1.73 | 0.55 |
| 4-hydroxyphenylpyruvate | ME447035 | 0.73 | 0.83 | 1.07 | 1.41 | 0.87 | 0.72 | 2.14 | 0.82 |
| stearate (18:0) | ME447652 | 0.78 | 1.06 | 1.04 | 1.18 | 0.50 | 0.51 | 2.26 | 0.49 |
| 1-methylurate | ME446898 | 1.02 | 0.94 | 0.61 | 1.41 | 0.14 | 0.70 | 2.03 | 0.55 |
| 3-hydroxypalmitate | ME446999 | 0.70 | 1.40 | 0.42 | 1.40 | 0.01 | 1.01 | 1.99 | 0.23 |
| 5-acetylamino-6-formylamino-3-methyluracil | ME447044 | 1.22 | 1.42 | 0.60 | 1.11 | 0.12 | 0.22 | 1.29 | 0.47 |
| hexadecatrienoate (16:3n3) | ME447333 | 0.91 | 1.38 | 0.29 | 1.21 | 0.26 | 0.39 | 1.68 | 0.52 |
| 2-hydroxypalmitate | ME446957 | 1.06 | 1.13 | 1.06 | 1.15 | 0.57 | 0.18 | 1.70 | 0.37 |
| docosadienoate (22:2n6) | ME447230 | 0.99 | 1.28 | 1.00 | 1.05 | 0.32 | 0.27 | 1.78 | 0.24 |
| 2-hydroxylaurate | ME446956 | 0.99 | 1.10 | 1.03 | 1.05 | 0.58 | 0.51 | 1.49 | 0.71 |
| 6-oxolithocholate | ME447071 | 0.72 | 1.23 | 1.01 | 1.10 | 0.47 | 0.55 | 1.50 | 0.60 |
| 1-methylxanthine | ME446899 | 0.97 | 1.24 | 0.70 | 1.13 | 0.16 | 0.74 | 1.59 | 0.92 |
| N-trimethyl 5-aminovalerate | ME447532 | 0.89 | 1.17 | 0.69 | 1.15 | 0.52 | 0.73 | 1.66 | 0.76 |
| S-methylcysteine | ME447644 | 0.60 | 1.22 | 1.48 | 0.70 | 0.81 | 0.56 | 1.69 | 1.21 |
| myristate (14:0) | ME447434 | 0.87 | 0.75 | 1.56 | 1.06 | 0.37 | 0.55 | 1.75 | 1.19 |
| N-acetylglucosaminylasparagine | ME447464 | 0.74 | 0.79 | 1.32 | 1.05 | 0.90 | 0.87 | 1.84 | 1.36 |
| N-acetylneuraminate | ME447475 | 0.82 | 0.84 | 1.25 | 1.08 | 0.68 | 0.54 | 2.20 | 1.17 |
| 7-methylxanthine | ME447078 | 1.54 | 0.58 | 1.12 | 0.91 | NA | 0.86 | 1.61 | 1.10 |
| 1-stearoyl-GPG (18:0) | ME446924 | 1.05 | 0.91 | 0.90 | 1.03 | 0.25 | 0.91 | 1.80 | 1.13 |
| N-propionylalanine | ME447527 | 1.24 | 1.12 | 0.61 | 0.88 | 0.52 | 1.13 | 1.78 | 1.10 |
| glutamyl-meso-diaminopimelate | ME447294 | 0.85 | 1.19 | 0.74 | 1.88 | NA | 0.65 | 1.01 | 0.85 |
| margaroylcarnitine (C17)* | ME447418 | 0.60 | 1.00 | 0.56 | 1.61 | 0.23 | 1.02 | 1.35 | 0.96 |
| 1,7-dimethylurate | ME446873 | 0.93 | 1.17 | 0.46 | 1.22 | 0.09 | 0.73 | 1.38 | 1.18 |
| N-formylanthranilic acid | ME447499 | 1.07 | 1.04 | 0.65 | 1.27 | 0.21 | 0.72 | 0.97 | 0.92 |
| N-acetyl-3-methylhistidine* | ME447452 | 1.60 | 0.90 | 0.27 | 1.19 | 0.23 | 1.18 | 1.07 | 0.58 |
| linoleoyl ethanolamide | ME447391 | 1.44 | 0.75 | 0.80 | 1.49 | 0.03 | 0.84 | 0.79 | 0.36 |
| mevalonate 5-diphosphate | ME447430 | 1.20 | 1.02 | 0.98 | 1.27 | NA | 0.52 | 1.09 | 0.47 |
| methyl indole-3-acetate | ME447424 | 0.64 | 1.08 | 1.67 | 1.21 | NA | 0.66 | NA | 1.44 |
| beta-cryptoxanthin | ME447134 | 0.57 | 1.59 | 1.01 | 0.83 | 0.10 | 0.54 | 0.16 | 1.43 |
| hydroxymethylpyrimidine | ME447343 | 0.71 | 1.59 | 0.97 | 0.81 | 0.46 | 0.29 | 0.65 | 1.18 |
| 5alpha-androstan-3beta,17alpha-diol monosulfate (2) | ME447051 | 1.50 | 1.37 | 0.39 | 1.03 | NA | 0.37 | NA | 1.10 |
| 5-hydroxyhexanoate | ME447064 | 1.12 | 1.05 | 1.45 | 0.92 | 0.14 | 0.37 | 0.73 | 1.27 |
| 2,3-dimethylsuccinate | ME446930 | 1.10 | 1.03 | 1.22 | 0.95 | NA | 0.52 | 0.61 | 0.82 |
| dopamine | ME447234 | 1.06 | 1.04 | 1.43 | 1.01 | 0.24 | 0.61 | 0.55 | 0.52 |
| 1,3-dimethylurate | ME446872 | 0.81 | 1.26 | 0.98 | 1.06 | NA | 0.47 | 0.90 | 0.85 |
| quinate | ME447616 | 0.94 | 1.09 | 1.18 | 1.00 | 0.10 | 0.73 | 0.90 | 1.08 |
| 2-aminoadipate | ME446938 | 1.04 | 1.11 | 0.75 | 1.11 | 0.26 | 1.15 | 0.53 | 0.89 |
| N-acetylglutamate | ME447465 | 1.14 | 1.12 | 0.94 | 0.96 | 0.25 | 1.15 | 0.31 | 0.98 |
| lanosterol | ME447375 | 0.93 | 1.12 | 1.02 | 1.06 | 0.37 | 0.92 | 0.67 | 0.87 |
| behenoylcarnitine (C22)* | ME447129 | 1.12 | 1.07 | 1.03 | 1.02 | 0.40 | 1.16 | 0.44 | 0.67 |
| oleoyl ethanolamide | ME447539 | 1.01 | 1.22 | 0.97 | 1.04 | 0.33 | 0.95 | 0.48 | 0.57 |
| palmitoyl ethanolamide | ME447558 | 0.96 | 1.17 | 0.98 | 1.08 | 0.31 | 1.00 | 0.34 | 0.71 |
| 16a-hydroxy DHEA 3-sulfate | ME446882 | 1.13 | 1.31 | 0.74 | 1.02 | NA | 0.98 | 0.20 | 0.85 |
| 3-methylglutarate/2-methylglutarate | ME447012 | 1.06 | 1.09 | 1.08 | 1.01 | 0.05 | 0.92 | 0.27 | 0.85 |
| tricarballylate | ME447691 | 1.00 | 1.25 | 0.95 | 1.06 | 0.16 | 0.95 | 0.06 | 0.66 |
| 4-hydroxybenzyl alcohol | ME447028 | 1.16 | 0.90 | 0.78 | 1.01 | NA | 1.26 | NA | 0.90 |
| methylsuccinate | ME447427 | 1.21 | 1.15 | 1.04 | 0.92 | 0.04 | 1.22 | 0.07 | 0.75 |
| 3,5-dihydroxybenzoic acid | ME446981 | 1.45 | 0.80 | 1.08 | 1.09 | 0.56 | 0.94 | NA | 0.93 |
| dimethylmalonic acid | ME447225 | 1.08 | 0.95 | 1.11 | 0.95 | NA | 0.92 | NA | 1.04 |
| fumarate | ME447264 | 1.22 | 0.91 | 1.23 | 0.89 | 0.10 | 1.01 | 0.09 | 1.23 |
| pimelate (C7-DC) | ME447590 | 1.29 | 0.83 | 1.08 | 1.03 | 0.31 | 1.07 | 0.49 | 0.95 |
| alpha-tocopherol | ME447099 | 1.46 | 0.97 | 1.23 | 0.89 | 0.22 | 0.86 | 0.43 | 0.74 |
| N-carbamoylglutamate | ME447493 | 1.36 | 0.71 | 1.15 | 1.01 | NA | 0.94 | 0.27 | 0.81 |
| undecanedioate (C11-DC) | ME447704 | 1.16 | 1.33 | 0.78 | 0.84 | 0.18 | 0.93 | 0.27 | 1.21 |
| 4-hydroxyglutamate | ME447032 | 1.45 | 0.89 | 0.91 | 0.89 | NA | 1.03 | 0.43 | 1.24 |
| maltol | ME447411 | 1.19 | 0.97 | 0.89 | 0.94 | NA | 0.92 | 0.47 | 1.47 |
| homocitrulline | ME447339 | 1.24 | 1.04 | 0.95 | 0.95 | 0.25 | 0.99 | 0.43 | 1.48 |
| pyridoxate | ME447611 | 1.19 | 0.99 | 1.09 | 0.87 | 0.30 | 1.14 | 0.39 | 1.45 |
| hexadecanedioate (C16-DC) | ME447330 | 0.80 | 1.17 | 0.69 | 1.05 | 0.33 | 1.36 | 0.27 | 1.46 |
| 3-hydroxysuberate | ME447004 | 0.94 | 0.95 | 0.84 | 1.07 | NA | 1.31 | 0.52 | 1.26 |
| hydantoin-5-propionic acid | ME447341 | 0.81 | 0.91 | 0.87 | 1.23 | 0.31 | 1.22 | 0.72 | 1.11 |
| 1-methylimidazoleacetate | ME446896 | 1.40 | 0.97 | 0.69 | 1.14 | 0.38 | 0.82 | 0.57 | 1.03 |
| carotene diol (1) | ME447162 | 1.18 | 1.28 | 0.62 | 1.05 | 0.27 | 0.49 | 0.50 | 1.15 |
| glutamate, gamma-methyl ester | ME447291 | 1.07 | 0.91 | 1.12 | 1.03 | 0.63 | 0.90 | 0.55 | 1.31 |
| quinolinate | ME447618 | 1.05 | 0.87 | 1.07 | 1.13 | 0.41 | 0.84 | 0.31 | 1.33 |
| nicotinamide | ME447504 | 0.74 | 1.16 | 0.98 | 1.16 | 0.44 | 0.58 | 0.63 | 1.17 |
| suberate (C8-DC) | ME447658 | 0.98 | 1.08 | 0.93 | 1.15 | 0.32 | 0.64 | 0.29 | 1.24 |
| caffeine | ME447152 | 0.66 | 0.97 | 1.02 | 1.33 | 0.08 | 0.89 | 0.52 | 1.50 |
| N-acetylcysteine | ME447461 | 0.92 | 0.90 | 1.05 | 1.29 | NA | 0.66 | 0.29 | 1.01 |
| theophylline | ME447677 | 0.79 | 0.99 | 0.86 | 1.32 | NA | 0.74 | 0.56 | 0.96 |
| 3-aminoisobutyrate | ME446983 | 1.58 | 0.99 | 0.90 | 1.17 | 0.52 | 0.56 | 0.49 | 0.50 |
| 4-cholesten-3-one | ME447024 | 1.37 | 0.98 | 0.84 | 1.27 | 0.23 | 0.63 | 0.24 | 0.48 |
| dipicolinate | ME447229 | 1.38 | 1.18 | 1.06 | 0.93 | NA | 0.38 | 0.12 | 0.47 |
| octadecanedioate (C18-DC) | ME447535 | 1.34 | 1.13 | 1.08 | 0.89 | 0.33 | 0.32 | NA | 0.58 |
| azelate (C9-DC) | ME447125 | 1.21 | 1.05 | 1.14 | 1.07 | 0.25 | 0.56 | 0.26 | 0.79 |
| sebacate (C10-DC) | ME447634 | 1.19 | 1.04 | 1.09 | 1.04 | 0.23 | 0.61 | 0.35 | 0.66 |
| carotene diol (2) | ME447163 | 1.19 | 1.23 | 0.89 | 1.01 | 0.32 | 0.48 | 0.37 | 0.88 |
| carotene diol (3) | ME447164 | 1.17 | 1.28 | 0.84 | 1.05 | 0.15 | 0.48 | 0.22 | 0.84 |
| beta-muricholate | ME447138 | 1.14 | 1.13 | 0.97 | 1.13 | 0.15 | 0.48 | 0.05 | 0.56 |
| indolin-2-one | ME447357 | 1.15 | 1.24 | 0.90 | 1.06 | 0.30 | 0.35 | 0.13 | 0.70 |
| 3-methyladipate | ME447010 | 1.29 | 1.25 | 0.61 | 1.05 | NA | 0.46 | 0.07 | 0.50 |
| 5alpha-androstan-3beta,17beta-diol monosulfate (1) | ME447053 | 1.08 | 1.14 | 0.60 | 1.06 | NA | 0.61 | NA | 1.06 |
| flavin mononucleotide (FMN) | ME447259 | 1.23 | 0.98 | 0.76 | 1.08 | NA | 0.61 | NA | 0.82 |
| 5-hydroxymethylfurfural | ME447066 | 0.94 | 1.58 | 0.88 | 0.81 | NA | 0.31 | 0.48 | 0.78 |
| sitostanol | ME447642 | 0.84 | 1.47 | 0.70 | 0.93 | NA | 0.59 | 0.13 | 0.96 |
| xanthosine | ME447726 | 0.71 | 1.23 | 0.99 | 1.23 | 0.25 | 0.63 | 0.52 | 0.47 |
| delta-tocopherol | ME447202 | 0.77 | 1.27 | 0.93 | 1.15 | 0.17 | 0.81 | 0.45 | 0.72 |
| gamma-tocopherol/beta-tocopherol | ME447282 | 0.83 | 1.29 | 0.91 | 1.15 | 0.20 | 0.65 | 0.49 | 0.67 |
| 5-acetylamino-6-amino-3-methyluracil | ME447043 | 0.88 | 1.22 | 0.72 | 1.31 | NA | 0.22 | 0.43 | 0.45 |
| palmitoylcholine | ME447561 | 0.73 | 1.21 | 1.01 | 1.19 | 0.11 | 0.37 | 0.27 | 0.51 |
| coprostanol | ME447186 | 0.72 | 1.60 | 0.87 | 0.96 | NA | 0.51 | 0.11 | 0.47 |
| 3-carboxyadipate | ME446987 | 0.98 | 1.30 | 1.18 | 1.08 | 0.05 | 0.32 | 0.07 | 0.30 |
| 4-oxo-retinoic acid | ME447040 | 0.88 | 1.18 | 1.13 | 0.94 | NA | 0.45 | NA | 0.59 |
| 5alpha-androstan-3beta,17alpha-diol monosulfate (1) | ME447050 | 0.86 | 1.30 | 1.26 | 0.94 | NA | 0.45 | NA | 0.67 |
| guanosine-2^,3^-cyclic monophosphate | ME447322 | 0.94 | 1.38 | 0.58 | 0.86 | NA | NA | 0.38 | 0.40 |
| dihydroorotate | ME447222 | 1.11 | 1.13 | 0.44 | 1.52 | 0.12 | 0.22 | 0.33 | 0.46 |
| paraxanthine | ME447568 | 0.97 | 1.04 | 0.48 | 1.31 | NA | 0.50 | 0.54 | 0.73 |
| epiandrosterone sulfate | ME447243 | 1.07 | 1.65 | 0.37 | 1.10 | 0.64 | 1.02 | 1.07 | 0.76 |
| pterin | ME447607 | 1.05 | 1.25 | 0.58 | 1.18 | 0.72 | 0.51 | 0.21 | 0.54 |
| 3,4-dihydroxybenzoate | ME446979 | 0.92 | 1.62 | 0.78 | 0.85 | 0.51 | 0.42 | 0.89 | 0.55 |
| biotin | ME447145 | 0.92 | 1.31 | 0.64 | 1.14 | 0.56 | 0.45 | 0.84 | 0.52 |
| 1-methylguanidine | ME446894 | 0.97 | 1.33 | 0.56 | 1.22 | 0.28 | 0.64 | 0.59 | 0.60 |
| stearoyl ethanolamide | ME447654 | 0.86 | 1.23 | 0.64 | 1.27 | 0.50 | 0.76 | 0.72 | 0.65 |
| enterolactone | ME447242 | 0.41 | 1.41 | 0.79 | 1.38 | 0.09 | 0.86 | 0.16 | 0.41 |
| anthranilate | ME447110 | 0.59 | 1.10 | 0.96 | 1.07 | NA | 0.81 | NA | NA |
| caffeate | ME447150 | 0.73 | 1.47 | 1.15 | 0.81 | 0.19 | 1.01 | NA | 0.21 |
| 3-hydroxycinnamate | ME446992 | 0.83 | 1.26 | NA | 1.16 | NA | 0.85 | 0.32 | 0.77 |
| cholate sulfate | ME447176 | 1.31 | 1.59 | 0.47 | 1.20 | 0.05 | 0.86 | 0.39 | 0.37 |
| p-cresol sulfate | ME447570 | 1.04 | 1.08 | 0.57 | 1.40 | 0.10 | 1.26 | 0.20 | 0.27 |
| 5alpha-androstan-3beta,17alpha-diol disulfate | ME447049 | 1.28 | 1.04 | 0.35 | 1.39 | NA | 1.00 | NA | 0.63 |
| ursodeoxycholate sulfate (1) | ME447711 | 1.03 | 1.12 | 0.49 | 1.38 | NA | 1.03 | 0.06 | 0.48 |
| S-methylmethionine | ME447645 | 0.69 | 1.42 | 1.28 | 0.68 | 1.21 | 1.24 | 0.55 | 0.22 |
| palmitoleoylcarnitine (C16:1)* | ME447555 | 0.47 | 1.48 | 1.23 | 0.79 | 0.45 | 0.85 | 0.51 | 0.75 |
| linoleoylcarnitine (C18:2)* | ME447393 | 0.93 | 1.20 | 1.44 | 0.77 | 0.93 | 0.72 | 0.74 | 0.97 |
| valine betaine | ME447717 | 0.86 | 1.09 | 1.44 | 1.00 | 0.63 | 0.96 | 0.39 | 0.66 |
| 3-sulfo-L-alanine | ME447017 | 0.58 | 1.06 | 0.74 | 1.12 | 0.38 | 1.17 | 1.60 | 1.56 |
| ceramide (d18:1/14:0, d16:1/16:0)* | ME447167 | 0.53 | 0.98 | 0.72 | 1.23 | 0.98 | 1.05 | 1.57 | 1.59 |
| cis-4-hydroxycyclohexylacetic acid | ME447182 | 0.65 | 1.16 | 0.79 | 1.05 | 1.04 | 1.12 | 1.06 | 1.50 |
| kynurenate | ME447367 | 0.69 | 1.03 | 0.93 | 0.99 | 1.15 | 1.17 | 1.32 | 1.63 |
| ceramide (d18:1/17:0, d17:1/18:0)* | ME447168 | 0.74 | 1.07 | 0.62 | 1.18 | 0.79 | 0.84 | 1.58 | 1.17 |
| leucylglycine | ME447381 | 0.88 | 1.06 | 0.44 | 1.32 | 0.84 | 0.75 | 1.18 | 1.25 |
| N-palmitoyl-sphinganine (d18:0/16:0) | ME447524 | 0.75 | 1.10 | 0.58 | 1.25 | 0.72 | 1.02 | 0.89 | 1.30 |
| O-acetylhomoserine | ME447533 | 1.10 | 1.33 | 0.83 | 0.75 | 0.83 | 0.94 | 1.20 | 0.87 |
| 7-ketocholesterol | ME447073 | 1.08 | 1.06 | 0.71 | 1.19 | 0.71 | 0.72 | 1.14 | 0.78 |
| leucylalanine | ME447379 | 1.03 | 0.97 | 0.71 | 1.18 | 0.84 | 0.81 | 1.37 | 0.98 |
| dimethylglycine | ME447224 | 1.37 | 0.90 | 0.90 | 1.01 | 0.92 | 0.74 | 1.29 | 0.88 |
| beta-sitosterol | ME447139 | 1.34 | 0.93 | 0.87 | 1.04 | 0.68 | 0.86 | 1.20 | 0.81 |
| campesterol | ME447153 | 1.20 | 1.01 | 0.79 | 1.07 | 0.57 | 0.88 | 1.39 | 0.82 |
| N-acetylcitrulline | ME447460 | 1.33 | 0.94 | 0.97 | 0.96 | 0.69 | 1.18 | 0.87 | 0.81 |
| stigmasterol | ME447657 | 1.31 | 0.98 | 0.87 | 1.09 | 0.64 | 0.88 | 0.82 | 0.64 |
| beta-guanidinopropanoate | ME447135 | 1.36 | 1.19 | 0.72 | 0.87 | 0.64 | 0.84 | 0.99 | 0.89 |
| ursodeoxycholate sulfate (2) | ME447712 | 1.46 | 0.99 | 0.96 | 0.83 | 0.45 | 0.89 | 1.17 | 0.90 |
| N-methylglutamate | ME447511 | 1.28 | 0.83 | 1.01 | 1.17 | 0.78 | 0.67 | 0.68 | 0.85 |
| sedoheptulose | ME447637 | 1.35 | 0.88 | 1.10 | 0.97 | 1.01 | 0.68 | 0.69 | 1.19 |
| alpha-tocotrienol | ME447101 | 1.19 | 1.20 | 1.01 | 0.89 | 0.37 | 0.67 | 0.66 | 0.94 |
| gamma-tocotrienol | ME447283 | 1.14 | 1.24 | 0.87 | 0.93 | 0.50 | 0.71 | 0.83 | 0.84 |
| pipecolate | ME447591 | 1.13 | 1.12 | 0.71 | 1.10 | 0.74 | 0.81 | 0.73 | 0.87 |
| cerotoylcarnitine (C26)* | ME447171 | 1.00 | 1.13 | 0.85 | 1.12 | 0.56 | 0.68 | 0.75 | 0.97 |
| maleate | ME447407 | 1.08 | 1.12 | 1.01 | 1.00 | 0.71 | 0.57 | 0.64 | 0.94 |
| thymine | ME447684 | 0.67 | 1.24 | 1.12 | 1.01 | 0.66 | 0.69 | 0.89 | 0.90 |
| palmitate (16:0) | ME447553 | 0.85 | 1.03 | 1.06 | 1.17 | 0.74 | 0.64 | 1.12 | 0.74 |
| cholesterol | ME447177 | 1.00 | 0.98 | 0.98 | 1.25 | 0.50 | 0.68 | 0.90 | 0.63 |
| oleate/vaccenate (18:1) | ME447538 | 0.81 | 1.02 | 1.01 | 1.26 | 0.66 | 0.73 | 0.85 | 0.65 |
| arachidoyl ethanolamide (20:0)* | ME447117 | 0.86 | 1.10 | 0.93 | 1.24 | 0.79 | 0.62 | 0.88 | 0.56 |
| glycosyl-N-palmitoyl-sphingosine (d18:1/16:0) | ME447312 | 0.90 | 1.01 | 1.02 | 1.25 | 0.76 | 0.69 | 0.89 | 0.56 |
| lignoceroylcarnitine (C24)* | ME447384 | 1.08 | 1.09 | 0.89 | 1.04 | 1.02 | 0.74 | 0.90 | 0.80 |
| behenoyl ethanolamide (22:0)* | ME447128 | 1.05 | 1.03 | 0.93 | 1.23 | 0.90 | 0.47 | 0.87 | 0.60 |
| lignoceroyl ethanolamide (24:0)* | ME447383 | 1.10 | 1.02 | 0.91 | 1.15 | 0.85 | 0.57 | 0.97 | 0.72 |
| 4-methyl-2-oxopentanoate | ME447037 | 0.73 | 0.90 | 1.15 | 1.45 | 0.44 | 0.81 | 1.01 | 0.76 |
| alpha-ketoglutarate | ME447097 | 1.02 | 0.76 | 1.19 | 1.23 | 0.48 | 0.92 | 1.18 | 0.76 |
| N-methylleucine | ME447513 | 0.97 | 0.74 | 1.17 | 1.31 | 0.35 | 0.75 | 1.09 | 0.86 |
| ferulate | ME447255 | 0.66 | 0.94 | 0.94 | 1.34 | 0.45 | 0.85 | 1.05 | 1.19 |
| N-acetylhistamine | ME447468 | 0.96 | 0.99 | 0.95 | 1.09 | 0.35 | 0.98 | 1.28 | 1.07 |
| N-palmitoylglycine | ME447522 | 0.92 | 1.00 | 0.94 | 1.19 | 0.77 | 1.19 | 1.20 | 0.45 |
| oleoylcarnitine (C18:1) | ME447540 | 0.75 | 1.24 | 0.78 | 1.19 | 0.63 | 1.11 | 1.01 | 0.79 |
| stearoylcarnitine (C18) | ME447655 | 0.87 | 1.01 | 0.68 | 1.26 | 0.38 | 1.24 | 1.07 | 0.95 |
| glycerophosphoglycerol | ME447300 | 0.87 | 0.94 | 1.00 | 1.02 | 1.25 | 1.06 | 0.70 | 1.44 |
| N-acetylglutamine | ME447466 | 0.82 | 1.07 | 0.83 | 0.96 | 1.14 | 1.46 | 0.89 | 1.30 |
| N-acetylhistidine | ME447469 | 0.99 | 0.98 | 1.00 | 0.94 | 1.21 | 1.26 | 0.71 | 1.17 |
| aspartate | ME447123 | 0.84 | 0.94 | 1.16 | 0.92 | 1.01 | 1.32 | 0.92 | 1.31 |
| palmitoylcarnitine (C16) | ME447560 | 0.83 | 0.88 | 1.14 | 1.02 | 1.08 | 1.39 | 0.68 | 1.20 |
| levulinate (4-oxovalerate) | ME447382 | 0.84 | 0.93 | 0.98 | 1.01 | 0.85 | 1.39 | 1.29 | 1.33 |
| riboflavin (Vitamin B2) | ME447622 | 1.00 | 1.08 | 0.82 | 0.90 | 0.90 | 1.25 | 1.03 | 1.31 |
| nicotinate | ME447506 | 1.03 | 0.95 | 0.87 | 0.99 | 1.14 | 1.22 | 1.08 | 1.18 |
| pantothenate | ME447567 | 1.05 | 0.99 | 0.86 | 0.94 | 1.06 | 1.14 | 1.15 | 1.32 |
| N6-methyladenosine | ME447450 | 0.59 | 1.09 | 0.87 | 1.02 | 1.13 | 1.29 | 1.34 | 1.15 |
| pyridoxamine | ME447610 | 0.91 | 1.04 | 0.82 | 0.92 | 1.40 | 1.42 | 1.15 | 1.11 |
| 10-hydroxystearate | ME446875 | 0.68 | 1.03 | 0.86 | 1.30 | 1.03 | 0.81 | 1.17 | 0.78 |
| benzoate | ME447130 | 0.76 | 0.97 | 0.79 | 1.22 | 1.07 | 1.05 | 0.91 | 1.04 |
| N-acetylmuramate | ME447474 | 0.92 | 1.04 | 1.03 | 1.00 | 1.40 | 0.82 | 0.94 | 0.95 |
| N-alpha-acetylornithine | ME447487 | 0.80 | 1.17 | 1.12 | 1.01 | 1.12 | 0.73 | 0.73 | 0.72 |
| cis-urocanate | ME447183 | 0.84 | 0.97 | 1.33 | 0.92 | 1.06 | 1.13 | 1.09 | 0.88 |
| 5-oxoproline | ME447069 | 0.79 | 1.06 | 1.37 | 0.92 | 1.04 | 0.76 | 1.11 | 0.88 |
| N-acetylglycine | ME447467 | 0.89 | 1.05 | 1.34 | 0.94 | 0.85 | 0.65 | 1.14 | 0.74 |
| fucose | ME447263 | 0.93 | 0.83 | 1.02 | 1.13 | 1.13 | 0.90 | 1.09 | 1.30 |
| N-acetylglucosamine/N-acetylgalactosamine | ME447463 | 0.86 | 0.84 | 1.25 | 1.11 | 1.06 | 0.79 | 1.02 | 1.11 |
| N-acetylasparagine | ME447455 | 0.92 | 0.97 | 1.16 | 0.95 | 0.97 | 1.02 | 1.23 | 1.06 |
| N-methylalanine | ME447509 | 0.99 | 1.05 | 1.02 | 0.99 | 0.92 | 0.90 | 1.22 | 0.85 |
| pseudouridine | ME447606 | 0.95 | 1.05 | 1.12 | 0.96 | 0.90 | 0.83 | 1.13 | 0.94 |
| 6-oxopiperidine-2-carboxylate | ME447072 | 0.99 | 1.13 | 1.00 | 0.84 | 1.14 | 0.88 | 1.15 | 1.07 |
| 2^-O-methyluridine | ME446966 | 0.76 | 1.13 | 0.93 | 0.97 | 1.02 | 0.94 | 1.15 | 1.11 |
| xanthine | ME447725 | 0.72 | 1.14 | 1.00 | 0.99 | 1.03 | 0.94 | 1.17 | 1.08 |
| hypoxanthine | ME447346 | 0.88 | 1.09 | 1.02 | 0.96 | 1.04 | 0.97 | 0.90 | 1.09 |
| N-acetylalanine | ME447453 | 0.79 | 1.11 | 1.06 | 0.99 | 0.86 | 0.85 | 1.01 | 1.16 |
| glycerophosphoinositol* | ME447301 | 0.95 | 0.53 | 1.00 | 1.42 | 1.17 | 0.97 | 1.14 | 1.22 |
| acisoga | ME447084 | 1.30 | 0.74 | 1.10 | 0.98 | 1.01 | 1.07 | 1.30 | 0.99 |
| mevalonolactone | ME447431 | 1.40 | 0.68 | 1.30 | 0.87 | 0.92 | 1.08 | 1.26 | 0.97 |
| cysteine | ME447190 | 0.99 | 0.78 | 1.50 | 0.82 | 0.38 | 1.22 | 0.74 | 1.82 |
| D-urobilin | ME447236 | 1.13 | 0.94 | 0.91 | 0.84 | 0.57 | 1.40 | 0.49 | 1.91 |
| malate | ME447406 | 1.07 | 0.86 | 0.99 | 0.94 | 0.35 | 1.36 | 0.81 | 1.82 |
| cytosine | ME447197 | 1.20 | 0.70 | 0.99 | 0.94 | 0.83 | 1.57 | 0.58 | 1.81 |
| gentisate | ME447285 | 1.36 | 0.77 | 1.17 | 0.60 | 0.87 | 1.51 | 0.78 | 1.82 |
| methyl glucopyranoside (alpha + beta) | ME447423 | 0.93 | 0.83 | 1.22 | 1.21 | 0.80 | 0.99 | 0.69 | 0.85 |
| nicotinamide riboside | ME447505 | 0.89 | 0.99 | 1.00 | 1.08 | 0.85 | 1.12 | 0.53 | 1.17 |
| glutamate | ME447290 | 0.92 | 0.96 | 1.11 | 0.97 | 0.54 | 1.31 | 0.75 | 1.29 |
| malonylcarnitine | ME447409 | 1.10 | 1.02 | 1.21 | 0.83 | 0.41 | 1.12 | 0.71 | 1.25 |
| pyridoxal | ME447609 | 1.16 | 0.93 | 1.02 | 0.87 | 0.69 | 1.23 | 0.65 | 1.56 |
| succinimide | ME447660 | 0.98 | 1.02 | 1.01 | 0.91 | 0.86 | 1.03 | 0.85 | 1.48 |
| bilirubin (E,Z or Z,E)* | ME447142 | 0.77 | 0.82 | 1.39 | 0.87 | 0.78 | 1.35 | 0.29 | 1.42 |
| beta-hydroxyisovalerate | ME447136 | 1.22 | 0.90 | 1.22 | 0.72 | 0.65 | 1.61 | 0.64 | 1.33 |
| deoxycarnitine | ME447203 | 1.16 | 0.77 | 1.19 | 0.90 | 1.07 | 1.56 | 0.63 | 1.15 |
| histamine | ME447336 | 1.19 | 0.90 | 1.26 | 1.01 | 0.23 | 1.02 | 1.16 | 0.60 |
| 3-(3-hydroxyphenyl)propionate | ME446973 | 1.38 | 1.03 | 0.85 | 0.89 | 0.04 | 1.26 | 0.96 | 0.73 |
| 3-hydroxysebacate | ME447003 | 1.35 | 1.00 | 0.96 | 1.01 | 0.10 | 0.96 | 0.80 | 0.57 |
| nervonoylcarnitine (C24:1)* | ME447498 | 1.19 | 0.94 | 1.27 | 1.01 | 0.17 | 1.31 | 0.52 | 0.68 |
| erucoylcarnitine (C22:1)* | ME447248 | 0.93 | 0.99 | 1.07 | 1.01 | 0.17 | 1.45 | 0.97 | 0.74 |
| 3,7-dimethylurate | ME446982 | 1.17 | 1.00 | 0.82 | 1.04 | 0.07 | 1.37 | 0.78 | 0.79 |
| arachidoylcarnitine (C20)* | ME447118 | 1.07 | 1.02 | 0.94 | 1.05 | 0.20 | 1.48 | 0.72 | 0.76 |
| phenylacetate | ME447573 | 1.09 | 1.20 | 0.67 | 0.83 | 0.49 | 1.64 | 1.12 | 0.92 |
| trans-urocanate | ME447688 | 1.01 | 1.11 | 0.81 | 0.90 | 0.71 | 1.38 | 1.14 | 1.09 |
| 4-imidazoleacetate | ME447036 | 1.20 | 1.03 | 0.67 | 0.94 | 0.40 | 1.58 | 0.56 | 1.31 |
| 5alpha-androstan-3beta,17beta-diol disulfate | ME447052 | 1.31 | 1.16 | 0.68 | 0.83 | 0.67 | 1.27 | 0.78 | 1.17 |
| N-carbamoylaspartate | ME447492 | 1.29 | 0.87 | 0.94 | 0.95 | 0.09 | 1.35 | 1.35 | 1.04 |
| cysteine s-sulfate | ME447191 | 0.90 | 0.93 | 1.14 | 0.89 | 0.44 | 1.34 | 1.31 | 1.48 |
| pyruvate | ME447615 | 1.09 | 0.81 | 1.40 | 0.89 | 0.29 | 1.47 | 0.92 | 1.05 |
| tetrahydrocortisone | ME447674 | 1.31 | 0.71 | 1.15 | 0.90 | 0.45 | 1.38 | 0.96 | 1.32 |
| allo-threonine | ME447093 | 1.88 | 0.96 | 0.69 | 0.98 | 0.92 | 0.41 | 0.57 | 1.28 |
| adenine | ME447085 | 2.11 | 0.79 | 0.68 | 0.82 | 1.14 | 1.19 | 0.67 | 0.68 |
| methylmalonate (MMA) | ME447425 | 2.00 | 0.82 | 0.91 | 0.83 | 0.11 | 1.32 | 0.66 | 0.93 |
| picolinate | ME447589 | 1.57 | 0.85 | 0.92 | 0.83 | NA | 1.41 | 0.70 | 1.14 |
| N2-acetyllysine | ME447444 | 1.73 | 0.82 | 0.67 | 0.80 | 0.86 | 1.66 | 0.62 | 1.28 |
| beta-alanine | ME447133 | 1.83 | 1.04 | 0.64 | 0.76 | 0.66 | 0.99 | 0.67 | 1.04 |
| 3-(2-hydroxyphenyl)propionate | ME446972 | 1.71 | 1.11 | 0.52 | 0.88 | 0.69 | 1.49 | 0.86 | 0.69 |
| sulfate* | ME447664 | 1.54 | 1.04 | 0.83 | 0.91 | 0.41 | 1.29 | 0.44 | 0.72 |
| 3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF) | ME446986 | 0.56 | 1.69 | 0.30 | 0.88 | 1.07 | 0.48 | NA | 1.35 |
| lactosyl-N-behenoyl-sphingosine (d18:1/22:0)* | ME447371 | 0.68 | 1.37 | 0.38 | 1.04 | 0.90 | 1.20 | 0.45 | 1.39 |
| N6-carboxyethyllysine | ME447447 | 0.65 | 1.44 | 0.64 | 1.09 | 1.38 | 0.98 | 0.57 | 1.17 |
| bilirubin (E,E)* | ME447141 | 0.86 | 1.03 | 0.66 | 1.12 | 0.85 | 1.76 | NA | 0.82 |
| heme | ME447324 | 1.20 | 1.01 | 0.66 | 1.08 | 0.19 | 1.63 | 0.15 | 0.98 |
| pregnen-diol disulfate C21H34O8S2* | ME447597 | 0.83 | 1.54 | 0.58 | 0.91 | 0.46 | 1.51 | 0.50 | 0.80 |
| pregn steroid monosulfate C21H34O5S* | ME447595 | 0.57 | 1.34 | 0.40 | 1.24 | 0.49 | 2.22 | 0.52 | 0.93 |
| androstenediol (3beta,17beta) monosulfate (1) | ME447106 | 0.54 | 1.50 | 0.27 | 1.42 | 0.11 | 1.92 | 0.18 | 1.17 |
| pregnenolone sulfate | ME447598 | 0.67 | 1.61 | 0.35 | 1.30 | 0.18 | 1.63 | 0.44 | 0.93 |
| 5alpha-androstan-3alpha,17alpha-diol monosulfate | ME447046 | 0.59 | 0.88 | 0.38 | 1.33 | 0.52 | 1.69 | 0.59 | 1.39 |
| 5alpha-androstan-3beta,17beta-diol monosulfate (2) | ME447054 | 0.57 | 0.94 | 0.41 | 1.28 | 0.72 | 1.73 | 0.48 | 1.04 |
| 5alpha-androstan-3alpha,17alpha-diol disulfate | ME447045 | 0.68 | 1.10 | 0.48 | 1.11 | 0.71 | 1.69 | 0.90 | 0.98 |
| androsterone sulfate | ME447108 | 0.98 | 1.06 | 0.30 | 1.29 | 0.85 | 1.68 | 0.93 | 1.08 |
| androstenediol (3beta,17beta) disulfate (2) | ME447105 | 0.78 | 0.99 | 0.46 | 1.13 | 0.45 | 1.79 | 0.58 | 1.87 |
| sphinganine | ME447649 | 0.63 | 1.08 | 0.50 | 1.18 | 0.48 | 1.63 | 0.60 | 1.87 |
| carboxyethyl-GABA | ME447158 | 0.72 | 0.99 | 0.76 | 1.18 | 0.68 | 1.41 | 0.71 | 1.41 |
| hexadecasphinganine (d16:0)* | ME447331 | 0.60 | 1.10 | 0.60 | 1.16 | 0.53 | 1.67 | 0.72 | 1.54 |
| dehydroisoandrosterone sulfate (DHEA-S) | ME447200 | 0.76 | 1.21 | 0.38 | 0.96 | 0.73 | 1.82 | 0.93 | 1.94 |
| sphingosine | ME447650 | 0.47 | 1.06 | 0.57 | 1.09 | 0.44 | 1.83 | 1.02 | 2.17 |
| hexadecasphingosine (d16:1)* | ME447332 | 0.33 | 0.79 | 1.07 | 1.30 | 0.43 | 1.55 | 0.76 | 1.40 |
| phytosphingosine | ME447588 | 0.81 | 0.79 | 1.01 | 1.03 | 0.65 | 2.04 | 1.11 | 1.30 |
| 7-methylguanine | ME447076 | 0.73 | 0.92 | 1.02 | 0.93 | 0.46 | 1.92 | 0.82 | 1.66 |
| sphingadienine | ME447648 | 0.50 | 0.86 | 0.90 | 1.19 | 0.17 | 2.01 | 0.68 | 1.62 |
| 3-hydroxyhexanoate | ME446994 | 0.73 | 1.24 | 0.49 | 0.83 | NA | 1.43 | 1.02 | 2.20 |
| orotidine | ME447549 | 0.70 | 0.79 | 0.46 | 1.53 | 0.12 | 1.56 | 0.45 | 1.93 |
| 3-ketosphinganine | ME447007 | 0.47 | 1.06 | 0.48 | 1.22 | 0.30 | 1.45 | 0.17 | 2.56 |
| heptadecasphingosine (d17:1) | ME447325 | 0.37 | 1.12 | 0.42 | 1.40 | 0.29 | 1.23 | 0.33 | 2.07 |
| ribose | ME447624 | 0.54 | 1.09 | 0.70 | 1.20 | 1.05 | 1.46 | 0.58 | 2.24 |
| 3-ureidopropionate | ME447018 | 1.16 | 1.15 | 0.59 | 0.89 | 0.60 | 1.14 | 0.10 | 2.04 |
| eicosanoylsphingosine (d20:1)* | ME447238 | 0.80 | 0.99 | 0.87 | 0.94 | 0.55 | 1.40 | 0.25 | 2.25 |
| pantetheine | ME447566 | 0.78 | 0.84 | 0.75 | 1.02 | 0.39 | 1.59 | 0.30 | 1.97 |
| harmane | ME447323 | 2.26 | 1.12 | 0.88 | 0.60 | NA | 0.91 | 1.55 | 0.75 |
| N-methyltryptophan | ME447518 | 2.17 | 0.89 | 0.40 | 0.79 | NA | NA | 1.24 | 0.54 |
| 3-hydroxy-2-ethylpropionate | ME446989 | 1.61 | 1.56 | NA | 0.79 | 0.87 | NA | 0.96 | 0.67 |
| pheophorbide A | ME447582 | 1.29 | 1.77 | 0.24 | 0.64 | 0.08 | 0.58 | 1.28 | 0.90 |
| 1-methylhistamine | ME446895 | 1.36 | 0.62 | 1.18 | NA | NA | NA | 0.50 | NA |
| phenylacetylglutamate | ME447574 | 2.14 | 0.82 | 1.58 | 0.70 | NA | NA | 0.94 | NA |
| 1-oleoyl-GPI (18:1)* | ME446905 | 1.83 | 0.41 | 0.83 | 1.01 | NA | 0.58 | NA | 0.44 |
| saccharopine | ME447629 | 2.22 | 0.50 | 1.22 | 0.93 | 0.22 | 0.35 | 0.15 | 0.76 |
| digalacturonic acid | ME447214 | 2.23 | 0.77 | 0.97 | 0.68 | NA | 0.50 | 0.09 | 1.10 |
| ethylmalonate | ME447252 | 1.82 | 0.80 | 1.16 | 0.83 | 0.05 | 0.81 | 0.25 | 1.03 |
| 1-methylnicotinamide | ME446897 | 1.91 | 0.69 | 1.53 | 0.78 | 0.52 | 0.77 | 0.30 | 0.49 |
| mannose | ME447416 | 1.69 | 0.82 | 1.28 | 0.96 | 0.62 | 0.70 | 0.96 | 0.62 |
| deoxymugineic acid | ME447206 | 1.67 | 1.26 | 1.21 | 0.71 | 0.63 | 0.48 | 0.51 | 0.48 |
| tyramine O-sulfate | ME447700 | 1.86 | 1.20 | 0.79 | 0.79 | 0.70 | 0.20 | 0.56 | 0.16 |
| dodecanedioate (C12-DC) | ME447233 | 2.26 | 1.11 | 0.82 | 0.58 | 0.24 | 0.67 | 0.34 | 0.74 |
| N-carbamoylsarcosine | ME447494 | 2.25 | 1.17 | 0.55 | 0.90 | 0.46 | 0.41 | 0.57 | 0.47 |
| 5alpha-pregnan-3beta,20alpha-diol disulfate | ME447056 | 1.42 | 1.62 | 1.25 | 0.62 | 0.09 | 0.31 | 0.10 | 0.22 |
| 5alpha-pregnan-3beta,20alpha-diol monosulfate (1) | ME447057 | 1.87 | 1.12 | 1.14 | 0.53 | NA | 0.18 | NA | 0.29 |
| escitalopram | ME447251 | 1.51 | 0.56 | 1.15 | 0.78 | NA | NA | NA | NA |
| nicotinic acid mononucleotide (NaMN) | ME447508 | 1.89 | 0.54 | 1.47 | 1.54 | 0.11 | 0.06 | NA | 0.11 |
| tiglylcarnitine (C5:1-DC) | ME447685 | 1.57 | 0.35 | 2.27 | 0.46 | NA | 0.10 | NA | 0.47 |
| 1,3,7-trimethylurate | ME446871 | 2.41 | 0.63 | 1.90 | 0.71 | 0.01 | 0.15 | 0.19 | 0.16 |
| skatol | ME447643 | 2.33 | 0.37 | 2.53 | 0.47 | NA | NA | NA | NA |
| caprylate (8:0) | ME447156 | 2.40 | 0.47 | 2.28 | 0.33 | NA | 0.78 | 0.58 | 0.25 |
| 3-methylurate* | ME447014 | 1.70 | 0.54 | 2.03 | 0.68 | NA | 1.10 | 0.48 | 0.30 |
| theobromine | ME447676 | 1.91 | 0.72 | 2.01 | 0.57 | 0.10 | 1.20 | 1.10 | 0.44 |
| N-glycolylneuraminate | ME447502 | 2.81 | 0.60 | 1.43 | 0.26 | 0.20 | 0.78 | 0.31 | 0.99 |
| N-methyltaurine | ME447517 | 2.63 | 1.11 | 1.72 | 0.49 | NA | 0.83 | NA | 0.77 |
| 4-hydroxyphenylacetate | ME447034 | 2.66 | 0.88 | 1.14 | 0.51 | 0.63 | 1.11 | 0.61 | 0.49 |
| indoleacetate | ME447353 | 2.47 | 0.61 | 1.61 | 0.50 | 0.43 | 0.59 | 0.79 | 0.61 |
| glycerophosphoserine* | ME447303 | 0.71 | 0.56 | 1.15 | 0.71 | 2.45 | 1.31 | 1.46 | 2.43 |
| tryptophan | ME447696 | 0.88 | 0.78 | 1.20 | 0.73 | 1.80 | 1.42 | 1.22 | 2.05 |
| erythronate* | ME447249 | 0.80 | 0.76 | 1.62 | 0.70 | 1.51 | 0.82 | 1.67 | 1.98 |
| myo-inositol | ME447433 | 1.03 | 0.65 | 1.53 | 0.62 | 1.74 | 0.70 | 0.91 | 2.40 |
| ribitol | ME447621 | 0.57 | 0.83 | 1.31 | 0.88 | 1.63 | 0.50 | 0.83 | 2.39 |
| glycerophosphorylcholine (GPC) | ME447302 | 1.56 | 0.64 | 1.28 | 0.77 | 1.71 | 0.44 | 0.86 | 1.96 |
| N6,N6,N6-trimethyllysine | ME447445 | 2.21 | 0.41 | 1.35 | 0.57 | 1.69 | 0.50 | 1.11 | 1.76 |
| lysylleucine | ME447405 | 1.50 | 0.59 | 0.51 | 1.24 | 1.95 | 0.66 | NA | 2.19 |
| 3-hydroxybutyrate (BHBA) | ME446991 | 0.99 | 0.54 | 0.42 | 1.48 | 2.39 | 1.09 | 1.08 | 1.76 |
| 2,4,6-trihydroxybenzoate | ME446931 | 1.57 | 0.87 | 0.85 | 0.77 | 2.48 | 0.84 | 0.82 | 1.50 |
| glycerophosphoethanolamine | ME447299 | 1.09 | 0.63 | 1.12 | 1.04 | 1.90 | 1.12 | 0.69 | 1.59 |
| imidazole propionate | ME447349 | 1.97 | 0.61 | 0.70 | 0.53 | 0.74 | 1.16 | 1.48 | 2.96 |
| diaminopimelate | ME447212 | 0.80 | 0.94 | 0.74 | 0.71 | 0.60 | 1.40 | 1.40 | 2.97 |
| proline | ME447600 | 0.76 | 0.86 | 0.95 | 0.75 | 1.15 | 1.26 | 1.64 | 2.79 |
| ectoine | ME447237 | 1.27 | 0.68 | 0.50 | 1.23 | 0.80 | 0.60 | 1.66 | 2.22 |
| N(^1)-acetylspermidine | ME447437 | 1.75 | 0.58 | 0.98 | 0.89 | 0.79 | 0.71 | 1.72 | 1.60 |
| N-acetylproline | ME447477 | 1.53 | 0.88 | 0.72 | 0.70 | 0.64 | 1.10 | 1.89 | 1.93 |
| gamma-glutamylmethionine | ME447279 | 1.55 | 0.65 | 0.78 | 0.72 | 1.22 | 1.19 | 0.92 | 2.29 |
| malonate | ME447408 | 1.39 | 0.91 | 0.85 | 0.86 | 1.26 | 1.20 | 0.45 | 1.42 |
| cysteinylglycine | ME447193 | 1.29 | 0.64 | 0.85 | 0.75 | 1.41 | 1.34 | 0.35 | 1.95 |
| trimethylamine N-oxide | ME447694 | 1.31 | 1.02 | 0.64 | 0.65 | 1.38 | 1.52 | 0.41 | 1.99 |
| 3-hydroxy-3-methylglutarate | ME446990 | 0.96 | 0.37 | 0.90 | 1.51 | 0.69 | 0.76 | 0.84 | 2.38 |
| ribulose/xylulose | ME447625 | 1.15 | 0.65 | 1.08 | 1.20 | 0.52 | 0.56 | 0.24 | 2.32 |
| arabinose | ME447112 | 1.15 | 0.54 | 1.20 | 1.27 | 0.93 | 0.48 | 0.75 | 1.78 |
| propionylglycine | ME447603 | 0.94 | 0.71 | 0.97 | 0.99 | 0.96 | 0.91 | 1.24 | 1.86 |
| trans-4-hydroxyproline | ME447344 | 1.13 | 0.62 | 1.01 | 1.08 | 0.72 | 1.15 | 1.24 | 1.88 |
| N-monomethylarginine | ME447519 | 0.66 | 0.58 | 0.84 | 0.93 | 2.34 | 2.19 | 1.07 | 1.25 |
| 1-oleoyl-GPG (18:1)* | ME446904 | 0.45 | 0.31 | 1.51 | 1.15 | 1.17 | 1.68 | 1.92 | 0.38 |
| dihomo-linolenate (20:3n3 or n6) | ME447217 | 0.74 | 1.40 | 0.52 | 1.02 | 1.07 | 1.43 | 1.38 | 0.43 |
| tyrosylglycine | ME447703 | 0.62 | 1.02 | 0.58 | 1.07 | 1.70 | 2.05 | 1.58 | 0.48 |
| 5alpha-androstan-3alpha,17beta-diol disulfate | ME447047 | 2.23 | 0.69 | 0.92 | 0.64 | 1.17 | 1.89 | 1.46 | 0.81 |
| 4-guanidinobutanoate | ME447026 | 1.43 | 0.58 | 1.10 | 0.85 | 1.50 | 1.54 | 1.73 | 1.08 |
| N-acetyltyrosine | ME447485 | 1.39 | 1.06 | 0.84 | 0.62 | 1.20 | 1.77 | 1.41 | 0.82 |
| serine | ME447638 | 0.82 | 0.91 | 1.28 | 0.84 | 1.25 | 1.28 | 1.54 | 1.25 |
| threonine | ME447681 | 0.81 | 0.91 | 1.43 | 0.78 | 1.03 | 1.14 | 1.44 | 1.39 |
| glycerate | ME447296 | 0.84 | 0.75 | 1.39 | 0.89 | 1.08 | 1.28 | 1.82 | 1.29 |
| glycine | ME447304 | 0.70 | 0.80 | 1.47 | 0.89 | 1.38 | 1.13 | 1.70 | 1.29 |
| thymidine | ME447683 | 0.87 | 1.04 | 1.18 | 0.68 | 1.08 | 1.44 | 1.15 | 1.58 |
| cysteine sulfinic acid | ME447192 | 1.01 | 0.81 | 1.10 | 0.83 | 1.19 | 1.23 | 1.42 | 1.54 |
| isoleucine | ME447361 | 0.87 | 1.01 | 0.94 | 0.86 | 1.39 | 1.23 | 1.44 | 1.37 |
| 2^-deoxyinosine | ME446946 | 0.82 | 0.87 | 1.35 | 0.64 | 0.86 | 1.93 | 1.47 | 1.69 |
| 2-methylserine | ME446964 | 0.56 | 0.80 | 1.53 | 0.73 | 0.99 | 1.52 | 1.56 | 1.68 |
| 2^-deoxyuridine | ME446947 | 0.63 | 1.07 | 1.09 | 0.66 | 1.24 | 1.67 | 1.89 | 1.69 |
| 3-hydroxylaurate | ME446997 | 0.86 | 0.73 | 1.22 | 0.76 | 1.24 | 1.76 | 2.00 | 1.71 |
| 5-methylthioadenosine (MTA) | ME447067 | 0.89 | 0.67 | 0.97 | 0.89 | 1.27 | 1.68 | 1.27 | 1.49 |
| 3-hydroxydecanoate | ME446993 | 0.86 | 0.81 | 1.00 | 0.89 | 1.21 | 1.66 | 1.70 | 1.38 |
| glycylvaline | ME447317 | 0.79 | 0.98 | 0.75 | 0.92 | 0.98 | 1.76 | 1.67 | 1.48 |
| dimethylarginine (SDMA + ADMA) | ME447223 | 0.90 | 0.63 | 1.05 | 0.84 | 2.10 | 1.28 | 1.78 | 2.05 |
| valine | ME447716 | 0.71 | 1.03 | 0.93 | 0.72 | 2.11 | 1.11 | 2.06 | 1.87 |
| alanine | ME447090 | 0.78 | 0.94 | 0.94 | 0.81 | 1.91 | 1.26 | 1.85 | 1.67 |
| phenylalanine | ME447577 | 0.76 | 0.94 | 0.99 | 0.83 | 1.84 | 1.30 | 1.87 | 1.49 |
| glutamine | ME447292 | 0.81 | 0.86 | 1.17 | 0.79 | 1.72 | 1.33 | 2.27 | 1.31 |
| choline | ME447178 | 0.99 | 0.69 | 1.04 | 0.97 | 2.30 | 1.16 | 2.22 | 1.05 |
| dihomo-linolenoylcarnitine (20:3n3 or 6)* | ME447218 | 0.78 | 1.02 | 0.82 | 0.94 | 2.17 | 1.17 | 2.38 | 1.49 |
| 1-palmitoyl-GPE (16:0) | ME446916 | 0.81 | 0.92 | 0.80 | 1.10 | 1.75 | 1.22 | 1.47 | 1.02 |
| glycylleucine | ME447316 | 0.92 | 0.88 | 0.63 | 1.10 | 1.58 | 1.36 | 1.74 | 1.22 |
| leucine | ME447378 | 0.81 | 1.02 | 0.90 | 0.82 | 1.72 | 1.34 | 1.62 | 1.41 |
| citrulline | ME447185 | 0.75 | 1.07 | 0.74 | 0.94 | 1.48 | 1.39 | 1.62 | 1.31 |
| methionine | ME447420 | 0.80 | 0.99 | 0.87 | 0.85 | 1.51 | 1.49 | 1.82 | 1.41 |
| ceramide (d16:1/24:1, d18:1/22:1)* | ME447166 | 0.76 | 0.75 | 0.57 | 1.12 | 1.50 | 1.20 | 1.76 | 1.80 |
| tyrosine | ME447701 | 0.74 | 0.96 | 1.01 | 0.85 | 1.74 | 1.32 | 1.35 | 1.63 |
| vanillate | ME447723 | 0.61 | 0.87 | 0.78 | 0.98 | 1.64 | 1.11 | 1.25 | 1.77 |
| butyrylglutamine/isobutyrylglutamine | ME447147 | 0.89 | 0.90 | 0.61 | 1.01 | 1.39 | 1.34 | 1.29 | 1.80 |
| lysine | ME447404 | 0.83 | 0.92 | 0.86 | 0.80 | 1.61 | 1.53 | 1.51 | 1.93 |
| gamma-glutamyl-alpha-lysine | ME447271 | 0.72 | 0.82 | 0.74 | 1.03 | 2.37 | 1.46 | 1.40 | 1.68 |
| glutaminylleucine | ME447293 | 0.80 | 0.97 | 0.66 | 1.05 | 1.98 | 1.55 | 1.07 | 1.19 |
| threonylphenylalanine | ME447682 | 0.85 | 0.96 | 0.43 | 1.01 | 1.77 | 1.68 | 2.37 | 1.19 |
| isovalerate (i5:0) | ME447364 | 1.19 | 1.11 | 0.65 | 0.62 | 1.05 | 2.05 | 1.98 | 1.03 |
| phenylalanylglycine | ME447579 | 0.74 | 0.97 | 0.64 | 1.02 | 1.23 | 2.03 | 1.89 | 0.96 |
| valylglycine | ME447720 | 0.70 | 1.05 | 0.57 | 1.02 | 1.22 | 1.84 | 2.30 | 0.90 |
| gamma-glutamylleucine | ME447278 | 0.88 | 0.95 | 0.87 | 0.89 | 1.27 | 1.49 | 2.86 | 1.33 |
| N-behenoyl-sphingadienine (d18:2/22:0)* | ME447490 | 1.05 | 0.66 | 1.02 | 0.99 | 1.24 | 0.85 | 2.74 | 1.32 |
| N-formylphenylalanine | ME447501 | 0.87 | 1.03 | 0.92 | 0.88 | 1.37 | 0.87 | 2.67 | 1.04 |
| valerylglycine | ME447714 | 0.82 | 1.06 | 0.88 | 0.86 | 1.26 | 0.89 | 3.03 | 1.04 |
| 5-methyluridine (ribothymidine) | ME447068 | 0.68 | 1.13 | 1.19 | 0.75 | 0.90 | 1.19 | 2.06 | 0.93 |
| 4-ureidobutyrate | ME447041 | 0.81 | 1.22 | 0.83 | 0.85 | 0.77 | 1.02 | 2.44 | 0.96 |
| lithocholate | ME447400 | 0.66 | 1.17 | 0.80 | 1.00 | 1.39 | 0.80 | 2.31 | 0.87 |
| isobutyrylglycine | ME447359 | 0.92 | 1.05 | 0.83 | 0.94 | 1.11 | 0.88 | 2.33 | 0.95 |
| vanillin | ME447724 | 0.81 | 0.94 | 1.09 | 0.86 | 1.12 | 0.88 | 2.35 | 0.69 |
| glycylisoleucine | ME447315 | 0.90 | 0.98 | 0.72 | 1.05 | 1.07 | 1.31 | 1.75 | 1.08 |
| N-acetyl-beta-glucosaminylamine | ME447458 | 0.76 | 1.09 | 0.72 | 0.99 | 0.96 | 1.49 | 1.73 | 1.08 |
| 2-acetamidobutanoate | ME446937 | 0.97 | 1.06 | 0.74 | 0.88 | 1.06 | 1.18 | 1.65 | 1.40 |
| valerate (5:0) | ME447713 | 1.06 | 1.02 | 0.77 | 0.81 | 1.09 | 1.44 | 1.64 | 1.36 |
| isovalerylglycine | ME447365 | 0.97 | 1.08 | 0.95 | 0.96 | 0.99 | 0.75 | 1.73 | 0.89 |
| indole-3-carboxylic acid | ME447352 | 0.97 | 1.09 | 1.02 | 0.89 | 0.76 | 0.99 | 1.81 | 1.11 |
| S-1-pyrroline-5-carboxylate | ME447627 | 1.02 | 0.98 | 0.85 | 0.86 | 0.80 | 1.17 | 1.70 | 1.28 |
| 3-phenylpropionate (hydrocinnamate) | ME447016 | 0.84 | 1.02 | 0.69 | 0.96 | 1.18 | 1.15 | 2.17 | 1.56 |
| methionine sulfoxide | ME447422 | 0.82 | 1.09 | 0.65 | 1.00 | 1.14 | 1.07 | 1.99 | 1.32 |
| N-palmitoyl-sphingosine (d18:1/16:0) | ME447525 | 0.78 | 0.98 | 0.67 | 1.12 | 1.09 | 0.93 | 2.36 | 1.31 |
| tryptophylglycine | ME447698 | 0.73 | 1.03 | 0.63 | 1.09 | 1.08 | 1.08 | 2.24 | 1.04 |
| isoleucylglycine | ME447362 | 0.73 | 1.08 | 0.60 | 1.00 | 1.01 | 1.46 | 2.44 | 1.12 |
| valylleucine | ME447721 | 0.85 | 0.87 | 0.57 | 1.09 | 0.90 | 1.62 | 2.07 | 1.44 |
| N-methylphenylalanine | ME447514 | 0.45 | 1.19 | 1.21 | 1.02 | 1.33 | 0.27 | 2.24 | 0.41 |
| 3beta-hydroxy-5-cholestenoate | ME446984 | 0.40 | 1.44 | 0.36 | 1.48 | 1.75 | 0.52 | 1.86 | 0.26 |
| histidylalanine | ME447338 | 0.60 | 1.14 | 0.57 | 1.16 | 1.80 | 1.01 | 2.09 | 0.32 |
| N-acetylmethionine | ME447472 | 1.30 | 0.87 | 0.75 | 0.74 | 2.30 | 0.96 | 1.67 | 1.70 |
| N-acetyltryptophan | ME447484 | 1.33 | 0.78 | 0.79 | 0.79 | 2.52 | 1.37 | 1.85 | 1.08 |
| N-carbamoylalanine | ME447491 | 1.15 | 1.07 | 0.73 | 1.00 | 2.20 | 0.81 | 2.53 | 0.39 |
| leucylglutamine* | ME447380 | 0.66 | 0.89 | 0.64 | 1.14 | 2.79 | 1.30 | 1.87 | 0.90 |
| N6-acetyllysine | ME447446 | 0.94 | 0.98 | 0.84 | 0.79 | 2.70 | 1.03 | 2.46 | 0.97 |
| deoxycholate | ME447204 | 0.67 | 1.06 | 0.78 | 1.00 | 2.66 | 1.07 | 2.69 | 1.23 |
| linolenoylcarnitine (C18:3)* | ME447388 | 0.73 | 0.94 | 0.92 | 1.01 | 2.43 | 1.15 | 2.84 | 1.11 |
| 4-hydroxybenzoate | ME447027 | 0.89 | 0.87 | 1.83 | 0.77 | 1.96 | 0.47 | 1.37 | 0.95 |
| gamma-glutamylglutamine | ME447274 | 0.59 | 0.51 | 1.60 | 0.77 | 2.33 | 0.94 | 1.20 | 1.29 |
| 1-palmitoyl-GPC (16:0) | ME446915 | 0.97 | 0.72 | 1.57 | 0.85 | 2.90 | 0.45 | 1.70 | 0.82 |
| mevalonate | ME447429 | 1.45 | 0.55 | 1.36 | 0.82 | 2.30 | 0.81 | 1.44 | 1.01 |
| PAHSA (16:0/OH-18:0) | ME447552 | 0.89 | 0.87 | 0.43 | 1.46 | 1.48 | 0.17 | 1.13 | 0.96 |
| gamma-CEHC | ME447269 | 1.36 | 0.75 | 0.88 | 0.89 | 1.58 | 0.81 | 1.85 | 1.23 |
| pyrraline | ME447614 | 0.83 | 0.86 | 1.24 | 0.99 | 1.90 | 0.75 | 1.84 | 0.85 |
| N-acetylarginine | ME447454 | 0.93 | 1.05 | 1.12 | 0.82 | 1.70 | 0.89 | 1.82 | 0.84 |
| uracil | ME447705 | 0.78 | 1.09 | 0.97 | 0.96 | 1.52 | 0.89 | 1.76 | 0.90 |
| 9,10-DiHOME | ME447081 | 0.69 | 1.03 | 0.48 | 1.27 | 1.63 | 1.00 | 1.08 | 0.89 |
| 12,13-DiHOME | ME446877 | 0.86 | 0.96 | 0.47 | 1.34 | 1.71 | 0.63 | 1.45 | 1.03 |
| alanylleucine | ME447091 | 1.07 | 0.94 | 0.55 | 1.20 | 2.05 | 0.62 | 1.21 | 1.08 |
| 8-hydroxyoctanoate | ME447080 | 0.87 | 0.94 | 0.93 | 1.06 | 2.04 | 0.72 | 0.88 | 1.11 |
| methylphosphate | ME447426 | 0.90 | 0.87 | 0.87 | 1.15 | 1.73 | 0.75 | 1.30 | 1.17 |
| palmitoyl dihydrosphingomyelin (d18:0/16:0)* | ME447557 | 0.91 | 0.73 | 1.03 | 1.23 | 1.84 | 0.84 | 1.36 | 0.81 |
| phenylpyruvate | ME447581 | 0.71 | 0.75 | 1.22 | 1.34 | 2.29 | 0.71 | 1.70 | 0.67 |
| 2-hydroxyphenylacetate | ME446958 | 0.82 | 1.02 | 0.89 | 0.99 | 2.26 | 0.60 | 1.48 | 0.72 |
| alpha-methylornithine | ME447098 | 0.71 | 1.16 | 0.75 | 0.98 | 2.32 | 0.76 | 1.52 | 0.90 |
| formiminoglutamate | ME447260 | 0.86 | 1.14 | 0.81 | 0.92 | 2.44 | 0.81 | 1.55 | 1.10 |
| erucate (22:1n9) | ME447247 | 0.49 | 1.02 | 0.37 | 1.44 | 0.39 | 2.41 | 1.80 | 0.25 |
| solanidine | ME447646 | 0.74 | 1.32 | 0.73 | 0.79 | 0.25 | 2.42 | 1.07 | 0.48 |
| chenodeoxycholate | ME447173 | 0.40 | NA | 0.20 | 0.70 | 1.02 | 2.23 | 1.62 | 1.99 |
| gamma-glutamyl-epsilon-lysine | ME447272 | 0.66 | 0.90 | 1.10 | 0.82 | 0.91 | 2.01 | 1.06 | 1.86 |
| N6-carboxymethyllysine | ME447448 | 1.06 | 0.88 | 0.91 | 0.66 | 1.01 | 2.10 | 1.16 | 1.94 |
| N-formylmethionine | ME447500 | 0.92 | 0.89 | 0.63 | 0.77 | 1.37 | 1.91 | 2.10 | 1.99 |
| taurine | ME447667 | 1.09 | 0.87 | 0.42 | 0.91 | 1.25 | 2.16 | 1.44 | 1.73 |
| guanosine | ME447321 | 0.75 | 0.76 | 1.07 | 0.45 | 0.52 | 3.49 | 2.14 | 1.70 |
| 2^-deoxyguanosine | ME446945 | 0.72 | 0.72 | 1.25 | 0.48 | 0.88 | 2.85 | 2.00 | 2.37 |
| uridine | ME447707 | 0.63 | 0.94 | 0.93 | 0.60 | 1.02 | 2.57 | 2.13 | 2.02 |
| adenosine | ME447086 | 0.76 | 0.89 | 0.99 | 0.63 | 1.01 | 3.08 | 1.70 | 1.32 |
| cytidine | ME447195 | 1.00 | 0.58 | 1.57 | 0.51 | 0.41 | 2.93 | 1.65 | 1.73 |
| 3-hydroxyisobutyrate | ME446996 | 0.84 | 0.73 | 0.98 | 0.55 | 0.59 | 2.75 | 1.33 | 1.77 |
| guanine | ME447320 | 0.84 | 0.79 | 1.20 | 0.71 | 0.78 | 2.39 | 1.81 | 1.48 |
| inosine | ME447358 | 0.92 | 0.83 | 1.21 | 0.59 | 0.71 | 2.38 | 1.87 | 1.63 |
| N-acetyl-cadaverine | ME447459 | 2.61 | 0.42 | 1.24 | 0.45 | 0.32 | 1.02 | 2.31 | 1.14 |
| 1-stearoyl-GPI (18:0) | ME446925 | 2.03 | 0.59 | 0.93 | 0.62 | 0.50 | 1.79 | 2.52 | 1.66 |
| 7-methylurate | ME447077 | 1.75 | 0.54 | 1.12 | 0.41 | NA | 1.58 | 1.98 | 1.78 |
| 3-methylxanthine | ME447015 | 1.65 | 0.66 | 1.63 | 0.69 | NA | 0.92 | 1.78 | 0.44 |
| caprate (10:0) | ME447154 | 1.43 | 0.59 | 1.82 | 0.59 | 0.36 | 1.42 | 1.88 | 0.99 |
| N1-methyladenosine | ME446892 | 1.13 | 0.61 | 1.66 | 0.73 | 0.12 | 1.28 | 1.99 | 1.06 |
| asparagine | ME447122 | 0.95 | 0.84 | 1.49 | 0.48 | 0.49 | 1.91 | 2.55 | 1.53 |
| 5-dodecenoate (12:1n7) | ME447062 | 0.36 | 0.76 | 1.46 | 0.91 | 0.57 | 1.70 | 2.53 | 1.37 |
| myristoleate (14:1n5) | ME447435 | 0.37 | 0.78 | 1.40 | 1.01 | 0.45 | 1.35 | 2.60 | 1.63 |
| 2-hydroxyglutarate | ME446953 | 0.97 | 0.77 | 1.22 | 1.01 | 0.01 | 1.59 | 2.11 | 1.50 |
| 3-hydroxyphenylacetate | ME447000 | 0.69 | 1.04 | 0.78 | 0.77 | NA | 2.15 | 2.12 | 1.34 |
| N-palmitoylserine | ME447523 | 0.86 | 0.96 | 0.75 | 1.07 | 0.19 | 1.84 | 2.28 | 0.78 |
| tridecanedioate (C13-DC) | ME447692 | 0.78 | 1.31 | 0.76 | NA | NA | NA | NA | 0.84 |
| sertraline | ME447640 | 0.56 | 1.38 | 2.34 | 0.47 | NA | NA | NA | NA |
| stearidonate (18:4n3) | ME447653 | 0.05 | 1.57 | 2.50 | 0.71 | NA | 0.03 | NA | 0.11 |
| 5alpha-pregnan-3(alpha or beta),20beta-diol disulfate | ME447055 | 0.20 | 2.08 | 1.56 | 0.53 | 0.01 | 0.16 | 0.02 | 0.09 |
| caffeic acid sulfate | ME447151 | 0.13 | 1.57 | 1.26 | 1.05 | NA | NA | NA | 0.11 |
| 4-hydroxychlorothalonil | ME447029 | NA | 0.92 | NA | 1.11 | 1.28 | NA | 0.65 | NA |
| 2-hydroxyhippurate (salicylurate) | ME446954 | 0.53 | 0.38 | 0.16 | 1.99 | 0.92 | NA | 0.45 | 0.07 |
| biochanin A | ME447144 | 1.11 | NA | 0.12 | 1.32 | 0.57 | NA | 1.13 | NA |
| 3-hydroxyhippurate | ME446995 | 1.59 | 0.05 | 1.20 | 2.26 | 0.04 | 0.03 | NA | NA |
| phenylacetylglutamine | ME447575 | 1.45 | 0.08 | 0.73 | 2.16 | NA | 0.20 | 0.02 | 0.91 |
| (R)-salsolinol | ME446859 | 0.37 | 0.33 | 0.94 | 2.14 | NA | 1.36 | 0.15 | 0.51 |
| 4-methylcatechol sulfate | ME447038 | 0.36 | 0.85 | 0.53 | 1.83 | NA | 1.04 | NA | 0.83 |
| N2,N5-diacetylornithine | ME447443 | 0.70 | 0.63 | 0.77 | 1.78 | 0.29 | 1.12 | 0.37 | 0.67 |
| ergosterol | ME447245 | 0.47 | 0.92 | 0.47 | 1.92 | 0.58 | 0.35 | 0.18 | 1.09 |
| diglycerol | ME447215 | 0.63 | 1.07 | 0.50 | 1.71 | 0.40 | 0.64 | 0.51 | 0.60 |
| LAHSA (18:2/OH-18:0)* | ME447374 | 0.48 | 1.04 | 0.41 | 1.85 | 0.62 | 0.33 | 0.48 | 0.77 |
| OAHSA (18:1/OH-18:0) | ME447534 | 0.56 | 1.00 | 0.56 | 1.70 | 0.54 | 0.33 | 0.71 | 0.75 |
| m-tyramine | ME447432 | 0.43 | 0.58 | 0.65 | 2.12 | 0.08 | 0.13 | 0.17 | 0.19 |
| deoxycholic acid sulfate | ME447205 | 0.52 | 0.93 | 0.37 | 2.01 | NA | 0.52 | 0.00 | 0.38 |
| N-acetylserotonin | ME447480 | 0.53 | 1.00 | 0.74 | 1.75 | NA | 0.75 | NA | 0.24 |
| bufotenine | ME447146 | NA | 0.38 | NA | 2.46 | NA | 0.17 | NA | 0.89 |
| 1-linolenoyl-2-hexadecatrienoyl-galactosylglycerol (18:3/16:3) | ME446884 | 0.27 | 0.32 | NA | 2.41 | NA | 0.02 | 0.19 | 0.03 |
| hexanoylglycine | ME447334 | 0.46 | NA | 0.30 | 2.11 | NA | NA | 0.73 | NA |
| hippurate | ME447335 | 0.90 | 0.05 | 0.20 | 3.04 | 0.18 | 0.01 | 0.01 | 0.01 |
| N-acetylsphingosine | ME447481 | 0.29 | 0.38 | 0.22 | 3.12 | NA | 0.26 | 0.38 | 0.22 |
| lisinopril | ME447399 | 0.00 | 1.83 | 0.00 | 3.17 | NA | NA | NA | NA |
| 1,2,3-benzenetriol sulfate (1) | ME446863 | 0.05 | 1.93 | 0.02 | 2.21 | NA | 0.06 | 0.51 | NA |
| maltitol/lactitol/cellobiotol/palatinol | ME447410 | 0.03 | 2.03 | 0.13 | 2.19 | NA | NA | NA | 0.09 |
| saccharin | ME447628 | 0.29 | 1.93 | 0.08 | 1.87 | 0.06 | 0.08 | 0.15 | 0.02 |
| 5alpha-pregnan-3beta,20beta-diol monosulfate (1) | ME447059 | 0.23 | 1.97 | 0.38 | 1.50 | 0.05 | 0.58 | 0.08 | 0.31 |
| enterodiol | ME447241 | 0.25 | 1.76 | 0.41 | 1.43 | 0.31 | 0.38 | 0.49 | 0.13 |
| adenosine-2^,3^-cyclic monophosphate | ME447087 | NA | 1.74 | 0.06 | 1.40 | NA | NA | NA | 0.05 |
| hydrochlorothiazide | ME447342 | 0.10 | 1.35 | 0.58 | 1.62 | NA | NA | NA | NA |
| sucralose | ME447662 | 0.17 | 1.67 | 0.37 | 1.72 | 0.01 | 0.24 | 0.04 | 0.19 |
| 5alpha-pregnan-3beta-ol,20-one sulfate | ME447060 | 0.77 | 1.96 | 0.74 | 0.59 | NA | 0.82 | NA | 0.83 |
| pregnanolone/allopregnanolone sulfate | ME447596 | 0.33 | 2.26 | 0.34 | 0.81 | NA | 0.36 | NA | 0.43 |
| steviol | ME447656 | 0.44 | 1.84 | 0.14 | 0.94 | 0.09 | 0.64 | NA | 0.81 |
| 5alpha-pregnan-3beta,20alpha-diol monosulfate (2) | ME447058 | 0.81 | 2.09 | 0.56 | 1.17 | NA | 0.16 | NA | 0.11 |
| homovanillate sulfate | ME447340 | 0.29 | 2.02 | 0.83 | 0.79 | 0.63 | 0.27 | NA | 0.13 |
| ciliatine (2-aminoethylphosphonate) | ME447180 | 0.85 | 0.56 | 0.91 | 0.93 | 0.43 | 7.83 | 0.30 | NA |
| diphenhydramine | ME447228 | 1.60 | 0.71 | 0.56 | 0.42 | 0.03 | 9.14 | NA | 0.17 |
| ursocholate | ME447709 | 0.43 | 0.42 | 0.13 | 0.27 | 0.26 | 7.49 | 1.38 | 4.18 |
| indolelactate | ME447355 | 0.78 | 0.34 | 0.36 | 0.45 | 2.67 | 3.45 | 0.46 | 5.04 |
| (15:2)-anacardic acid | ME446858 | 0.08 | 0.17 | 1.78 | 0.33 | NA | 5.05 | NA | 7.47 |
| maltotriose | ME447414 | 0.17 | 0.17 | 1.18 | 0.13 | 0.04 | 4.40 | NA | 5.88 |
| 1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6) | ME446906 | 0.19 | 0.27 | 0.84 | 0.19 | 11.16 | 0.14 | 7.66 | 0.05 |
| lactate | ME447369 | 0.33 | 0.36 | 1.31 | 0.43 | 13.51 | 0.80 | 0.60 | 1.49 |
Factors:
| F1 | Gender:Female | Timepoint:Baseline | CBT_Responder:No |
| F2 | Gender:Female | Timepoint:Baseline | CBT_Responder:Yes |
| F3 | Gender:Female | Timepoint:Post_CBT | CBT_Responder:No |
| F4 | Gender:Female | Timepoint:Post_CBT | CBT_Responder:Yes |
| F5 | Gender:Male | Timepoint:Baseline | CBT_Responder:No |
| F6 | Gender:Male | Timepoint:Baseline | CBT_Responder:Yes |
| F7 | Gender:Male | Timepoint:Post_CBT | CBT_Responder:No |
| F8 | Gender:Male | Timepoint:Post_CBT | CBT_Responder:Yes |