Data for (Study ST003280)
(Analysis AN005373)Values for each metabolite have been scaled by dividing by the mean across all factors Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study| Metabolite | F1 | F2 | F3 | F4 |
|---|---|---|---|---|
| 1-[1-(1-Benzothiophen-2-yl)ethyl]urea | 1.0750 | 0.9502 | 0.6245 | 1.1833 |
| 1,1^-(3,5-Pyridinediyl)di(1-decanone) | 1.5010 | 0.9062 | 1.0522 | 0.7899 |
| 11-Aminoundecanoic acid | 0.9955 | 1.1313 | 0.8089 | 0.9940 |
| 1,1-Diethoxy-3-(methylthio)propane | 0.9536 | 1.0885 | 0.7138 | 1.0975 |
| 11-(Hydroxymethyl)-4,4,6b,8a,11,12b,14b-heptamethyl-1,2,3,4,4a,5,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydro-3-picenyl 4-aminobenzoate | 1.1721 | 1.0328 | 1.8364 | 0.7716 |
| 11-Nitro-1-undecene | 1.0504 | 1.1485 | 0.7748 | 0.8914 |
| 1-(1Z-hexadecenyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine | 1.9379 | 0.7031 | 0.2363 | 0.8016 |
| 1-(1Z-hexadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine | 1.4942 | 0.8298 | 0.9143 | 0.9196 |
| 1-(1Z-hexadecenyl)-2-oleoyl-sn-glycero-3-phosphoethanolamine | 1.4463 | 1.0574 | 0.6644 | 0.7175 |
| 1,26-Hexacosanediyl (2E,2^E)bis[3-(3,4-dihydroxyphenyl)acrylate] | 1.1235 | 0.7126 | 0.5958 | 1.4382 |
| 1_2-Diaminobenzene | 1.0595 | 1.0470 | 1.2775 | 0.9494 |
| 1,2-Dihydropyrimidine | 1.2139 | 1.0638 | 0.5393 | 0.9079 |
| 1_2-Dihydrovomilenine | 0.4888 | 0.3660 | 1.7579 | 2.2327 |
| 1-{3-Hydroxy-3-[(2E,4E,6Z,8E,10E,12E,14Z,16E)-6,11,15-trimethyl-17-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8,10,12,14,16-heptadecaoctaen-2-yl]-2-oxiranyl}ethanone | 0.7049 | 0.8676 | 1.0914 | 1.5333 |
| 1,4-Dimethylimidazole | 0.8805 | 1.1197 | 0.8393 | 1.0913 |
| (14E)-3-Ethyl-7-hydroxy-2,8,12,16-tetramethyl-5,13-dioxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-9-yl 2-O-butyryl-3,4,6-trideoxy-3-(dimethylamino)hexopyranoside | 0.9827 | 0.9912 | 1.2102 | 1.1034 |
| 1-(4-Hydroxyphenyl)-2-aminoethanol | 0.9327 | 1.1813 | 1.0605 | 0.9306 |
| 1_4-Lactone | 0.9729 | 1.1305 | 0.8938 | 0.9691 |
| 1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine | 0.4751 | 1.7589 | 1.3883 | 0.5705 |
| 1,5-Dimethylbicyclo(3.2.1)octan-8-one oxime | 1.6356 | 0.7654 | 1.1978 | 0.8105 |
| 17-amino-5?-androstan-11-ol | 1.0206 | 0.8738 | 1.2357 | 1.1829 |
| 17-OXO DEXAMETHASONE | 0.9448 | 0.9472 | 1.1267 | 1.2017 |
| 1_8-Diazacyclotetradecane-2_9-dione | 0.9528 | 1.2609 | 0.6406 | 0.8806 |
| 1-[(9Z)-octadecenoyl]-2-tetradecanoyl-sn-glycero-3-phosphocholine | 1.1684 | 0.6554 | 0.6610 | 1.4649 |
| 1-Aminocyclopropane-1-carboxylate | 1.6834 | 0.8359 | 0.3890 | 0.8316 |
| 1-Ethyl-1H-pyrrole-2-carboxaldehyde | 1.4901 | 0.9931 | 0.6622 | 0.7345 |
| 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine | 1.1869 | 1.3846 | 0.5781 | 0.5506 |
| 1-Linoleoylglycerophosphocholine | 0.3997 | 1.7417 | 1.4167 | 0.6535 |
| 1-Methylguanine | 1.1227 | 1.3195 | 0.8589 | 0.6416 |
| 1-Methylpyrrolinium | 1.1052 | 1.2969 | 1.6288 | 0.5208 |
| 1-myristoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine | 1.2970 | 1.0238 | 0.9177 | 0.8459 |
| 1-Nitrosopiperidine | 0.9329 | 1.1471 | 1.4238 | 0.9193 |
| 1-oleoyl-2-linoleyl-sn-glycero-3-phosphoethanolamine | 1.4370 | 1.2737 | 0.3298 | 0.5112 |
| 1-Oleoylglycerophosphocholine | 0.4824 | 1.7214 | 1.3624 | 0.6156 |
| 1-Palmitoylglycerophosphocholine | 0.5332 | 1.7306 | 1.4547 | 0.5442 |
| 1-Phenylethylamine | 1.0142 | 1.2015 | 0.9293 | 0.8268 |
| 1-Pyrroline | 0.7068 | 1.3454 | 0.5549 | 1.0148 |
| (1S,6S)-6-Aminooctahydro-1-indolizinyl acetate | 0.7049 | 1.2373 | 0.5887 | 1.1509 |
| 1-tetradecyl-2-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine | 1.1723 | 0.7162 | 0.6832 | 1.3794 |
| (1Z,3S,4Z,6S,7E,9S,15aR)-9-sec-Butyl-1,4,7-trihydroxy-3-[(6R)-6-hydroxyoctyl]-6-[(1-methoxy-1H-indol-3-yl)methyl]-3,6,9,12,13,14,15,15a-octahydro-10H-pyrido[1,2-a][1,4,7,10]tetraazacyclododecin-10-one | 0.9892 | 1.1167 | 0.9453 | 0.9794 |
| 2-[(11Z,14Z)-icosadienoyl]-sn-glycero-3-phosphoethanolamine | 1.0902 | 1.1040 | 1.4582 | 0.8223 |
| 2-(1-Methyl-2-piperidinyl)-1-phenylethanol | 0.9666 | 0.9078 | 1.9989 | 1.1018 |
| 2-[(1Z)-1,2-Diamino-1-propen-1-yl]phenol | 1.2026 | 0.8747 | 0.8987 | 1.1164 |
| 2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxamide | 0.9187 | 1.3388 | 1.0331 | 0.7453 |
| 2-[(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-Nonamethyl-2,6,10,14,18,22,26,30,34-hexatriacontanonaen-1-yl]-1,4-naphthoquinone | 1.2491 | 0.6861 | 0.5552 | 1.3729 |
| 2,2^-Iminodipropan-1-ol | 0.7750 | 1.3199 | 1.1405 | 0.8900 |
| 2_2^-Iminodipropanoate | 0.6529 | 1.2924 | 1.7225 | 0.9273 |
| 2,3-Bis(octanoyloxy)propanimidic acid | 0.6989 | 1.2323 | 0.9195 | 1.1097 |
| 2_3-Bis-O-(geranylgeranyl)glycerol1-phosphate | 1.1913 | 1.3930 | 0.4796 | 0.5501 |
| 2,3-Diethyl-5-methylpyrazine | 1.0749 | 0.9335 | 1.3989 | 1.0570 |
| 2,3-Dimethoxy-5-methyl-6-(3-methyl-2-buten-1-yl)-1,4-benzenediol | 0.8508 | 1.1124 | 1.1446 | 1.0838 |
| 246I1D7TDL | 1.0196 | 0.7287 | 1.2001 | 1.3969 |
| 2,4,6-triaminotoluene | 0.8276 | 1.3407 | 0.6634 | 0.9011 |
| 2,4-Diaminotoluene | 0.9940 | 0.8895 | 1.4977 | 1.1453 |
| 2,4-DIMETHYL-2-IMIDAZOLINE | 0.9637 | 1.1002 | 0.9096 | 1.0284 |
| 2,4-Dimethyl-5,6,7,8-tetrahydroquinoline | 1.0732 | 0.8762 | 1.2343 | 1.1587 |
| 2-(4-Methylthiazol-5-yl)ethyl decanoate | 0.8739 | 0.8625 | 1.0605 | 1.3707 |
| (24R_24^R)-Fucosterolepoxide | 0.7928 | 1.3994 | 0.6583 | 0.8612 |
| 2,5-Diethyl-3,6-dimethylpyrazine | 1.4222 | 0.9993 | 1.8399 | 0.5953 |
| 2-[(5Z,8Z,11Z)-icosatrienoyl]-sn-glycero-3-phosphoethanolamine | 0.7285 | 1.6419 | 0.9600 | 0.5621 |
| (2,7-Dimethyloctahydro-1H-cyclopenta[c]pyridin-4-yl)methanol | 1.0599 | 0.9118 | 0.8644 | 1.1999 |
| 2-Amino-3-hydroxy-15-methyl-1-hexadecanesulfonic acid | 1.1091 | 0.9172 | 1.1322 | 1.0908 |
| 2-Amino-3-hydroxyoctadecyl beta-D-glucopyranoside | 1.2720 | 0.7633 | 1.3538 | 1.1171 |
| 2-Amino-4-[(3-aminopropyl)amino]butanoic acid | 0.8182 | 1.0364 | 1.8652 | 1.0573 |
| 2-Aminoacetophenone;O-Acetylaniline | 0.9011 | 0.9165 | 0.8837 | 1.3201 |
| 2-Aminophenol | 1.0400 | 0.8514 | 1.0610 | 1.2550 |
| (2-Chlorophenyl)diphenylmethanol | 0.6952 | 1.6073 | 0.7552 | 0.6610 |
| 2-Deoxy-2-(dimethylamino)-alpha-D-glucopyranose | 0.9914 | 0.8980 | 0.6800 | 1.2749 |
| 2-Dimethylamino-5,6-dimethyl-4-hydroxypyrimidine | 0.8368 | 1.2531 | 1.2464 | 0.8943 |
| (2E)-1-(4-Hydroxyphenyl)-3-(5-methoxy-2,2-dimethyl-2H-chromen-6-yl)-2-propen-1-one | 1.0702 | 1.0800 | 2.5756 | 0.6755 |
| (2E)-2,3-Diphenyl-3-(2-pyridinyl)acrylonitrile | 1.2575 | 1.2011 | 0.8051 | 0.6772 |
| (2E,4E,16Z)-1-(1-Piperidinyl)-2,4,16-icosatrien-1-one | 1.1096 | 0.8570 | 1.3808 | 1.1232 |
| (2E,4Z,12E)-1-(1-Piperidinyl)-2,4,12-octadecatrien-1-one | 1.2249 | 1.0411 | 1.0547 | 0.8476 |
| (2E,4Z)-N-Isobutyl-2,4-decadienamide | 0.9517 | 0.6106 | 1.3843 | 1.5810 |
| (2E,6Z)-N-Cyclopropyl-2,6-nonadienamide | 0.9069 | 1.2991 | 0.4435 | 0.9213 |
| (2E,6Z)-N-Ethyl-2,6-nonadienamide | 0.9066 | 0.8205 | 1.2799 | 1.3697 |
| (2E)-hexadecenoylcarnitine | 0.6280 | 0.6023 | 0.8491 | 1.9665 |
| 2-Ethyl-2-phenylmalonamide | 0.7139 | 1.2083 | 1.5154 | 1.0244 |
| 2-Ethyl-4,5-dimethylthiazole | 1.1288 | 0.5448 | 1.7231 | 1.4502 |
| 2-Hexenoylcarnitine | 0.9308 | 1.2028 | 1.3987 | 0.8647 |
| 2-(Hydroxymethyl)-1-methyl-3,4,5-piperidinetriol | 1.0501 | 1.0012 | 0.9333 | 1.0792 |
| 2-Hydroxyphenethylamine | 1.1115 | 0.9509 | 1.1430 | 1.0432 |
| 2-Isobutoxypyrazine | 1.3831 | 0.6886 | 1.9694 | 0.9981 |
| 2-Isobutyl-3-methoxypyrazine | 1.3054 | 0.9292 | 0.9359 | 0.9229 |
| 2-Isopropyl-3-methoxypyrazine | 0.7757 | 1.2855 | 1.5177 | 0.8539 |
| 2-Methyl-5-vinylpyrazine | 0.8185 | 0.6447 | 3.9297 | 1.2196 |
| 2-Methyl-6-undecylpiperidine | 1.2183 | 0.6131 | 1.1112 | 1.3880 |
| 2-Methylcholine | 0.9408 | 1.0910 | 0.8788 | 1.0721 |
| 2-Methylnicotinamide | 0.9100 | 0.7702 | 0.7969 | 1.5042 |
| 2-MethylpropanalO-methyloxime | 1.0409 | 0.9370 | 1.4185 | 1.0713 |
| 2-Methylpropanaloxime | 1.2905 | 0.8944 | 0.7584 | 1.0325 |
| 2-Methylpropanamine | 0.9784 | 1.2798 | 1.1074 | 0.7483 |
| 2-Methylpyrrolidine | 0.7509 | 1.2443 | 0.3189 | 1.1257 |
| 2-Oxo-3-(phosphonooxy)propyl formate | 1.0153 | 1.2664 | 0.9316 | 0.7578 |
| 2P5MU968XW | 0.8294 | 1.2121 | 0.9270 | 1.0000 |
| 2-Pentyl-1,3-thiazolidine | 0.5480 | 1.2777 | 2.0071 | 0.9980 |
| 2-Pentylpyridine | 1.0671 | 1.3019 | 1.5589 | 0.5564 |
| 2-Phenylcyclopropanamine | 1.1615 | 0.8088 | 1.2250 | 1.1719 |
| 2-Pipecoline | 1.0597 | 0.9425 | 0.6324 | 1.1956 |
| 2-Piperazinecarboxylic acid | 1.1316 | 0.8243 | 1.1847 | 1.1756 |
| (2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-docosapentaenoate | 0.8718 | 1.6377 | 0.5821 | 0.5064 |
| (2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoate | 0.3592 | 2.0325 | 1.3565 | 0.3351 |
| (2R)-1-(Phosphonooxy)-3-[(9Z)-9-tetradecenoyloxy]-2-propanyl (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoate | 1.1325 | 0.6858 | 0.9789 | 1.3917 |
| (2R)-2-{[(2R)-2-{[(2S,3R,4R,5S,6R)-3-Acetamido-2,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl]oxy}propanoyl]amino}propanoic acid | 1.0497 | 0.6987 | 1.4227 | 1.3616 |
| (2R)-2-[(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-Icosapentaenoyloxy]-3-(stearoyloxy)propyl 2-(trimethylammonio)ethyl phosphate | 1.0205 | 1.5940 | 0.3500 | 0.4727 |
| (2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(1Z,11Z)-1,11-octadecadien-1-yloxy]propyl (9Z)-9-tetradecenoate | 1.8239 | 0.6126 | 0.3749 | 0.9898 |
| (2R)-3-(Phosphonooxy)-2-(tetradecanoyloxy)propyl (9Z)-9-tetradecenoate | 1.4189 | 1.0302 | 0.8173 | 0.7484 |
| 2S-Amino-tridecanoic acid | 0.9202 | 0.7101 | 1.0055 | 1.5432 |
| (2Z,4E)-1-(1-Piperidinyl)-2,4-icosadien-1-one | 1.2520 | 0.8401 | 0.8797 | 1.1168 |
| 3-(1-Piperazinyl)benzisothiazole | 1.0629 | 1.2966 | 0.8139 | 0.7299 |
| 3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one | 1.1058 | 1.2385 | 1.0148 | 0.7024 |
| 3-(3,4,5-trimethoxyphenyl)propanoic acid | 1.0778 | 1.2361 | 1.5136 | 0.6319 |
| 3-[(6-Oxodecanoyl)oxy]-4-(trimethylammonio)butanoate | 0.8221 | 0.9296 | 1.1713 | 1.3397 |
| 3-(7^-Hydroxy-4b^,8^,8^,10a^-tetramethyl-5-oxotetradecahydro-2^H-spiro[furan-3,1^-phenanthren]-2^-yl)-1-(4-methyl-5-oxotetrahydro-2-furanyl)-2-butanyl acetate | 0.8995 | 0.9567 | 1.2495 | 1.2093 |
| 3-Amino-3-(4-hydroxyphenyl)propanoate | 0.5566 | 1.4452 | 0.4907 | 1.0385 |
| 3-Amino-5,7-dimethyl-1-adamantanol | 1.0081 | 0.6098 | 0.9870 | 1.5947 |
| 3-Carboxy-1-methylpyridinium;N-Methylnicotinicacid | 0.8643 | 1.4721 | 0.8662 | 0.6716 |
| 3-Dehydroxycarnitine | 1.0020 | 0.9459 | 1.7569 | 1.0321 |
| (3E,5E,7E,9E,11E,13E,15E,17Z,19E)-5,9,14,18-Tetramethyl-20-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3,5,7,9,11,13,15,17,19-icosanonaen-2-one | 0.9131 | 0.9688 | 2.0604 | 1.0592 |
| 3-Epihydroxy-2^-deoxymugineicacid | 0.8906 | 0.7947 | 1.1440 | 1.4424 |
| 3-Guanidinopropanoate | 1.8798 | 0.7523 | 0.3073 | 0.7795 |
| 3-(Isothiocyanatomethyl)-1H-indole | 0.9083 | 0.8276 | 0.7106 | 1.4688 |
| 3-Methyl-3-phenylazetidine | 1.0326 | 0.7358 | 1.6036 | 1.3102 |
| 3-Methylbut-2-enal | 0.9430 | 1.3361 | 1.0700 | 0.7403 |
| 3-Methylcrotonylglycine | 1.1016 | 0.6820 | 0.8363 | 1.4329 |
| 3-Methylcyclopentene | 0.7736 | 1.3631 | 0.6252 | 0.9162 |
| 3-Phosphonooxypyruvate | 0.9039 | 0.9818 | 1.2568 | 1.1727 |
| (3R)-beta-Leucine | 0.7710 | 1.3076 | 1.2016 | 0.8914 |
| 3-(tert-butyl)-1-methyl-4,5-dihydro-1H-pyrazol-5-one | 0.7609 | 1.1431 | 0.8302 | 1.1240 |
| (3Z,6E)-N-Hydroxy-2,4,4,7-tetramethyl-6,8-nonadien-3-imine | 1.0269 | 0.7368 | 1.2070 | 1.3815 |
| 4-(1,2,3-thiadiazol-4-yl)phenyl pivalate | 0.8819 | 1.3703 | 1.3164 | 0.6704 |
| 4-(1,2-Dihydroxy-2-propanyl)-1-methyl-1,2-cyclohexanediol | 0.9927 | 1.1038 | 0.6322 | 1.0498 |
| 4-(1-D-Ribitylamino)-5-amino-2_6-dihydroxypyrimidine | 0.5029 | 1.4911 | 1.6789 | 0.8010 |
| 4-[(1S)-1-Cyclohexyl-2-(2-piperidinyl)ethyl]cyclohexanol | 1.0045 | 0.6417 | 0.9378 | 1.5680 |
| 4^-(2-{[3-(9H-Carbazol-4-yloxy)-2-hydroxypropyl]amino}ethoxy)-3^-methoxy-4-biphenylol | 0.8864 | 0.9809 | 1.0988 | 1.2184 |
| 4-[(2-Hydroxy-4-methylpentanoyl)amino]-7-isobutyl-3-isopropyl-5,8-dioxo-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),12,15-triene-10-carboxylic acid | 1.5788 | 0.5097 | 0.6467 | 1.2843 |
| 4-(3,5-Diphenylcyclohexyl)phenol | 1.4187 | 0.7836 | 0.7696 | 1.0447 |
| 4,4^-diapolycopen-4-al | 1.1881 | 0.8143 | 1.4675 | 1.1141 |
| 4,6-Diamino-5-formamidopyrimidine | 1.1221 | 1.4384 | 0.4417 | 0.5631 |
| (4-amino-1,2,5-oxadiazol-3-yl)(1-pyrrolidinyl)methanone oxime | 1.0744 | 1.0681 | 0.9296 | 0.9832 |
| 4-Aminopyridine | 1.3094 | 1.0977 | 0.6670 | 0.7474 |
| 4-(beta-Acetylaminoethyl)imidazole | 1.7313 | 0.7192 | 0.6984 | 0.8614 |
| 4-Guanidinobutanal | 0.8324 | 1.1535 | 0.4557 | 1.1547 |
| 4-(hydroxylamino)-N,N-dimethylaniline | 1.0214 | 1.3051 | 0.8119 | 0.7547 |
| 4-Hydroxy-L-threonine | 1.1802 | 0.7687 | 0.8186 | 1.2837 |
| 4-Hydroxymethylphenylhydrazine | 0.9893 | 1.0680 | 0.9280 | 1.0410 |
| 4-Imidazolemethanol | 1.8357 | 1.0225 | 0.1191 | 0.4760 |
| 4-Methoxyaniline | 1.0166 | 0.9144 | 1.3046 | 1.1408 |
| 4-Methyl-2-propyloxazole | 1.1499 | 0.8611 | 1.4636 | 1.0693 |
| (4-methylphenyl)[4-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperazino]methanone | 1.0650 | 1.2987 | 1.1492 | 0.6402 |
| 4-Nitroaniline | 1.0434 | 0.9868 | 0.5932 | 1.1700 |
| (4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate | 1.0090 | 1.1295 | 1.7581 | 0.8253 |
| (4S)-4-hydroxy-3,5,5-trimethyl-4-[(1E)-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-1-en-1-yl]cyclohex-2-en-1-one | 0.4597 | 0.4193 | 1.0444 | 2.3112 |
| 4-Trimethylammoniobutanal | 1.0266 | 1.0571 | 1.0703 | 0.9883 |
| 4-Vinylpyridine | 0.9982 | 1.0329 | 1.2595 | 1.0279 |
| 5,5^,6,6^-Tetrahydro-3^,6^-epoxy-beta,beta-carotene-3,5,5^,6-tetrol | 0.8062 | 1.3367 | 1.0357 | 0.8476 |
| 5,6-Dichloro-1,3-cyclohexadiene | 1.0895 | 0.5547 | 1.0817 | 1.5848 |
| 5-Aminopentanamide | 1.0895 | 0.9595 | 1.4914 | 0.9887 |
| 5-Ethyl-4-methyl-2-octylthiazole | 1.0175 | 1.0664 | 1.4333 | 0.9344 |
| 5-Methoxybenzimidazole | 1.3569 | 0.8844 | 0.3858 | 1.0489 |
| 5-Methoxy-N_N-dimethyltryptamine | 0.7800 | 1.3945 | 1.1105 | 0.8058 |
| 5-Methyl-4-pentyl-3,4-dihydro-2H-pyrrole | 0.9477 | 1.1118 | 1.3992 | 0.9507 |
| (5S)-5-hydroxy-1,7-diphenylheptan-3-one | 0.7037 | 0.6847 | 1.0470 | 1.7478 |
| 5-Undecyl-1,2-dihydro-3H-pyrrol-3-one | 1.1181 | 0.8271 | 1.0028 | 1.2104 |
| 6-[(1Z)-1-Propen-1-yl]-2,3,4,5-tetrahydropyridine | 1.1757 | 0.7189 | 0.9661 | 1.3105 |
| 6-{[2-(2-oxo-1-imidazolidinyl)ethyl]amino}-2-pyridinecarbonitrile | 1.1722 | 1.0785 | 0.3367 | 0.9403 |
| 6^-Apo-y-caroten-6^-al | 0.8933 | 1.0267 | 0.7603 | 1.1875 |
| 6-fluoro-3,4-dihydro-2H-pyrano[2,3-b]quinolin-5-amine | 0.8846 | 0.9503 | 1.0549 | 1.2787 |
| 6-Methylnicotinamide | 1.2115 | 0.9935 | 0.8854 | 0.9632 |
| 6-methyltetrahydropterin | 1.0935 | 1.3205 | 1.0342 | 0.6366 |
| 7-(1-Ethoxyethoxy)-4,10-dimethyl-3,5,9,11-tetraoxatridecane | 1.3082 | 0.9804 | 1.2080 | 0.8207 |
| 7_8-Diaminononanoate | 0.8534 | 1.2926 | 1.9132 | 0.7063 |
| (7alpha,18S,20R)-12,20-Cycloormosanine | 1.4220 | 0.6997 | 0.9891 | 1.1321 |
| 7-chloro-2-methyl-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydroquinazolin-4-one | 0.9869 | 1.3422 | 0.8755 | 0.7006 |
| 8-methylthiooctanaldoxime | 0.1529 | 2.4238 | 0.5141 | 0.1659 |
| 9,19-Cyclolanost-24-en-3-yl (2E)-3-(3,4-dihydroxyphenyl)acrylate | 0.6438 | 1.4492 | 1.3663 | 0.8092 |
| (9alpha,11alpha,13E,15S)-5,6,9,11,15-Pentahydroxyprost-13-en-1-oic acid | 0.8338 | 0.7122 | 1.3374 | 1.5653 |
| (9cis,13^cis)-3,3^-Dihydroxy-7,8-didehydro-beta,beta-carotene-4,4^-dione | 1.5169 | 0.7609 | 3.6652 | 0.5119 |
| 9-Decenoylcarnitine | 1.7230 | 0.9713 | 0.6244 | 0.5863 |
| Acetoneoxime | 1.0512 | 1.4160 | 0.2684 | 0.6771 |
| Acetylcadaverine | 0.8568 | 1.1946 | 1.7283 | 0.8658 |
| Acetyl-L-carnitine | 0.6226 | 1.8612 | 0.0759 | 0.5314 |
| Acmimycin | 0.8732 | 1.1579 | 0.9802 | 1.0294 |
| Adenine | 1.1809 | 0.6877 | 0.6732 | 1.4087 |
| afegostat | 1.0904 | 1.0316 | 0.6177 | 1.0386 |
| AL9450000 | 0.9946 | 1.0955 | 1.0190 | 0.9866 |
| Ala-Pro(Alanyl-Proline) | 1.0235 | 1.2677 | 0.5538 | 0.8346 |
| Alfentanil | 1.0235 | 1.0577 | 1.4754 | 0.9520 |
| Alimemazine | 1.7178 | 0.8463 | 0.8550 | 0.7079 |
| allopurinol | 1.1208 | 1.3201 | 0.6207 | 0.6817 |
| .alpha.-Naphthylthiourea | 1.0463 | 1.2837 | 0.8258 | 0.7586 |
| Amide C18 | 1.1094 | 0.6448 | 1.2999 | 1.4091 |
| Amide C22 | 1.0052 | 0.7706 | 1.1426 | 1.3712 |
| Amidrine | 0.7653 | 1.3755 | 0.8660 | 0.8718 |
| ammodendrine | 1.6741 | 0.9605 | 0.2918 | 0.6497 |
| Amorolfine | 0.9967 | 0.9114 | 1.0579 | 1.2080 |
| Amphetamine | 1.1332 | 1.1855 | 1.8088 | 0.6188 |
| Anatabine | 0.9234 | 1.1218 | 1.2327 | 0.9895 |
| Aphylline | 1.3074 | 0.7128 | 0.9511 | 1.1670 |
| APM | 1.0966 | 0.9451 | 1.3062 | 1.0319 |
| ARECOLINE | 0.8880 | 1.1210 | 1.2588 | 1.0005 |
| arg-asn | 1.1912 | 0.7674 | 0.6780 | 1.2899 |
| aspergillic acid | 0.3550 | 0.2872 | 0.5456 | 2.6529 |
| Atagabalin | 1.2989 | 0.8154 | 1.6378 | 0.9254 |
| Atipamezole | 0.8376 | 1.4371 | 0.9601 | 0.7264 |
| axitirome | 1.7207 | 0.9109 | 0.7390 | 0.6480 |
| Bamethan | 0.8141 | 1.8153 | 0.7177 | 0.3140 |
| Benzamidine | 1.2196 | 0.9884 | 0.8341 | 0.9659 |
| Benzylamine | 1.0277 | 1.0964 | 0.8030 | 0.9794 |
| Bethanidine | 2.0938 | 0.6175 | 0.6539 | 0.6996 |
| Bis(2-chloroethyl)amine | 0.8554 | 1.4254 | 0.9128 | 0.7116 |
| (-)-Borneol | 0.8961 | 0.9647 | 1.9820 | 1.0904 |
| BORRELINE | 1.2568 | 0.6183 | 0.9206 | 1.3899 |
| Buclizine | 1.3001 | 0.7411 | 0.2316 | 1.3137 |
| butoctamide | 1.1758 | 1.0693 | 1.0122 | 0.8824 |
| C18-Carnitine | 1.0896 | 1.0549 | 1.0652 | 0.9656 |
| (+)-calycanthidine | 1.1063 | 1.1435 | 1.4819 | 0.7705 |
| Calystegin B2 | 1.1530 | 1.2705 | 0.8226 | 0.6491 |
| Caprolactam | 0.9039 | 1.0190 | 1.2016 | 1.1294 |
| Capryloylglycine | 0.8161 | 1.4517 | 0.9932 | 0.7090 |
| Capsi-amide | 0.9667 | 0.9809 | 1.2625 | 1.1096 |
| (-)-cassine | 1.0232 | 0.8665 | 1.0046 | 1.2476 |
| CETABEN | 1.2507 | 0.8460 | 0.9313 | 1.0981 |
| Choline | 0.8673 | 1.0570 | 1.3832 | 1.0888 |
| clocinizine | 0.9632 | 0.8258 | 0.5830 | 1.4086 |
| ?-Coniceine | 1.9279 | 0.7329 | 1.5213 | 0.5421 |
| Coniine | 1.0867 | 0.9444 | 1.1337 | 1.0712 |
| Creatinine | 1.1020 | 1.1629 | 0.8572 | 0.8418 |
| Crotono-betaine | 1.1424 | 1.0699 | 0.9907 | 0.9089 |
| Cryptophorine | 0.9273 | 0.8597 | 0.9133 | 1.3687 |
| Cyanopyrazine | 0.7848 | 1.4855 | 0.4987 | 0.7649 |
| Cyclohexane | 1.1077 | 0.8687 | 1.1553 | 1.1526 |
| Cyclohexapyrazine | 1.1172 | 0.5582 | 2.2551 | 1.3469 |
| Cyclohexylamine | 1.1138 | 0.9691 | 0.8167 | 1.0841 |
| (cyclohexylmethyl)pyrazine | 0.8367 | 1.0193 | 1.2147 | 1.1930 |
| Cyclo(leucylprolyl) | 0.7631 | 1.0982 | 2.4452 | 0.9613 |
| Cyprodenate | 1.0832 | 0.5960 | 0.7090 | 1.5948 |
| D-2-Amino-hexano-6-lactam | 0.9146 | 1.1101 | 1.1965 | 1.0238 |
| D-Cathinone | 1.2798 | 0.8025 | 1.2297 | 1.0609 |
| DD9275000 | 1.3073 | 0.9008 | 0.9727 | 0.9780 |
| Deanol | 1.1353 | 0.9366 | 1.2533 | 1.0218 |
| Decarbamoylsaxitoxin | 0.7416 | 1.3318 | 1.4575 | 0.8354 |
| delcorine | 1.1175 | 0.7594 | 0.6304 | 1.3752 |
| delta-Guanidinovalericacid | 0.8087 | 1.2603 | 0.7996 | 0.9983 |
| deoxyhypusine | 0.8897 | 0.9978 | 1.2331 | 1.1593 |
| desvenlafaxine | 1.4973 | 0.7429 | 0.5346 | 1.0783 |
| Dexamisole | 1.1026 | 0.9004 | 1.3491 | 1.1007 |
| Dichlorocarbene | 0.6254 | 0.3859 | 0.9290 | 2.2247 |
| Dicyclohexylamine | 1.1001 | 0.9794 | 1.1002 | 1.0181 |
| dicyclohexylcarbodiimide | 1.3881 | 0.6715 | 0.6622 | 1.2448 |
| Dicyclomine | 1.0361 | 0.5450 | 1.5224 | 1.5632 |
| Diethanolamine | 0.9725 | 1.1541 | 0.6204 | 1.0131 |
| Diethylamine | 0.9975 | 1.2205 | 1.2761 | 0.7759 |
| dimetamfetamine | 1.3698 | 1.0411 | 0.2348 | 0.8538 |
| Dimethylaminopropionylphenothiazine | 1.1871 | 0.8369 | 1.0723 | 1.1531 |
| Dimethylbenzimidazole | 1.0305 | 0.9665 | 1.2133 | 1.0858 |
| Dinitrosopentamethylenetetramine | 0.6147 | 1.6033 | 0.5049 | 0.7676 |
| D-Lysyl-L-valyl-D-valyl-L-allothreonine | 0.6083 | 1.0041 | 0.5821 | 1.5269 |
| D-Methionine | 0.8485 | 1.3473 | 0.6493 | 0.8800 |
| Dolichotheline | 0.8312 | 1.3569 | 0.5493 | 0.8645 |
| D-Phenylalanine | 0.6036 | 1.3129 | 0.3831 | 1.1833 |
| D-Pipecolicacid | 0.6838 | 0.9252 | 1.0066 | 1.4742 |
| D-Proline | 1.0580 | 1.3767 | 0.3513 | 0.7074 |
| Epinephrine(OrL-Adrenaline) | 1.1234 | 1.1197 | 0.7772 | 0.8673 |
| ethambutol | 0.7326 | 1.3068 | 0.4065 | 1.0640 |
| Ethephon | 1.2235 | 0.8335 | 0.9637 | 1.1244 |
| Ethinylestradiol sulfonate | 0.6123 | 1.5402 | 0.6997 | 0.8195 |
| ethyl 1-{[1-benzyl-3-(tert-butyl)-1H-pyrazol-5-yl]carbonyl}-4-piperidinecarboxylate | 1.0620 | 0.7497 | 1.2205 | 1.3466 |
| ethyl 2-{4-[(4-methoxyphenyl)methylene]-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl}acetate | 0.5225 | 0.6797 | 1.4840 | 1.8456 |
| ethyl dibunate | 1.0186 | 0.8139 | 1.6533 | 1.2196 |
| Etiracetam | 0.9049 | 1.1596 | 0.9975 | 0.9924 |
| (+/-)-Eucalyptol | 1.1228 | 1.0489 | 0.9514 | 0.9549 |
| Eudesobovatol A | 0.9825 | 1.1497 | 1.0840 | 0.9271 |
| [FA(16:2)]N-hexadecyl-ethanolamine | 0.8313 | 1.1580 | 0.7984 | 1.1013 |
| [FAamino(5:0)]2S-amino-pentanoicacid | 1.0811 | 1.0641 | 1.0980 | 0.9206 |
| [FAhydroxy(4:0)]N-(3S-hydroxy-butanoyl)-homoserinelactone | 1.1962 | 0.7200 | 0.8374 | 1.2975 |
| [FA]O-Palmitoyl-R-carnitine | 1.7385 | 0.5864 | 0.6630 | 1.0498 |
| [FAoxo(6:0)]N-(3-oxo-hexanoyl)-homoserinelactone | 1.0529 | 1.1642 | 0.5140 | 0.9251 |
| [FAoxo_amino(6:0)]3-oxo-5S-amino-hexanoicacid | 0.8832 | 0.7291 | 0.6645 | 1.6056 |
| Fingolimod | 0.9903 | 0.5764 | 1.6118 | 1.5509 |
| fluocortolone pivalate | 1.0951 | 1.1231 | 0.8573 | 0.9108 |
| fluromidine | 0.8830 | 0.8454 | 0.3707 | 1.5114 |
| Forasartan | 1.1244 | 1.1312 | 1.5230 | 0.7633 |
| Fumaricacid | 1.2183 | 0.8440 | 1.0485 | 1.0755 |
| Gabapentin | 1.1351 | 0.8016 | 1.1419 | 1.2137 |
| gamma-Coniceine | 1.2785 | 1.2435 | 1.5871 | 0.4576 |
| gamma-Glutamyl-gamma-aminobutyraldehyde | 0.8412 | 0.6236 | 1.7680 | 1.5991 |
| Geosmin | 1.4334 | 0.8358 | 1.4805 | 0.8678 |
| Ggamma-L-Glutamyl-L-glutamicacid | 0.8573 | 1.0926 | 0.7293 | 1.1685 |
| Glabrol | 1.3849 | 0.7603 | 1.4247 | 0.9898 |
| glutethimide | 0.9134 | 0.8588 | 0.8552 | 1.3907 |
| Glycerol 5-hydroxydodecanoate | 1.0626 | 1.1205 | 1.1021 | 0.8617 |
| Gly-Pro(Glycylproline) | 0.9033 | 1.3118 | 1.1626 | 0.7828 |
| Gramine | 0.9349 | 1.2657 | 0.3939 | 0.9179 |
| Graveoline | 1.1398 | 0.9570 | 1.2348 | 0.9914 |
| Guanadrel | 0.7679 | 1.4424 | 0.6644 | 0.8000 |
| Guanine | 0.8400 | 1.1298 | 1.7187 | 0.9828 |
| GW7191000 | 1.3676 | 0.6809 | 1.2272 | 1.1458 |
| Heptaethylene Glycol | 0.5367 | 0.5698 | 1.8293 | 1.9110 |
| heptaminol | 1.7738 | 0.6820 | 0.8925 | 0.8015 |
| Hexadecanamide;Palmiticamide | 0.8956 | 0.9661 | 0.6435 | 1.2957 |
| Hexoprenaline | 0.8382 | 1.5085 | 0.7876 | 0.6631 |
| Hexylamine | 0.9593 | 1.0587 | 1.2056 | 1.0356 |
| Histamine | 0.9186 | 1.3017 | 0.8688 | 0.8224 |
| HMBA | 1.0453 | 1.3209 | 1.0381 | 0.6675 |
| HO-dPEG8-OH | 0.5425 | 0.7438 | 2.6835 | 1.5461 |
| Hordenine | 1.1863 | 0.9631 | 0.9644 | 0.9991 |
| Hydroxynorleucine | 1.2544 | 0.8993 | 0.2261 | 1.1409 |
| IE1225000 | 0.6944 | 1.3772 | 0.9308 | 0.9291 |
| Imagabalin | 1.0825 | 0.8887 | 1.6254 | 1.0682 |
| Imidazole-4-acetaldehyde | 1.0632 | 0.9388 | 1.3645 | 1.0451 |
| iminoquinoline | 1.2381 | 0.8531 | 0.8010 | 1.1125 |
| indanazoline | 0.8226 | 1.0238 | 1.0413 | 1.2270 |
| Indane | 1.2562 | 0.9713 | 1.2278 | 0.8907 |
| Inspra | 1.8578 | 0.6338 | 0.9256 | 0.8429 |
| Iprovalicarb | 0.6847 | 0.7111 | 0.8128 | 1.7908 |
| Iridodial glucoside tetraacetate | 0.9311 | 1.0967 | 2.1449 | 0.8571 |
| Isoleucine - 6C13 | 1.1426 | 1.2086 | 0.7929 | 0.7738 |
| Isoniazid | 1.0515 | 0.5705 | 2.2994 | 1.3838 |
| Isoprene | 0.8806 | 0.8603 | 0.5136 | 1.4640 |
| Isoquinoline | 1.3286 | 0.7608 | 1.1358 | 1.0983 |
| ISOXYL | 0.5124 | 1.2250 | 1.4378 | 1.1911 |
| Istamycin C1 | 1.2209 | 0.8269 | 1.1279 | 1.1152 |
| KJ9800000 | 1.4263 | 0.7993 | 1.0226 | 0.9966 |
| Korec | 0.6455 | 0.6676 | 1.0377 | 1.8313 |
| Lasalocid A | 0.7260 | 0.7701 | 1.1879 | 1.6132 |
| Lauramide | 1.0364 | 0.7107 | 1.2348 | 1.3944 |
| Leucamine | 1.0114 | 0.9165 | 1.4404 | 1.1197 |
| Leucinamide | 0.9658 | 0.9236 | 1.0472 | 1.2095 |
| Levallorphan | 0.9019 | 0.7671 | 1.4369 | 1.4147 |
| Levamisole hydrochloride | 0.9756 | 0.9054 | 0.8860 | 1.2827 |
| L-?,gamm | 1.1213 | 1.1864 | 0.7424 | 0.8240 |
| L-gamma-Glutamyl-L-hypoglycin | 1.0564 | 0.7865 | 1.0824 | 1.2996 |
| L-isoglutamine | 1.2546 | 1.0947 | 0.5741 | 0.8371 |
| LQ1825000 | 0.9587 | 1.1114 | 0.9152 | 1.0094 |
| Luciduline | 1.1205 | 1.1774 | 0.7370 | 0.8018 |
| (-)-Lupinine | 1.0865 | 1.0695 | 1.1253 | 0.9339 |
| L-(+)-Valine | 1.2220 | 0.8200 | 1.9135 | 0.9787 |
| LysoPC(20:5(5Z,8Z,11Z,14Z,17Z)) | 0.3438 | 1.9324 | 1.3559 | 0.4740 |
| lysophosphatidylethanolamine (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) | 0.6590 | 1.7007 | 1.1804 | 0.5169 |
| MACAMIDE 1 | 0.9519 | 0.9417 | 1.4302 | 1.1485 |
| Mammea A/AA | 0.8615 | 1.2436 | 0.6844 | 0.9856 |
| Meclizine | 1.0249 | 0.7966 | 0.9946 | 1.3435 |
| Melilotoside A2 | 1.0493 | 0.9803 | 1.1076 | 1.0736 |
| Menaquinone 8 | 1.2709 | 1.0599 | 0.3035 | 0.9289 |
| mephentermine | 1.0436 | 1.0102 | 1.3514 | 0.9890 |
| Meptazinol | 0.8556 | 1.0659 | 0.7882 | 1.1856 |
| mesaconitine | 1.0339 | 0.9714 | 2.8185 | 0.8119 |
| Methoxyphenamine | 1.3065 | 1.2167 | 0.4410 | 0.6543 |
| Methyl 15-cyanopentadecanoate | 0.7464 | 0.7000 | 1.7885 | 1.5840 |
| Methyl (2E,4E,6E,8E,10E,12E,14E,16E,18E,20E)-4,8,13,17,21,25-hexamethyl-2,4,6,8,10,12,14,16,18,20,24-hexacosaundecaenoate | 0.9075 | 1.1800 | 0.8106 | 1.0058 |
| Methyl 4-{[6-deoxy-2,3,4-tri-O-methyl-alpha-L-galactopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->3)-6-deoxy-2-O-methyl-alpha-L-mannopyranosyl]oxy}benzoate | 1.0559 | 1.4979 | 0.3073 | 0.5450 |
| Methylcyclopentane | 1.4830 | 0.4591 | 1.0238 | 1.3657 |
| Methyl diisopropyl propionamide | 0.9872 | 0.6145 | 1.7770 | 1.4584 |
| methylguanidine | 1.1366 | 0.8542 | 0.7585 | 1.2063 |
| Methylimidazoleacetaldehyde | 1.0361 | 0.9401 | 1.4408 | 1.0740 |
| Methyl N-formylnorleucylleucylphenylalaninate | 0.9532 | 1.0619 | 0.7347 | 1.1150 |
| Mexiletine | 1.0985 | 0.8425 | 0.7324 | 1.2612 |
| MFCD02259286 | 0.8766 | 1.7476 | 0.6766 | 0.3519 |
| MFCD24849356 | 0.7956 | 1.1326 | 0.4639 | 1.2268 |
| Miglitol | 1.2914 | 0.9883 | 0.7210 | 0.9015 |
| Militarinone A | 1.1656 | 1.1349 | 1.0231 | 0.8074 |
| MM3670000 | 0.9936 | 0.7910 | 1.3035 | 1.3188 |
| Moxisylyte | 0.8506 | 0.8530 | 0.9091 | 1.4373 |
| MTIC | 0.7887 | 1.0115 | 1.7914 | 1.1628 |
| Myristamide | 1.0181 | 1.0513 | 0.8964 | 1.0604 |
| N-[(13Z)-docosenoyl]sphing-4-enine-1-phosphocholine | 0.8670 | 1.6308 | 0.5761 | 0.5167 |
| N1-(5-methylisoxazol-3-yl)-2-cyano-3-(4-cyanophenyl)acrylamide | 1.0203 | 1.3132 | 0.9453 | 0.7041 |
| N1-bicyclo[2.2.1]hept-2-yl-2-{4-[(dipropylamino)sulfonyl]benzoyl}hydrazine-1-carbothioamide | 0.4281 | 0.4618 | 1.6682 | 2.1832 |
| N-(2,6,10,14-Tetramethylpentadecanoyl)glycine | 0.8709 | 0.7057 | 1.1640 | 1.5669 |
| N2-tetrahydrofuran-2-ylmethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine | 1.1035 | 1.1888 | 0.8519 | 0.7924 |
| N-(3-acetamidopropyl)pyrrolidin-2-one | 0.9515 | 1.4280 | 0.6540 | 0.6848 |
| N-(3-Oxododecanoyl)homoserinelactone | 0.6262 | 0.9827 | 0.4032 | 1.5719 |
| N-(6-Aminohexanoyl)-6-aminohexanoate | 1.0448 | 0.9066 | 1.2833 | 1.1535 |
| N6_N6_N6-Trimethyl-L-lysine | 1.1386 | 1.1301 | 0.7316 | 0.8691 |
| N8ONU3L3PG | 0.7787 | 1.2867 | 0.7313 | 0.9935 |
| N-acetyl-DL-cysteine | 0.9221 | 0.8761 | 0.4158 | 1.4443 |
| N-Acetyl-D-quinovosamine | 1.2942 | 0.6994 | 1.3901 | 1.1576 |
| N-Acetyl-L-histidine | 2.7949 | 0.2684 | 0.4500 | 0.5598 |
| N-Acetyl-L-leucine | 0.8533 | 0.9272 | 1.5106 | 1.2583 |
| N-Acetyl-O-demethylpuromycin | 0.9802 | 1.0168 | 0.6292 | 1.1729 |
| Naphthalen-2-amine | 1.0271 | 1.0945 | 1.6068 | 0.8640 |
| N-benzyl-N-isopropyl-N^-[4-(trifluoromethoxy)phenyl]urea | 0.8568 | 1.2860 | 1.2092 | 0.8299 |
| N-cyclohexyl-1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide | 1.3578 | 0.8752 | 1.1468 | 0.9115 |
| N-Cyclohexyl-N-methylcyclohexanamine | 0.9244 | 1.1498 | 0.7118 | 1.0467 |
| N-Desmethyltramadol | 0.8789 | 1.2940 | 0.5697 | 0.9049 |
| n-Dibutyl sulfide | 1.1062 | 0.8980 | 2.3046 | 0.9186 |
| N-Ethylamphetamine | 1.3337 | 0.7676 | 0.8263 | 1.1401 |
| NFP | 0.9893 | 0.8760 | 1.6816 | 1.1501 |
| N-Heptadecanoylglycine | 0.9218 | 0.8416 | 1.5424 | 1.2991 |
| n-Hexanamide | 1.0110 | 1.0505 | 1.3715 | 0.9711 |
| N-Hydroxydecanamide | 1.3731 | 0.8446 | 1.4822 | 0.8930 |
| Nicotinamide | 1.4048 | 1.1212 | 1.0042 | 0.6128 |
| Nigrifactin | 1.0528 | 0.9157 | 1.2147 | 1.1313 |
| N-lauroylglycine | 1.2106 | 0.7436 | 1.8040 | 1.1166 |
| (+)-N-Methylconiine | 0.9672 | 0.6329 | 1.1690 | 1.5665 |
| N-Methyldioctylamine | 1.0529 | 0.9787 | 1.2645 | 1.0302 |
| N-Methylphenylethanolamine | 0.9875 | 0.9682 | 1.1775 | 1.1300 |
| N-Methylpyridinium | 1.0587 | 1.1252 | 1.0950 | 0.8805 |
| N,N-Dimethyl-N-phenylurea | 0.9689 | 0.9513 | 0.8797 | 1.2163 |
| N_N-Dimethylsphing-4-enine | 1.1457 | 0.9711 | 1.3278 | 0.9685 |
| N-Nitrosodiethylamine | 1.2789 | 1.0033 | 0.1820 | 1.0121 |
| Nonane-4_6-dione | 1.0668 | 0.9983 | 0.9169 | 1.0667 |
| Nornicotine;L-Nor-nicotine | 0.9556 | 1.0670 | 0.8723 | 1.0890 |
| Notoamide E | 0.5722 | 0.9049 | 1.0947 | 1.6001 |
| NP-002105 | 1.2586 | 0.6195 | 1.0508 | 1.3651 |
| NP-008993 | 1.4708 | 0.8959 | 1.2293 | 0.8048 |
| NP-009373 | 0.4950 | 0.5757 | 1.3817 | 2.0097 |
| NP-016596 | 0.4350 | 0.5063 | 1.7465 | 2.1036 |
| N-Pentacosanoylglycine | 1.0255 | 1.1299 | 0.8467 | 0.9657 |
| N-Phenylcarbamoyl 3-amino-2-[4-(trifluoromethyl)piperidino]pyridine ethanolate | 0.7044 | 0.6553 | 1.3269 | 1.7377 |
| NPYR | 1.2657 | 1.2516 | 0.0668 | 0.6959 |
| NSC 622050 | 0.8941 | 1.1476 | 1.0538 | 1.0113 |
| N-Sulfo-D-glucosamine | 0.8464 | 1.1923 | 1.1386 | 0.9890 |
| N-tert-Butyloxycarbonyl-deacetyl-leupeptin | 0.8959 | 0.7290 | 1.4061 | 1.4844 |
| nufenoxole | 1.0620 | 1.1116 | 1.2526 | 0.8797 |
| N-Undecanoylglycine | 1.1894 | 1.1239 | 0.6503 | 0.8591 |
| NX4900000 | 1.2640 | 0.7692 | 1.3022 | 1.1028 |
| O-behenoylcarnitine | 1.0009 | 1.4790 | 0.9443 | 0.5324 |
| Octylamine | 0.8278 | 0.7859 | 0.9781 | 1.5292 |
| ODA | 0.9935 | 1.1064 | 1.0709 | 0.9673 |
| O-heptanoylcarnitine | 0.9436 | 1.2766 | 0.9662 | 0.8309 |
| Oleamide | 1.2350 | 0.7660 | 1.1084 | 1.1866 |
| Oleoylethanolamide | 0.9052 | 0.6550 | 1.3396 | 1.5675 |
| OLEOYL TYROSINE | 0.4098 | 0.3090 | 0.6130 | 2.5653 |
| Ormosanine | 0.9738 | 1.0431 | 1.0406 | 1.0612 |
| Oxibendazole | 0.7201 | 0.9793 | 1.5362 | 1.2903 |
| Oxomemazine | 1.4208 | 0.7288 | 1.0471 | 1.0857 |
| PALGLY | 1.6914 | 0.7413 | 2.2002 | 0.6308 |
| Palmitoyl Serinol | 0.8580 | 1.3094 | 0.5510 | 0.9275 |
| Panobinostat | 0.7068 | 0.8469 | 1.5636 | 1.4700 |
| Pantothenicacid(VitaminB5) | 1.1452 | 0.8802 | 0.8406 | 1.1577 |
| Paspalinine | 1.2181 | 0.8811 | 1.1989 | 1.0410 |
| PEG-4 | 1.3182 | 1.1205 | 0.6620 | 0.7254 |
| Pent-1-ene | 1.0576 | 0.8773 | 1.3596 | 1.1409 |
| Pentahomoserine | 0.9212 | 0.8574 | 2.6154 | 1.0867 |
| Petromyzonol24-sulfate | 0.7633 | 0.7260 | 0.9803 | 1.6722 |
| PF-04965842 | 0.9212 | 1.5640 | 0.5226 | 0.5401 |
| (-)-Phaseollin | 1.1414 | 1.0278 | 0.8769 | 0.9842 |
| Phenelzine | 0.8432 | 1.2159 | 0.9629 | 0.9801 |
| Phenethylamine | 0.8432 | 1.1204 | 0.7177 | 1.1394 |
| Phenmetrazine | 0.9381 | 1.0899 | 1.4700 | 0.9797 |
| Phentermine | 1.0534 | 1.0815 | 1.0317 | 0.9227 |
| Pifithrin-? | 1.0172 | 1.0196 | 1.2713 | 1.0392 |
| Pinidine | 1.0539 | 0.7975 | 0.9228 | 1.3194 |
| Piperazine | 1.0771 | 1.3027 | 0.5288 | 0.7456 |
| Piperidine | 1.0327 | 0.9260 | 1.3523 | 1.1095 |
| PM-Toxin A | 1.4344 | 0.9486 | 1.2252 | 0.7669 |
| Pregabalin | 1.0570 | 1.0405 | 1.2960 | 0.9510 |
| prolintane | 1.2023 | 0.6826 | 1.0007 | 1.3390 |
| Propylhexedrine | 1.0933 | 0.8252 | 1.5811 | 1.1510 |
| Pumiliotoxin 251D | 0.6135 | 0.4601 | 1.5432 | 2.0374 |
| Pyridine | 0.9096 | 0.9321 | 1.0835 | 1.2625 |
| Pyrimidine | 1.1525 | 1.0883 | 0.2117 | 0.9875 |
| Pyrrolidine | 0.9830 | 0.9984 | 1.6057 | 1.0162 |
| Quinoxaline | 0.5761 | 1.2101 | 0.3510 | 1.3374 |
| (R)-2_3-Dihydroxy-3-methylpentanoate | 0.9140 | 1.2354 | 0.7942 | 0.9037 |
| (R)-2-Methylimino-1-phenylpropan-1-ol | 0.6722 | 1.0746 | 1.2775 | 1.2610 |
| (R)-3-Hydroxybutanoate | 0.9073 | 1.2598 | 0.4360 | 0.9682 |
| (R)-6-Hydroxynicotine | 1.0656 | 0.9098 | 0.9077 | 1.1779 |
| (R)-Acetoin | 0.8644 | 0.8126 | 1.1850 | 1.4331 |
| RH0365500 | 0.8545 | 0.7247 | 1.9782 | 1.4050 |
| Rilmenidine | 1.4140 | 0.8735 | 0.8463 | 0.9274 |
| (-)-Salsoline | 0.8475 | 1.4189 | 0.2742 | 0.8226 |
| (S)-Carnitine | 1.0554 | 1.1806 | 1.4270 | 0.7713 |
| sedamine | 0.9088 | 0.9625 | 1.0556 | 1.2042 |
| Selsun | 0.7829 | 1.2933 | 1.4692 | 0.8690 |
| (S)-Nicotine | 0.9643 | 1.0404 | 0.8144 | 1.1236 |
| Solasodine | 0.7747 | 1.5282 | 2.0659 | 0.4682 |
| solenopsin | 1.1431 | 1.0001 | 1.0021 | 0.9912 |
| Spermine | 0.6530 | 1.7796 | 0.2664 | 0.5506 |
| Sphinganine;2-Amion-1_3-octadecanediol | 1.0587 | 1.4819 | 0.3216 | 0.5759 |
| spirilloxanthin | 0.9711 | 1.5874 | 0.4537 | 0.4987 |
| spironolactone | 1.4294 | 0.6141 | 1.2243 | 1.1732 |
| Stachydrine | 1.0480 | 1.1534 | 0.5078 | 0.9600 |
| SteroidO-sulfate | 0.9336 | 1.2241 | 1.5652 | 0.7741 |
| Stiripentol | 0.9051 | 0.8542 | 1.4645 | 1.3063 |
| Sulfate | 0.8522 | 1.1403 | 1.0256 | 1.0695 |
| Talampanel | 1.1245 | 0.9417 | 0.9828 | 1.0906 |
| Taurocholate | 0.1214 | 0.4658 | 2.9033 | 2.2432 |
| Templetine | 1.5946 | 0.6140 | 0.5582 | 1.1453 |
| Terminaline | 1.4531 | 0.7008 | 0.8367 | 1.1142 |
| Tetramethylurea | 0.7421 | 1.1240 | 1.2700 | 1.1232 |
| THREONIC ACID, L- | 1.0274 | 1.4251 | 0.2637 | 0.6921 |
| Thymidine | 1.1271 | 1.2009 | 0.7458 | 0.7583 |
| TO0110000 | 0.6290 | 1.4327 | 0.8603 | 0.9310 |
| TO0127900 | 1.2830 | 0.6325 | 0.3452 | 1.4339 |
| Tocainide | 1.0068 | 1.0925 | 1.1165 | 0.9659 |
| Tolperisone | 1.0388 | 1.0216 | 1.1456 | 1.0373 |
| Tramadol | 0.9479 | 1.3460 | 0.9000 | 0.7355 |
| tranexamic acid | 1.1820 | 1.2006 | 0.9040 | 0.7093 |
| trans-2-Dodecenoylcarnitine | 0.7341 | 0.8460 | 1.8229 | 1.4119 |
| (-)-trans-Carveol | 1.2058 | 0.4874 | 1.3784 | 1.5147 |
| Tridemorph | 1.0551 | 0.9161 | 1.0730 | 1.1479 |
| TRILAURYLAMINE | 1.3178 | 0.7312 | 0.5427 | 1.2506 |
| Trimethylpyrazine | 1.1284 | 1.0079 | 0.6999 | 1.0392 |
| Tris(hydroxymethyl)aminomethane | 1.4313 | 1.0189 | 0.4273 | 0.7943 |
| Tropinone | 1.0977 | 0.9136 | 1.1946 | 1.0960 |
| Tryptoline | 1.1998 | 0.9471 | 0.8437 | 1.0388 |
| tuaminoheptane | 0.9563 | 1.0017 | 1.5410 | 1.0475 |
| TX1575000 | 0.9006 | 1.2322 | 1.4847 | 0.8246 |
| undecenal | 1.1176 | 1.0046 | 1.1556 | 0.9795 |
| UNII:6S7S02945H | 0.9164 | 0.7830 | 1.3611 | 1.3940 |
| UQ3675000 | 1.5306 | 1.1163 | 0.4507 | 0.5927 |
| US4056000 | 1.3408 | 1.1101 | 1.4447 | 0.5916 |
| UX9465930 | 0.9234 | 0.9284 | 1.2700 | 1.2247 |
| Valeroidine | 1.0913 | 1.1521 | 2.1811 | 0.6557 |
| valpromide | 0.9876 | 0.8146 | 1.3199 | 1.2958 |
| WLH | 0.3233 | 0.3990 | 1.7233 | 2.3351 |
| Yellow OB | 0.8852 | 0.8090 | 1.6634 | 1.3336 |
| Z-Arg-Arg | 0.6968 | 1.1107 | 1.1018 | 1.2230 |
| Zizyphine A | 1.1491 | 0.7838 | 2.5915 | 0.9866 |
Factors:
| F1 | Sample source:Optic Nerve | Treatment:Control |
| F2 | Sample source:Optic Nerve | Treatment:Crush |
| F3 | Sample source:Optic Nerve | Treatment:QC |
| F4 | Sample source:Optic Nerve | Treatment:Sham |