Data for LC-MS Based Approaches to Investigate Metabolomic Differences in the Urine of Young Women after Drinking Cranberry Juice or Apple Juice (Study ST000291)
(Analysis AN000465)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 studyMetabolite | F1 | F2 | F3 |
---|---|---|---|
10-Deacetyl-2-debenzoylbaccatin III | 1.3452 | 0.5984 | 1.0563 |
10-Oxodecanoate | 1.5872 | 0.9439 | 0.4689 |
1,1-Diethyl-2-hydroxy-2-nitrosohydrazine_1 | 0.9798 | 0.8926 | 1.1277 |
1,1-Diethyl-2-hydroxy-2-nitrosohydrazine_2 | 1.0724 | 1.2832 | 0.6444 |
1,2-Dihydroxynaphthalene-6-sulfonate | 2.6014 | 0.0019 | 0.1503 |
12-trans-Hydroxy juvenile hormone III | 0.9276 | 1.3945 | 0.6779 |
14-Dihydroxycornestin | 0.9057 | 1.8643 | 0.2300 |
1-(5-Phosphoribosyl)imidazole-4-acetate | 0.0132 | 0.0077 | 3.3085 |
1alpha,5alpha-Epidithio-17a-oxa-D-homoandrostan-3,17-dione_1 | 1.0062 | 0.6203 | 1.3736 |
1alpha,5alpha-Epidithio-17a-oxa-D-homoandrostan-3,17-dione_2 | 0.6075 | 1.2164 | 1.1248 |
1-(beta-D-Ribofuranosyl)-1,4-dihydronicotinamide | 4.9120 | 0.0168 | 0.6192 |
1-Caffeoyl-4-deoxyquinic acid_1 | 1.1021 | 0.9467 | 0.9512 |
1-Caffeoyl-4-deoxyquinic acid_2 | 0.2934 | 2.3501 | 0.3564 |
(1E,3E)-4-Hydroxybuta-1,3-diene-1,2,4-tricarboxylate | 0.8806 | 1.0371 | 1.0823 |
1-O-Galloyl-beta-D-glucose | 2.1548 | 0.5135 | 0.3317 |
1-O-Sinapoyl-beta-D-glucose_1 | 0.5911 | 0.8923 | 1.5165 |
1-O-Sinapoyl-beta-D-glucose_2 | 1.8017 | 0.5517 | 0.6466 |
1-O-Vanilloyl-beta-D-glucose_1 | 0.9839 | 0.4691 | 1.5471 |
1-O-Vanilloyl-beta-D-glucose_2 | 0.5586 | 1.4239 | 1.0176 |
1-O-Vanilloyl-beta-D-glucose_3 | 0.8103 | 0.2752 | 1.9145 |
1-O-Vanilloyl-beta-D-glucose_4 | 0.9771 | 1.1894 | 0.8336 |
(1-Ribosylimidazole)-4-acetate | 1.0922 | 0.8117 | 1.0961 |
2,2-Bis(4^-chlorophenyl)ethanol | 1.3050 | 1.0787 | 0.5888 |
2-(2-Chloro-phenyl)-5-(5-methylthiophen-2-yl)-[1,3,4]oxadiazole | 1.6829 | 0.3434 | 0.9737 |
2,3-Dihydrothienamycin | 1.0803 | 0.9408 | 0.9789 |
2,3-Dihydroxy-p-cumate_1 | 1.0871 | 0.8628 | 1.0501 |
2,3-Dihydroxy-p-cumate_2 | 0.8783 | 0.9465 | 1.1751 |
2-(3^-Methylthio)propylmalic acid | 1.1041 | 0.6697 | 1.2263 |
2,4-Bis(acetamido)-2,4,6-trideoxy-beta-L-altropyranose_1 | 0.7790 | 1.7030 | 0.5180 |
2,4-Bis(acetamido)-2,4,6-trideoxy-beta-L-altropyranose_2 | 1.0260 | 0.8256 | 1.1485 |
2,4-Dichlorotoluene | 1.0044 | 0.9845 | 1.0111 |
2,4-Dinitro-1-(3-nitrophenoxy)benzene | 0.7226 | 0.4483 | 1.8882 |
2,4-Dinitrophenol | 0.7095 | 1.2499 | 1.0406 |
2,5-Diamino-6-(5-phospho-D-ribitylamino)pyrimidin-4(3H)-one_1 | 1.7099 | 0.3534 | 0.9366 |
2,5-Diamino-6-(5-phospho-D-ribitylamino)pyrimidin-4(3H)-one_2 | 2.2686 | 0.2610 | 0.4704 |
2,5-Furandicarboxylate_1 | 0.5065 | 1.4395 | 1.0540 |
2,5-Furandicarboxylate_2 | 0.5887 | 1.3165 | 1.0948 |
2-(6^-Methylthio)hexylmalic acid | 0.6399 | 0.5194 | 1.8407 |
2,7-Anhydro-alpha-N-acetylneuraminic acid_1 | 0.9652 | 0.8958 | 1.1390 |
2,7-Anhydro-alpha-N-acetylneuraminic acid_2 | 1.6700 | 0.5094 | 0.8206 |
2-(Acetamidomethylene)succinate | 1.1277 | 0.9927 | 0.8795 |
2-Amino-9,10-epoxy-8-oxodecanoic acid | 1.9221 | 0.4942 | 0.5837 |
2-AminoAMP | 0.7259 | 0.3994 | 1.8747 |
2-Chloro-1,4-naphthoquinone | 0.3755 | 0.1796 | 2.4450 |
2-Dehydro-D-xylonate | 0.4854 | 2.4410 | 0.0736 |
2-Deoxy-D-ribose 1-phosphate | 1.2340 | 0.8281 | 0.9379 |
2-Ethylhexyl phthalate_1 | 1.0070 | 0.9825 | 1.0105 |
2-Ethylhexyl phthalate_2 | 0.0814 | 2.8642 | 0.0544 |
2-Hydroxyfelbamate | 1.2906 | 0.9708 | 0.7386 |
2-Oxo-6-methylthiohexanoic acid_1 | 0.8852 | 0.5674 | 1.5474 |
2-Oxo-6-methylthiohexanoic acid_2 | 0.9628 | 0.9791 | 1.0582 |
2-Oxo-8-methylthiooctanoic acid | 1.5999 | 0.2222 | 1.0224 |
2-Oxosuberate | 1.2282 | 0.8311 | 0.9407 |
2-Phosphinomethylmalate | 2.9438 | 0.0062 | 0.0500 |
2-Pyridyl hydroxymethane sulfonic acid_1 | 1.3174 | 0.6958 | 0.9868 |
2-Pyridyl hydroxymethane sulfonic acid_2 | 1.2746 | 0.8145 | 0.9109 |
2-Pyridyl hydroxymethane sulfonic acid_3 | 1.2967 | 0.6977 | 1.0056 |
2-Pyridyl hydroxymethane sulfonic acid_4 | 0.4189 | 0.4862 | 2.0949 |
(2S,3S)-2-Hydroxytridecane-1,2,3-tricarboxylate | 0.7557 | 1.3458 | 0.8985 |
2-S-Glutathionyl acetate | 1.4157 | 1.2342 | 0.3778 |
2-Succinylbenzoate_1 | 1.1892 | 0.4155 | 1.3953 |
2-Succinylbenzoate_2 | 2.2322 | 0.2726 | 0.4952 |
3-(3,4-Dihydroxyphenyl)lactate_1 | 1.1606 | 0.9120 | 0.9274 |
3-(3,4-Dihydroxyphenyl)lactate_2 | 0.8738 | 0.6183 | 1.5080 |
3-[(3aS,4S,7aS)-7a-Methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate | 1.6385 | 0.7075 | 0.6540 |
3,4,3^-Tri-O-methylellagic acid | 1.0713 | 0.8992 | 1.0294 |
3,4-Dihydroxy-L-phenylalanine | 0.9670 | 1.2547 | 0.7783 |
3,4-Dihydroxymandelate_1 | 1.4439 | 1.2048 | 0.3513 |
3,4-Dihydroxymandelate_2 | 0.2535 | 0.0443 | 2.7021 |
3,4-Dihydroxyphenylethyleneglycol_1 | 1.1652 | 0.7926 | 1.0422 |
3,4-Dihydroxyphenylethyleneglycol_2 | 0.8776 | 0.7908 | 1.3316 |
3-(4-Hydroxyphenyl)lactate | 1.4231 | 0.4177 | 1.1592 |
3-(4-Hydroxyphenyl)pyruvate | 0.8747 | 0.5474 | 1.5779 |
3^,5^-Cyclic AMP | 1.1126 | 0.8548 | 1.0327 |
3^,5^-Cyclic GMP | 1.2399 | 0.7136 | 1.0465 |
3,5-Dinitroguaiacol | 0.9997 | 0.9965 | 1.0038 |
3,7-Di-O-methylquercetin | 0.3177 | 2.3559 | 0.3263 |
(3-Arylcarbonyl)-alanine | 0.5316 | 0.5083 | 1.9601 |
3-beta-D-Galactosyl-sn-glycerol_1 | 1.7440 | 0.6456 | 0.6104 |
3-beta-D-Galactosyl-sn-glycerol_2 | 1.0549 | 1.2690 | 0.6762 |
3-beta-D-Galactosyl-sn-glycerol_3 | 1.3693 | 0.4307 | 1.2247 |
(3E)-4-(2-Carboxyphenyl)-2-oxobut-3-enoate | 1.1735 | 0.9871 | 0.8394 |
3-Fluoro-cis,cis-muconate | 1.1849 | 1.0103 | 0.8048 |
3-Hydroxy-2-methylpyridine-4,5-dicarboxylate | 0.9829 | 1.0226 | 0.9945 |
3-Hydroxy-L-glutamate_1 | 0.0054 | 0.0242 | 2.9704 |
3-Hydroxy-L-glutamate_2 | 0.0217 | 0.0674 | 2.9109 |
3-Methyldioxyindole | 0.6846 | 0.3844 | 1.9310 |
3-Oxalomalate | 0.4727 | 2.1061 | 0.4212 |
3-Oxododecanoic acid | 1.2617 | 0.7441 | 0.9942 |
3-Sulfino-L-alanine | 1.0938 | 0.7951 | 1.1111 |
3-Sulfocatechol | 0.5459 | 0.4967 | 1.9573 |
3-Sulfomuconate | 1.0314 | 1.6205 | 0.3481 |
3-tert-Butyl-5-methylcatechol | 0.9404 | 0.7770 | 1.2826 |
4-(2-Aminophenyl)-2,4-dioxobutanoate_1 | 0.7508 | 1.0084 | 1.2408 |
4-(2-Aminophenyl)-2,4-dioxobutanoate_2 | 1.1977 | 0.5853 | 1.2170 |
4-(3-Methylbut-2-enyl)-L-tryptophan | 2.0872 | 0.6063 | 0.3065 |
4,4^-Biphenyldithiol_1 | 0.9571 | 1.2962 | 0.7467 |
4,4^-Biphenyldithiol_2 | 1.0652 | 0.8624 | 1.0724 |
4,4-Bis[4-(acetyloxy)phenyl]3-hexanone_1 | 1.4748 | 0.5111 | 1.0141 |
4,4-Bis[4-(acetyloxy)phenyl]3-hexanone_2 | 1.3949 | 0.6812 | 0.9239 |
4-(4-Deoxy-beta-D-gluc-4-enuronosyl)-D-galacturonate | 1.3303 | 0.8609 | 0.8087 |
4,4^-Diaminostilbene dihydrochloride_1 | 1.0716 | 0.8709 | 1.0575 |
4,4^-Diaminostilbene dihydrochloride_2 | 0.4454 | 2.0445 | 0.5101 |
4,4^-Dichlorobenzophenone_1 | 1.4771 | 0.1863 | 1.3367 |
4,4^-Dichlorobenzophenone_2 | 0.9202 | 1.6519 | 0.4279 |
4-Amino-4-deoxychorismate_1 | 0.9872 | 0.5950 | 1.4178 |
4-Amino-4-deoxychorismate_2 | 0.9828 | 0.5609 | 1.4562 |
4-(beta-D-Glucosyloxy)benzoate | 1.1068 | 0.8049 | 1.0883 |
4-Carboxy-4-hydroxy-2-oxoadipate | 1.0466 | 0.5457 | 1.4077 |
4-Hydroxy-2-quinolinecarboxylic acid_1 | 1.0114 | 0.8900 | 1.0986 |
4-Hydroxy-2-quinolinecarboxylic acid_2 | 0.9172 | 1.0338 | 1.0490 |
4-Hydroxycinnamyl alcohol 4-D-glucoside | 0.6075 | 1.2815 | 1.1110 |
4-Nitrophenol-alpha-D-galactopyranoside | 1.5306 | 1.0988 | 0.3706 |
4-Nitrophenyl-3-ketovalidamine_1 | 0.7568 | 1.7205 | 0.5227 |
4-Nitrophenyl-3-ketovalidamine_2 | 0.0130 | 2.8925 | 0.0122 |
4-O-beta-D-Glucosyl-4-hydroxycinnamate_1 | 0.6800 | 1.1789 | 1.1411 |
4-O-beta-D-Glucosyl-4-hydroxycinnamate_2 | 0.5817 | 1.3615 | 1.0569 |
4-Pyridoxate_1 | 0.5804 | 1.3403 | 1.0793 |
4-Pyridoxate_2 | 0.8539 | 1.6302 | 0.5159 |
4-Pyridoxate_3 | 0.9904 | 1.0592 | 0.9504 |
5-Amino-4-chloro-2-(2,3-dihydroxyphenyl)-3(2H)-pyridazinone | 0.9671 | 0.6783 | 1.3547 |
5-Amino-6-(5^-phospho-D-ribitylamino)uracil | 0.8427 | 0.8733 | 1.2840 |
5-Fluorouridine monophosphate | 1.0692 | 0.6889 | 1.2420 |
5-Guanidino-3-methyl-2-oxopentanoate | 1.8618 | 0.5737 | 0.5645 |
5-Hydroxyferulic acid methyl ester_1 | 1.3787 | 0.6879 | 0.9334 |
5-Hydroxyferulic acid methyl ester_2 | 1.3633 | 0.7500 | 0.8866 |
5-Hydroxyindoleacetate | 1.0806 | 0.6250 | 1.2944 |
5-Hydroxy-L-tryptophan | 1.1109 | 0.8491 | 1.0400 |
5-Hydroxymethyldeoxycytidylate | 0.9653 | 1.0999 | 0.9348 |
5-Methyl-3-isoxazolyl sulfate_1 | 0.0441 | 0.3696 | 2.0996 |
5-Methyl-3-isoxazolyl sulfate_2 | 0.0243 | 0.0289 | 1.9731 |
5-Methyl-3-isoxazolyl sulfate_3 | 0.0990 | 0.1287 | 2.7723 |
5-Methylthiopentanaldoxime | 1.5774 | 1.0039 | 0.4187 |
5-O-Methyl-myo-inositol | 0.8724 | 0.9809 | 1.1466 |
5-Sulfosalicylate_1 | 1.2876 | 0.8405 | 0.8719 |
5-Sulfosalicylate_2 | 1.3141 | 0.8869 | 0.7989 |
(5Z,13E)-11alpha-Hydroxy-9,15-dioxoprost-13-enoate | 1.2712 | 1.1046 | 0.6242 |
6-[2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,2-dihydro-7-hydroxy-9-methoxy-cyclopenta[c][1]benzopyran-3,4-dione | 0.2975 | 0.5068 | 2.1957 |
6-Acetyl-D-glucose | 1.1591 | 0.2066 | 1.6343 |
6-(alpha-D-Glucosaminyl)-1D-myo-inositol | 0.0472 | 0.0180 | 3.1433 |
6-Demethylsterigmatocystin | 0.9458 | 0.3749 | 1.6793 |
6-Hydroxyindolelactate | 1.2605 | 0.7087 | 1.0308 |
6-Methoxymellein_1 | 0.4772 | 1.2075 | 1.3153 |
6-Methoxymellein_2 | 2.5288 | 0.0961 | 0.3751 |
7,8-Dihydroxycoumarin | 1.0559 | 1.3721 | 0.5720 |
7-Deoxyloganate_1 | 1.3561 | 0.9055 | 0.7384 |
7-Deoxyloganate_2 | 0.6163 | 0.6675 | 1.7162 |
7-Deoxyloganate_3 | 0.9937 | 1.1158 | 0.8905 |
7-Deoxyloganetin | 1.1316 | 0.9748 | 0.8936 |
7-Hydroxy-3-(4-methoxyphenyl)-4-propyl-2H-1-benzopyran-2-one | 1.1801 | 0.8667 | 0.9532 |
7-Hydroxy-6-methyl-8-ribityl lumazine_1 | 1.1451 | 0.7403 | 1.1146 |
7-Hydroxy-6-methyl-8-ribityl lumazine_2 | 1.4691 | 0.7732 | 0.7577 |
7-Mercaptoheptanoic acid | 1.1525 | 0.9306 | 0.9168 |
7-Mercaptoheptanoylthreonine | 1.0187 | 0.7687 | 1.2126 |
7-Methyl-2-hydroxy-6-oxoocta-2,4-dienoate_1 | 1.4892 | 0.5028 | 1.0081 |
7-Methyl-2-hydroxy-6-oxoocta-2,4-dienoate_2 | 1.3928 | 0.7629 | 0.8444 |
8-Amino-7-oxononanoate_1 | 0.8300 | 0.7848 | 1.3851 |
8-Amino-7-oxononanoate_2 | 1.0962 | 0.9267 | 0.9771 |
8-Amino-7-oxononanoate_3 | 0.6168 | 1.6174 | 0.7658 |
8-Amino-7-oxononanoate_4 | 2.3830 | 0.4205 | 0.1965 |
8-Epiiridodial glucoside | 1.3939 | 0.7874 | 0.8187 |
8-Epiiridotrial glucoside | 1.1464 | 0.9671 | 0.8865 |
8-Hydroxyalanylclavam | 0.5845 | 2.1119 | 0.3036 |
8-Oxodeoxycoformycin | 1.9217 | 0.3780 | 0.7003 |
8-Oxoguanine | 1.1044 | 1.0585 | 0.8371 |
9,12,13-TriHOME_1 | 1.0397 | 0.9624 | 0.9980 |
9,12,13-TriHOME_2 | 0.9550 | 1.1045 | 0.9406 |
9-Hydroxybenzo[a]pyrene-4,5-oxide | 1.2634 | 0.9017 | 0.8349 |
(9R,10R)-Dihydroxyoctadecanoic acid | 1.0142 | 0.9743 | 1.0115 |
9-Riburonosyladenine | 0.0251 | 0.0164 | 3.3537 |
Abscisate | 0.7459 | 0.5080 | 1.7461 |
Abscisic acid glucose ester_1 | 1.1377 | 0.7287 | 1.1336 |
Abscisic acid glucose ester_2 | 0.9898 | 1.0110 | 0.9992 |
Acetophenazine | 0.1609 | 0.1897 | 2.6495 |
Acetyl-maltose_1 | 1.2965 | 0.7371 | 0.9663 |
Acetyl-maltose_2 | 1.6480 | 0.4870 | 0.8650 |
Acronycidine | 0.9126 | 1.3528 | 0.7345 |
Acutumidine | 0.0248 | 0.0014 | 2.9659 |
Acyclovir | 0.0001 | 2.9998 | NA |
Adiantifoline | 0.5618 | 0.7567 | 1.6329 |
alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine | 1.0449 | 0.8982 | 1.0569 |
alpha-Ribazole | 1.1431 | 0.9804 | 0.8765 |
Altersolanol A | 2.6631 | 0.0679 | 0.2690 |
AMCC | 0.7372 | 1.1177 | 1.1451 |
Amoxicillin | 0.0081 | 0.0006 | 3.5441 |
AMPA_1 | 1.1067 | 0.8566 | 1.0367 |
AMPA_2 | 0.5124 | 1.9716 | 0.5160 |
Anastrozole | 2.8144 | 0.0348 | 0.0213 |
Androsterone glucuronide | 1.0997 | 0.9263 | 0.9740 |
Anhydrochlortetracycline | 0.1006 | 2.9529 | 0.2720 |
Aniracetam | 1.0652 | 1.1020 | 0.8328 |
Anisatin_1 | 1.1596 | 0.9010 | 0.9393 |
Anisatin_2 | 1.3855 | 0.7161 | 0.8984 |
Anthocyanin | 0.0030 | 0.0027 | 1.7977 |
Anthocyanin 3^-O-beta-D-glucoside | 0.5645 | 0.6205 | 1.8149 |
Antirrhinoside | 1.0693 | 0.7691 | 1.1616 |
Arg-OEt | 0.9504 | 0.6474 | 1.4021 |
Artecanin | 0.3216 | 2.3382 | 0.3401 |
Ascorbate | 2.1166 | 0.3963 | 0.4871 |
Ascorbate 2-sulfate_1 | 1.1993 | 0.8823 | 0.9184 |
Ascorbate 2-sulfate_2 | 1.1981 | 0.8918 | 0.9101 |
Asebogenin | 2.0737 | 0.0223 | 0.7576 |
Asparenomycin A_1 | 1.1288 | 1.0442 | 0.8270 |
Asparenomycin A_2 | 0.6062 | 1.8456 | 0.3100 |
Asperuloside | 2.2559 | 0.2737 | 0.4703 |
Aspidinol | 1.0398 | 0.8869 | 1.0733 |
Atractyloside A | 0.3988 | 1.0075 | 1.5936 |
Aucubin | 1.4092 | 0.7440 | 0.8468 |
Autumnolide | 0.3118 | 1.1580 | 1.5302 |
Azelaic acid | 0.9841 | 1.0000 | 1.0159 |
Azinphos-ethyl_1 | 0.2179 | 0.3239 | 2.4582 |
Azinphos-ethyl_2 | 0.5864 | 0.3849 | 2.0287 |
Azoxystrobin | 1.1508 | 0.4153 | 1.4338 |
Baicalin | 1.7312 | 0.2184 | 0.9983 |
Bakkenolide A | 1.0458 | 0.9144 | 1.0398 |
Balofloxacin_1 | 0.8464 | 0.6941 | 1.4595 |
Balofloxacin_2 | 1.5182 | 0.4237 | 1.0582 |
Barbaloin_1 | 0.8853 | 1.1602 | 0.9545 |
Barbaloin_2 | 1.8034 | 0.0275 | 0.9706 |
Bendiocarb_1 | 1.0268 | 0.7583 | 1.2149 |
Bendiocarb_2 | 1.1155 | 0.8408 | 1.0437 |
Benzthiazuron | 1.6623 | 0.6424 | 0.6953 |
Berberastine | 1.4235 | 0.8979 | 0.6718 |
Berberine chloride_1 | 0.6330 | 0.6999 | 1.6671 |
Berberine chloride_2 | 0.8950 | 0.8999 | 1.2051 |
Berberine chloride_3 | 0.4610 | 0.7376 | 1.8014 |
Bergenin_1 | 1.0821 | 0.8840 | 1.0338 |
Bergenin_2 | 1.7732 | 0.5932 | 0.6336 |
beta-Citryl-L-glutamate | 1.1435 | 0.8898 | 0.9668 |
Biotin sulfone | 1.3872 | 1.0278 | 0.5850 |
Biotin sulfoxide_1 | 1.2542 | 1.1933 | 0.5525 |
Biotin sulfoxide_2 | 0.6577 | 1.5668 | 0.7755 |
Bis(4^-chlorophenyl)methane_1 | 1.7853 | 0.2264 | 0.9883 |
Bis(4^-chlorophenyl)methane_2 | 1.8543 | 0.3579 | 0.7878 |
Bis-D-fructose 2^,1:2,1^-dianhydride | 0.9314 | 0.4681 | 1.6005 |
Boc-Asn_1 | 0.4700 | 2.0716 | 0.4583 |
Boc-Asn_2 | 1.8506 | 0.5404 | 0.6089 |
Boc-Asn-OPhNO2 | 1.0916 | 0.9555 | 0.9529 |
Botrydial | 1.0136 | 0.9977 | 0.9888 |
Bowdichione | 0.0807 | 0.1446 | 2.7827 |
Bruceoside A | 0.0109 | 3.2331 | 0.0033 |
Butenachlor | 0.2628 | 0.2302 | 2.5069 |
Butopyronoxyl_1 | 1.1235 | 0.8606 | 1.0159 |
Butopyronoxyl_2 | 0.8907 | 0.6873 | 1.4220 |
C20913 | 0.9661 | 1.6365 | 0.3974 |
Calcium levulinate anhydrous | 2.4431 | 0.2661 | 0.2908 |
Carbamorph | 0.6086 | 1.5168 | 0.8746 |
Castanospermine_1 | 1.0619 | 0.8622 | 1.0759 |
Castanospermine_2 | 1.2851 | 0.9988 | 0.7161 |
Castanospermine_3 | 2.8886 | 0.0399 | 0.0715 |
Cellobionate | 1.9474 | 0.6184 | 0.4342 |
Cerulenin | 1.1593 | 0.8743 | 0.9664 |
Chlorbufam | 2.2000 | 0.0051 | 0.1436 |
Chlorogenate | 0.1943 | 2.6985 | 0.1072 |
Chloroxuron | 2.5238 | 0.2113 | 0.3665 |
Chlorphentermine | 0.4546 | 1.3927 | 1.1527 |
Chlorpromazine | 1.6258 | 0.8443 | 0.5300 |
Chlorpromazine N-oxide_1 | 0.5605 | 1.2602 | 1.1847 |
Chlorpromazine N-oxide_2 | 0.8555 | 1.0462 | 1.0982 |
Cholesterol sulfate | 1.0229 | 0.6952 | 1.2819 |
Cholic acid | 0.7867 | 0.5516 | 1.6617 |
cis-2,3-Dihydroxy-2,3-dihydro-p-cumate | 1.1572 | 0.8403 | 1.0025 |
cis-2-Carboxycyclohexyl-acetic acid_1 | 0.9070 | 0.7587 | 1.3342 |
cis-2-Carboxycyclohexyl-acetic acid_2 | 0.9400 | 0.9051 | 1.1550 |
cis-2-Carboxycyclohexyl-acetic acid_3 | 0.0991 | 0.0534 | 2.8475 |
cis-2-Carboxycyclohexyl-acetic acid_4 | 1.1769 | 0.7643 | 1.0588 |
cis-4-Carboxymethylenebut-2-en-4-olide | 0.4613 | 0.0482 | 2.4905 |
cis-(Homo)3-aconitate | 2.2775 | 0.3464 | 0.3761 |
CITRATE | 0.9425 | 1.0364 | 1.0211 |
Clavulanic acid | 1.3107 | 0.9965 | 0.6928 |
CNQX | 1.9720 | 0.4148 | 0.6132 |
Coformycin | 2.4445 | 0.1168 | 0.4387 |
Coniferin_1 | 1.0582 | 0.8746 | 1.0672 |
Coniferin_2 | 1.0375 | 1.0592 | 0.9033 |
Coniferin_3 | 1.5686 | 1.2260 | 0.2054 |
Coniferin_4 | 0.9253 | 0.3948 | 1.6799 |
Coniferyl alcohol | 0.9998 | 1.0317 | 0.9686 |
Corniculatusin | 0.8237 | 1.1361 | 1.0402 |
Creatine-D3 | 1.0435 | 0.9056 | 1.0739 |
Creatinine | 1.0811 | 0.9299 | 0.9890 |
Croconazole | 1.5750 | 0.8490 | 0.5760 |
Crotanecine | 0.9395 | 1.1336 | 0.9269 |
Cyclic GMP-AMP | 1.0269 | 0.9802 | 0.9929 |
cyclo-Dopa 5-O-glucoside_1 | 2.7431 | 0.0598 | 0.1971 |
cyclo-Dopa 5-O-glucoside_2 | 1.0835 | 0.7195 | 1.1970 |
Cyclophosphamide | 0.7678 | 0.9661 | 1.2661 |
Cypermethrin | 1.3946 | 0.9356 | 0.6698 |
D-Alanyl-D-serine | 1.0988 | 0.9182 | 0.9830 |
Dalpanin | 1.8745 | 0.9227 | 0.2028 |
Danielone_1 | 1.1966 | 0.6498 | 1.1537 |
Danielone_2 | 1.4846 | 0.4630 | 1.0524 |
Danielone_3 | 1.2502 | 0.8271 | 0.9226 |
Dantrolene_1 | 1.0319 | 0.8421 | 1.1260 |
Dantrolene_2 | 1.0741 | 0.6755 | 1.2503 |
DCEBIO_1 | 1.7223 | 0.3349 | 0.9428 |
DCEBIO_2 | 2.9877 | 0.0056 | 0.0067 |
Debromoaplysiatoxin | 0.4934 | 2.3279 | 0.1787 |
Decarbamoylgonyautoxin 1_1 | 0.1691 | 1.1386 | 1.6922 |
Decarbamoylgonyautoxin 1_2 | 0.4356 | 0.2736 | 2.2907 |
Dehypoxanthine futalosine | 2.0193 | 0.5826 | 0.3981 |
Deoxycoformycin | 1.0320 | 0.9044 | 1.0636 |
Deoxyguanidinoproclavaminic acid | 1.2017 | 1.0032 | 0.7950 |
Deoxylimononic acid D-ring-lactone | 1.5367 | 0.5236 | 0.6417 |
Deoxyloganin_1 | 0.9884 | 0.9158 | 1.0957 |
Deoxyloganin_2 | 0.6634 | 1.4876 | 0.8490 |
D-Galactose 6-sulfate | 1.0277 | 0.9476 | 1.0247 |
D-Glucono-1,5-lactone | 0.6333 | 0.1967 | 2.1700 |
D-GLUCURONOLACTONE | 1.0035 | 0.9888 | 1.0077 |
Didanosine | 1.1796 | 0.7888 | 1.0315 |
Didrovaltratum | 0.8964 | 0.9758 | 1.1278 |
Diethyl 2-methyl-3-oxosuccinate_1 | 0.4898 | 0.1711 | 2.3391 |
Diethyl 2-methyl-3-oxosuccinate_2 | 1.2049 | 1.0521 | 0.7430 |
Diethyl 2-methyl-3-oxosuccinate_3 | 1.3120 | 0.2541 | 1.4339 |
Diethyl (2R,3R)-2-methyl-3-hydroxysuccinate | 1.0367 | 0.6593 | 1.3039 |
Digalacturonate | 0.7795 | 0.0775 | 2.2089 |
Dihydromyricetin | 0.9720 | 0.8990 | 1.1290 |
Dihydrozeatin-O-glucoside | 0.3134 | 2.4148 | 0.2718 |
DIMBOA_1 | 1.1457 | 0.5545 | 1.2999 |
DIMBOA_2 | 2.0126 | 0.1571 | 0.8303 |
DIMBOA-glucoside | 1.3041 | 0.4962 | 1.1998 |
Disperse Blue 1 | 0.9574 | 0.5195 | 1.5231 |
D-Lombricine | 1.3728 | 0.8302 | 0.7970 |
D-Mannitol 1-phosphate | 2.4198 | 0.1723 | 0.4079 |
DMPP_1 | 1.2722 | 1.2879 | 0.4399 |
DMPP_2 | 0.2086 | 2.4419 | 0.3495 |
Dodecanedioic acid_1 | 0.6347 | 1.3567 | 1.0086 |
Dodecanedioic acid_2 | 1.6214 | 0.8787 | 0.4999 |
Dodecanedioic acid_3 | 0.7680 | 1.0362 | 1.1958 |
Dodecanedioic acid_4 | 0.6317 | 1.2838 | 1.0845 |
Dodecanedioic acid_5 | 1.7819 | 0.7760 | 0.4421 |
Dodecanedioic acid_6 | 1.3717 | 0.8118 | 0.8165 |
Doxazosin | 0.9794 | 0.8736 | 1.1470 |
D-Prephenyllactate | 0.3424 | 0.3505 | 2.3071 |
Drazoxolon | 1.0739 | 0.9248 | 1.0012 |
D-RIBOSE 5-PHOSPHATE | 0.7952 | 0.6935 | 1.5113 |
D-SACCHARIC ACID | 0.9769 | 1.0187 | 1.0045 |
D-Urobilinogen | 0.0431 | 3.2578 | 0.0217 |
D-Xylonate_1 | 0.8392 | 0.9840 | 1.1768 |
D-Xylonate_2 | 1.0377 | 1.1672 | 0.7950 |
E3040 | 0.7661 | 1.3587 | 0.8752 |
EDTA | 1.0631 | 0.8343 | 1.1026 |
Elephantopin | 1.3726 | 0.6666 | 0.9608 |
Enoxacin | 2.7172 | 0.0709 | 0.2120 |
Epithienamycin B | 2.5280 | 0.0254 | 0.4071 |
erythro-3-Hydroxy-Ls-aspartate | 1.6592 | 0.6483 | 0.6925 |
Eseramine_1 | 0.7528 | 0.4157 | 1.8314 |
Eseramine_2 | 0.9815 | 0.8807 | 1.1378 |
Estazolam | 2.7845 | 0.1026 | 0.1129 |
Eudistomin C | 1.1053 | 0.9983 | 0.8964 |
Evadol hydrochloride | 1.3880 | 0.7990 | 0.8130 |
Fenoldopam_1 | 1.1338 | 1.2225 | 0.6438 |
Fenoldopam_2 | 0.8579 | 1.2029 | 0.9392 |
Fenpiclonil | 0.8750 | 1.1650 | 0.9599 |
Fenvalerate | 0.7246 | 1.1369 | 1.1844 |
Ferrous lactate | 0.8359 | 0.5867 | 1.5774 |
Flamprop-M | 1.0535 | 0.9539 | 0.9962 |
Flavanone 7-O-[alpha-L-rhamnosyl-(1->2)-beta-D-glucoside] | 1.6817 | 0.4254 | 0.9977 |
Flavonol 3-O-D-xylosylglucoside | 2.1221 | 0.2224 | 0.4828 |
Fluazifop | 1.5333 | 0.8138 | 0.6529 |
Forchlorfenuron_1 | 0.5945 | 1.8119 | 0.7560 |
Forchlorfenuron_2 | 1.4411 | 1.1466 | 0.4123 |
Forchlorfenuron_3 | 1.1873 | 0.6233 | 1.1893 |
Forchlorfenuron_4 | 1.6634 | 0.6869 | 0.6497 |
Fraxin_1 | 1.0485 | 0.7235 | 1.2280 |
Fraxin_2 | 0.7892 | 0.8581 | 1.3527 |
Fraxin_3 | 0.7751 | 0.9918 | 1.2331 |
Fraxin_4 | 0.4535 | 1.3372 | 1.2093 |
Fructoselysine | 1.2817 | 0.4501 | 1.2683 |
Funebrine | 0.9352 | 1.4294 | 0.6353 |
Furamizole | 0.1107 | 0.2346 | 2.6547 |
Furcatin | 0.7179 | 1.2962 | 0.9859 |
Furmecyclox | 0.9457 | 1.1096 | 0.9447 |
Fusarenone X_1 | 1.6678 | 0.2826 | 1.0495 |
Fusarenone X_2 | 1.7993 | 0.4962 | 0.7045 |
Gallate | 0.3211 | 0.2414 | 2.4374 |
gamma-Glutamyl-gamma-aminobutyraldehyde | 1.3377 | 0.7129 | 0.9495 |
gamma-Glutamyltyramine | 0.8869 | 1.1399 | 0.9732 |
gamma-L-Glutamyl-D-alanine | 1.0707 | 0.9470 | 0.9823 |
gamma-L-Glutamyl-L-cysteine | 0.0072 | 0.0058 | 5.5704 |
gamma-Undecalactone | 0.8961 | 1.0863 | 1.0175 |
Gardenoside | 2.4767 | 0.3974 | 0.1258 |
Genipin_1 | 1.0668 | 0.6589 | 1.2743 |
Genipin_2 | 0.4685 | 2.1394 | 0.3921 |
Genipin_3 | 2.5672 | 0.1785 | 0.2543 |
Gentiopicrin_1 | 1.5882 | 0.8041 | 0.6077 |
Gentiopicrin_2 | 0.4691 | 1.3806 | 1.1503 |
Gentiopicrin_3 | 1.2692 | 0.9076 | 0.8233 |
Gentiopicrin_4 | 0.4554 | 2.0748 | 0.4698 |
Gibberellin A44 diacid | 1.8563 | 0.9570 | 0.1867 |
Glaucarubin_1 | 0.9671 | 0.8075 | 1.2254 |
Glaucarubin_2 | 1.3388 | 1.2835 | 0.3777 |
Glaucarubin_3 | 0.8121 | 0.9253 | 1.2626 |
Glucocleomin | 1.5710 | 0.3570 | 1.0128 |
Glucoiberverin | 0.8025 | 1.2171 | 0.9804 |
Glucose/Fructose [M+Cl]- | 1.2051 | 0.8865 | 0.9084 |
Glucotropaeolin | 0.9658 | 1.0514 | 0.9828 |
Glucovanillin_1 | 1.5126 | 0.5414 | 0.9460 |
Glucovanillin_2 | 0.7596 | 0.8394 | 1.4010 |
Glucovanillin_3 | 1.2062 | 0.8770 | 0.9167 |
Glutamine | 1.0671 | 0.9582 | 0.9747 |
GLYCEROL 2-PHOSPHATE | 1.0154 | 1.0559 | 0.9287 |
Glycerophosphoglycerol | 1.5462 | 0.6523 | 0.8015 |
Glycochenodeoxycholate 7-sulfate | 1.2778 | 0.5690 | 1.1629 |
Glycocholate | 1.2423 | 0.6217 | 1.1360 |
Glycodeoxycholate | 1.3845 | 0.6919 | 0.9236 |
Glycyl-leucine_1 | 0.7717 | 0.9642 | 1.2642 |
Glycyl-leucine_2 | 2.6335 | 0.0039 | 0.3626 |
Grandidentatin_1 | 0.5513 | 0.4543 | 1.9944 |
Grandidentatin_2 | 0.9839 | 0.6488 | 1.3674 |
Graphinone | 1.3936 | 0.8863 | 0.7201 |
Guanidinoethyl methyl phosphate_1 | 1.0673 | 0.8106 | 1.1221 |
Guanidinoethyl methyl phosphate_2 | 1.2023 | 0.8257 | 0.9720 |
Guanidinoethyl methyl phosphate_3 | 1.3566 | 0.5145 | 1.1289 |
GW 9662 | 1.1542 | 0.7056 | 1.1402 |
HC Blue No.1 | 0.9055 | 1.7312 | 0.3633 |
HC Blue No. 2_1 | 1.2700 | 0.8726 | 0.8574 |
HC Blue No. 2_2 | 1.2219 | 1.2020 | 0.5762 |
HC-toxin_1 | 0.8723 | 1.0172 | 1.1104 |
HC-toxin_2 | 1.4192 | 0.8097 | 0.7712 |
Hellicoside | 1.9798 | 0.0007 | 0.0495 |
Hesperetin | 0.6646 | 1.5910 | 0.7444 |
Hesperetin 7-O-glucoside | 2.1186 | 0.0621 | 0.6724 |
Heterocladol | 0.4246 | 0.6556 | 1.9198 |
Hexaflumuron | 1.4515 | 0.8615 | 0.6986 |
Hinokitiol glucoside | 0.4893 | 0.9877 | 1.5230 |
Histidine | 1.0791 | 0.8376 | 1.0833 |
Hordatine A | 1.1707 | 0.7658 | 1.0635 |
Hymenoxon | 0.3876 | 2.3023 | 0.3100 |
Hymexazol O-glucoside | 0.8886 | 0.9679 | 1.1436 |
Hyoscyamine methylbromide | 1.1967 | 0.8398 | 0.9636 |
Hypoglycin B | 1.2043 | 0.5698 | 1.2259 |
Hypoxylone | 1.1297 | 0.9265 | 0.9439 |
Indolelactate | 0.9733 | 0.9785 | 1.0483 |
Indolepyruvate | 0.7409 | 1.1288 | 1.1303 |
Inosine | 1.1433 | 1.0948 | 0.7620 |
ISOCITRIC ACID | 1.2065 | 0.8364 | 0.9571 |
Isofenphos | 1.0869 | 0.9253 | 0.9878 |
Isopentenyladenosine-5^-diphosphate | 1.1038 | 0.8727 | 1.0235 |
Isoscoparine_1 | 0.5622 | 1.2381 | 1.2480 |
Isoscoparine_2 | 0.5181 | 1.1579 | 1.3697 |
Isosorbide mononitrate | 1.0096 | 0.9793 | 1.0111 |
Isotan B_1 | 1.3187 | 0.8717 | 0.8096 |
Isotan B_2 | 1.3966 | 0.9291 | 0.6743 |
Kaempferol 3-sophorotrioside | 1.0593 | 0.8851 | 1.0556 |
Kanamycin B | 1.0069 | 0.9501 | 1.0429 |
Kolaflavanone | 2.1145 | 0.0459 | 0.0699 |
L-2,3-Dihydrodipicolinate | 0.8054 | 1.3863 | 0.8083 |
L-Adrenaline | 0.2481 | 0.3513 | 2.4006 |
Lamioside | 1.7152 | 0.6357 | 0.6491 |
L-Ascorbic acid-2-glucoside | 0.8379 | 0.9904 | 1.1718 |
Laserpitin | 1.1981 | 1.0085 | 0.8083 |
L-Cladinose | 1.0374 | 1.0012 | 0.9614 |
Lecanoric acid | 1.4113 | 1.0464 | 0.5423 |
Leflunomide | 1.1544 | 1.0507 | 0.7948 |
Leonuridine_1 | 1.8303 | 0.5551 | 0.6146 |
Leonuridine_2 | 1.0678 | 0.7513 | 1.1810 |
Leucomethylene blue | 0.7404 | 0.5177 | 1.7418 |
L-Formylkynurenine | 2.0174 | 0.0463 | 0.9363 |
Linezolid_1 | 1.0049 | 1.1011 | 0.8940 |
Linezolid_2 | 0.9189 | 1.2544 | 0.8267 |
Lipoamide | 1.3412 | 0.9883 | 0.6705 |
Lithospermoside | 1.0783 | 1.0343 | 0.8874 |
LL-2,6-Diaminoheptanedioate_1 | 1.3429 | 0.8427 | 0.8143 |
LL-2,6-Diaminoheptanedioate_2 | 1.7171 | 0.5721 | 0.7108 |
L-Mimosine | 1.1467 | 0.9336 | 0.9197 |
Loganin | 1.1424 | 0.7614 | 1.0962 |
Lophophorine | 1.3389 | 0.8440 | 0.8171 |
Loxapine | 0.6073 | 2.2390 | 0.1537 |
L-Tyrosine methyl ester | 0.9896 | 0.9828 | 1.0275 |
L-Tyrosine methyl ester 4-sulfate | 1.2691 | 1.0405 | 0.6904 |
Lusitanicoside | 1.0020 | 0.8397 | 1.1583 |
Lysine | 1.3757 | 0.6230 | 1.0013 |
Maculosin | 0.8517 | 1.5242 | 0.6241 |
Mallotophenone | 2.6950 | 0.0567 | 0.2482 |
Mangiferin | 0.7459 | 0.1862 | 2.1314 |
Medicarpin 3-O-glucoside-6^-malonate | 1.3039 | 0.6858 | 0.9894 |
Menazon | 1.0512 | 1.0131 | 0.9358 |
Mercury(2+) | 0.9453 | 1.0279 | 1.0268 |
Metaxalone | 1.1325 | 0.9497 | 0.9178 |
Metazachlor | 1.0358 | 0.8806 | 1.0836 |
Metconazole | 0.9974 | 0.7907 | 1.2120 |
Meteloidine | 3.0742 | 0.0622 | 0.0787 |
Methapyrilene | 0.9179 | 0.9720 | 1.1101 |
Methyl 2-diazoacetamidohexonate_1 | 0.9082 | 0.9136 | 1.1782 |
Methyl 2-diazoacetamidohexonate_2 | 0.8056 | 0.9834 | 1.2110 |
Methyldopa anhydrous_1 | 0.5395 | 1.5043 | 0.9562 |
Methyldopa anhydrous_2 | 0.9890 | 1.6047 | 0.4063 |
Midazolam | 1.3637 | 0.8846 | 0.7516 |
Midodrine | 1.1469 | 0.8353 | 1.0178 |
Miraxanthin-II_1 | 1.9702 | 0.3322 | 0.4726 |
Miraxanthin-II_2 | 2.6708 | 0.1134 | 0.0964 |
Mitomycin | 0.4895 | 1.2301 | 1.2804 |
MK 571 | 1.8690 | 0.3389 | 0.7921 |
Moricizine | 1.4359 | 0.7213 | 0.8427 |
Morphine-6-glucuronide | 2.2772 | 0.0015 | 0.1098 |
Moxifloxacin | 0.4058 | 1.4654 | 1.1289 |
Musca-aurin-VII | 1.1584 | 0.9279 | 0.9136 |
N-(2,3-Dihydroxybenzoyl)-L-serine_1 | 1.2148 | 0.8885 | 0.8967 |
N-(2,3-Dihydroxybenzoyl)-L-serine_2 | 0.9583 | 0.6982 | 1.3435 |
N2-Acetyl-L-aminoadipate_1 | 0.9865 | 0.4865 | 1.5270 |
N2-Acetyl-L-aminoadipate_2 | 1.2522 | 0.8842 | 0.8636 |
N2-Acetyl-L-aminoadipate_3 | 1.3325 | 0.7746 | 0.8928 |
N7-Methylguanosine | 1.1987 | 0.9652 | 0.8362 |
N-Acetylaspartylglutamate_1 | 1.0066 | 0.9619 | 1.0315 |
N-Acetylaspartylglutamate_2 | 1.2377 | 0.8265 | 0.9358 |
N-Acetyl-D-fucosamine | 1.3690 | 0.7406 | 0.8904 |
N-ACETYL-DL-GLUTAMIC ACID | 1.0383 | 0.8956 | 1.0661 |
N-ACETYL-D-MANNOSAMINE | 1.1159 | 0.9283 | 0.9557 |
N-Acetyl-D-tryptophan | 1.0596 | 1.0221 | 0.9183 |
N-Acetylglucosamine 4-sulfate | 1.0979 | 0.9693 | 0.9328 |
N-Acetyl-L-glutamate 5-semialdehyde | 1.2879 | 0.7538 | 0.9584 |
N-Acetyl-L-leucine_1 | 1.0528 | 0.9185 | 1.0288 |
N-Acetyl-L-leucine_2 | 0.9407 | 0.8936 | 1.1657 |
N-Acetyl-L-leucine_3 | 1.0223 | 1.0092 | 0.9685 |
N-Acetyl-L-phenylalanine | 1.2180 | 0.8021 | 0.9799 |
N-ACETYLNEURAMINATE | 1.0187 | 0.9776 | 1.0038 |
N-Acetylornithine | 2.0450 | 0.3036 | 0.6514 |
N(alpha)-Benzyloxycarbonyl-L-leucine | 0.8412 | 1.3515 | 0.8073 |
N-AMIDINO-L-ASPARTATE | 1.1564 | 1.3255 | 0.5181 |
Naringenin 7-O-beta-D-glucoside | 0.8528 | 0.7197 | 1.4275 |
N-Benzyloxycarbonylglycine_1 | 1.2052 | 0.7925 | 1.0023 |
N-Benzyloxycarbonylglycine_2 | 0.3746 | 0.3315 | 2.2939 |
N-Carbamyl-L-glutamate | 0.7188 | 1.0207 | 1.2605 |
Neostigmine bromide_1 | 1.1726 | 0.6174 | 1.2100 |
Neostigmine bromide_2 | 0.3891 | 0.7651 | 1.8457 |
Neostigmine bromide_3 | 1.7131 | 0.6687 | 0.6182 |
N-Feruloylglycine | 1.0503 | 0.7034 | 1.2463 |
N-Heptanoylhomoserine lactone | 1.3245 | 0.8942 | 0.7813 |
Nicotianamine | 1.0579 | 1.1571 | 0.7850 |
Nicotinurate_1 | 0.7402 | 0.5627 | 1.6971 |
Nicotinurate_2 | 0.9787 | 0.8952 | 1.1261 |
Niflumic acid_1 | 0.8408 | 0.4464 | 1.7127 |
Niflumic acid_2 | 1.0219 | 1.0633 | 0.9148 |
Nitrogen mustard | 1.8352 | 0.3630 | 0.7876 |
Nitrovin | 1.1881 | 0.7536 | 1.0583 |
N,N-Bis(2-chloroethyl)-DL-alanine hydrochloride | 2.3549 | 0.0139 | 0.1081 |
Nocardicin C | 1.1053 | 0.8620 | 1.0327 |
Octamethyltrisiloxane | 0.9992 | 0.8565 | 1.1443 |
Ofloxacin_1 | 0.6702 | 1.1763 | 1.1535 |
Ofloxacin_2 | 1.9657 | 0.6816 | 0.3527 |
O-Propanoylcarnitine | 1.1107 | 0.8555 | 1.0338 |
Oseltamivir | 1.4173 | 0.7221 | 0.8607 |
O-Succinyl-L-homoserine | 1.0874 | 0.9380 | 0.9745 |
Oxalosuccinate | 2.1314 | 0.3771 | 0.4915 |
Oxazepam | 0.0852 | 2.8736 | 0.0413 |
Oxaziclomefone | 2.6786 | 0.1085 | 0.1363 |
Oxmetidine | 0.6352 | 0.9952 | 1.3695 |
Ozagrel hydrochloride | 1.1173 | 1.0250 | 0.8577 |
Paeonolide | 1.0760 | 0.8167 | 1.1073 |
Panfuran S | 1.0741 | 0.8819 | 1.0439 |
Pantothenate | 1.0191 | 0.8519 | 1.1291 |
Pantothenol | 0.5537 | 1.9989 | 0.2519 |
Parsonsine | 3.5857 | 0.0057 | 0.0054 |
Paucin | 1.2851 | 0.7646 | 0.9504 |
Pendimethalin | 1.2134 | 1.1552 | 0.6314 |
Pentahomomethionine | 1.0655 | 0.9194 | 1.0150 |
Pentamidine | 1.7268 | 0.7919 | 0.4813 |
Perindopril | 0.9405 | 0.6608 | 1.3987 |
Perseitol_1 | 1.2717 | 0.9991 | 0.7291 |
Perseitol_2 | 0.3524 | 2.2710 | 0.3765 |
Phenylacetylglutamine | 1.1520 | 0.8766 | 0.9713 |
Phenylgalactoside_1 | 1.2172 | 0.8857 | 0.8970 |
Phenylgalactoside_2 | 0.6529 | 0.3395 | 2.0077 |
Phenylgalactoside_3 | 1.5247 | 0.6741 | 0.8012 |
Phenylmethanesulfonyl fluoride_1 | 1.1357 | 0.8269 | 1.0373 |
Phenylmethanesulfonyl fluoride_2 | 1.1448 | 0.7978 | 1.0574 |
Phenylpyruvate | 2.3635 | 0.2632 | 0.3734 |
PHOSPHOCHOLINE | 1.2809 | 0.8615 | 0.8576 |
Phosphoramide mustard | 2.7204 | 0.1324 | 0.1472 |
p-Hydroxyphenylacetothiohydroximate_1 | 2.5899 | 0.0108 | 0.2857 |
p-Hydroxyphenylacetothiohydroximate_2 | 2.4994 | 0.0110 | 0.2589 |
Plumieride | 1.0428 | 1.1259 | 0.8313 |
Podophyllotoxone | 0.9575 | 1.0963 | 0.9462 |
Polypodine B | 1.1622 | 0.6793 | 1.1585 |
Porphobilinogen | 1.3555 | 0.9023 | 0.7422 |
Portulacaxanthin II | 1.5542 | 0.7054 | 0.7404 |
Potassium cyanate_1 | 0.5007 | 0.2922 | 2.2072 |
Potassium cyanate_2 | 1.7306 | 0.7135 | 0.5558 |
Potassium cyanate_3 | 0.4499 | 1.9753 | 0.5748 |
Potassium cyanate_4 | 1.4141 | 0.3024 | 1.2835 |
p,p^-Methoxychlor olefin | 1.0846 | 0.6511 | 1.2643 |
Prodiamine | 1.3544 | 0.9166 | 0.7290 |
Prontosil | 0.2658 | 0.2204 | 2.5138 |
Propachlor_1 | 0.9414 | 1.5462 | 0.4775 |
Propachlor_2 | 1.6802 | 0.8256 | 0.4942 |
Propanethial S-oxide | 1.8143 | 0.6330 | 0.5527 |
Propantheline chloride | 1.5329 | 0.7807 | 0.6864 |
Proparacaine | 1.1591 | 0.5836 | 1.3001 |
Propyzamide_1 | 1.3089 | 0.6776 | 1.0134 |
Propyzamide_2 | 1.7464 | 0.5487 | 0.6516 |
Prostaglandin G2 | 1.5859 | 0.8024 | 0.6117 |
Psicofuranine | 1.1052 | 0.9362 | 0.9587 |
Pulcherriminic acid | 1.0617 | 0.9054 | 1.0328 |
Pydanon | 1.0780 | 0.9628 | 0.9592 |
Pyricarbate | 1.1921 | 0.7356 | 1.0723 |
Pyridaben | 1.0952 | 0.8343 | 1.0704 |
Quercetin 3-O-glucoside | 0.6893 | 0.6938 | 1.5694 |
Quercitrin_1 | 0.7426 | 0.9290 | 1.3283 |
Quercitrin_2 | 0.7996 | 0.8275 | 1.3729 |
Quetiapine | 1.9926 | 0.3988 | 0.5260 |
Quinate | 2.1223 | 0.7489 | 0.1287 |
Quinoclamin | 0.0348 | 0.0308 | 2.9344 |
Quinolinate | 1.0256 | 0.8429 | 1.1315 |
Quizalofop-ethyl | 1.2063 | 0.6578 | 1.1359 |
(R)-2-Hydroxybutane-1,2,4-tricarboxylate_1 | 1.3358 | 0.9677 | 0.6964 |
(R)-2-Hydroxybutane-1,2,4-tricarboxylate_2 | 0.0371 | 0.0387 | 2.9242 |
(R)-2-Hydroxybutane-1,2,4-tricarboxylate_3 | 0.9665 | 1.3784 | 0.6552 |
(R)-2-Hydroxybutane-1,2,4-tricarboxylate_4 | 1.2368 | 0.9371 | 0.8261 |
(R)-3-((R)-3-Hydroxybutanoyloxy)butanoate_1 | 1.1151 | 0.8625 | 1.0224 |
(R)-3-((R)-3-Hydroxybutanoyloxy)butanoate_2 | 0.9759 | 0.9891 | 1.0350 |
(R)-3-((R)-3-Hydroxybutanoyloxy)butanoate_3 | 0.9910 | 0.9926 | 1.0165 |
Reduced riboflavin_1 | 1.1643 | 0.9140 | 0.9218 |
Reduced riboflavin_2 | 0.9479 | 1.3552 | 0.6968 |
Reduced riboflavin_3 | 0.9200 | 0.6154 | 1.4646 |
Rehmaionoside A_1 | 0.5047 | 0.3126 | 2.1826 |
Rehmaionoside A_2 | 1.6898 | 0.4043 | 0.9059 |
Rehmaionoside C_1 | 1.1023 | 0.9188 | 0.9789 |
Rehmaionoside C_2 | 1.0747 | 0.4593 | 1.4659 |
Rhododendrin_1 | 1.0492 | 1.0818 | 0.8689 |
Rhododendrin_2 | 1.0932 | 1.1904 | 0.7163 |
(R)-(Homo)2-citrate_1 | 0.7455 | 1.1955 | 1.0590 |
(R)-(Homo)2-citrate_2 | 1.2981 | 0.5740 | 1.1279 |
(R)-(Homo)2-citrate_3 | 0.1269 | 0.1763 | 2.6968 |
Riboflavin | 0.9955 | 0.9208 | 1.0837 |
Ripazepam_1 | 1.0900 | 0.5355 | 1.3745 |
Ripazepam_2 | 0.9166 | 0.8830 | 1.2004 |
Ripazepam_3 | 1.3446 | 0.8374 | 0.8181 |
Ripazepam_4 | 1.0545 | 0.5821 | 1.3633 |
Rishitin | 1.0016 | 0.9885 | 1.0100 |
Robustine | 2.0255 | 0.4601 | 0.5144 |
Rosmarinine | 0.4121 | 2.3168 | 0.2711 |
S-(2-Hydroxyethyl)-N-acetyl-L-cysteine | 1.2800 | 1.0138 | 0.7062 |
S-(2-Methylpropanoyl)-dihydrolipoamide | 1.1767 | 0.8070 | 1.0163 |
(S)-ACPA | 1.6058 | 0.4821 | 0.8776 |
Salidroside | 1.0614 | 1.3852 | 0.5534 |
(S)-ATPA_1 | 0.9041 | 1.0319 | 1.0640 |
(S)-ATPA_2 | 0.9440 | 1.2898 | 0.7662 |
S-Carboxymethyl-L-cysteine | 1.4135 | 1.0622 | 0.5243 |
Schizonepetoside E_1 | 0.9528 | 0.2116 | 1.8356 |
Schizonepetoside E_2 | 0.6754 | 1.5057 | 0.8189 |
Schizonepetoside E_3 | 1.0121 | 0.4929 | 1.4950 |
Schizonepetoside E_4 | 0.6463 | 0.5361 | 1.8177 |
Scopoletin | 0.1027 | 0.1522 | 2.7451 |
Scytalone_1 | 1.2461 | 0.8489 | 0.9050 |
Scytalone_2 | 0.8617 | 1.7009 | 0.4374 |
Sebacic acid_1 | 1.1161 | 0.8882 | 0.9957 |
Sebacic acid_2 | 0.9358 | 0.8535 | 1.2107 |
Secologanate_1 | 1.0557 | 0.9666 | 0.9777 |
Secologanate_2 | 0.9958 | 1.0339 | 0.9703 |
Secologanate_3 | 2.0429 | 0.3854 | 0.5718 |
Secologanin | 1.0527 | 0.6967 | 1.2506 |
Sedoheptulose_1 | 1.0424 | 1.0059 | 0.9517 |
Sedoheptulose_2 | 1.5550 | 0.8764 | 0.5685 |
Sesamex_1 | 1.8514 | 0.5463 | 0.6024 |
Sesamex_2 | 0.7026 | 1.9480 | 0.3495 |
Shanzhiside | 1.8091 | 0.6193 | 0.5716 |
S-(Hydroxyphenylacetothiohydroximoyl)-L-cysteine | 2.7739 | 0.0118 | 0.2143 |
Sinapate_1 | 1.9555 | 0.3968 | 0.6477 |
Sinapate_2 | 0.5278 | 0.8101 | 1.6620 |
Sinapate_3 | 0.7992 | 0.2513 | 1.9495 |
Sinapate_4 | 1.7822 | 0.3567 | 0.8611 |
Sinapyl alcohol | 0.7806 | 1.6917 | 0.5277 |
sn-Glycero-3-phosphocholine_1 | 1.4629 | 0.8625 | 0.6747 |
sn-Glycero-3-phosphocholine_2 | 1.9987 | 0.3011 | 0.7003 |
Spectinomycin dihydrochloride | 1.4119 | 1.0131 | 0.5750 |
S-Ribosyl-L-homocysteine | 0.8994 | 0.9833 | 1.1173 |
S,S-Dimethyl-beta-propiothetin | 1.2154 | 0.9258 | 0.8588 |
S-Sulfo-L-cysteine | 1.0168 | 0.9412 | 1.0419 |
Sterigmatocystin | 0.2802 | 0.3733 | 2.3047 |
Suberic acid | 0.9661 | 0.9787 | 1.0551 |
Sucralose | 0.1072 | 0.1149 | 2.3628 |
Sulbactam | 1.3636 | 0.8694 | 0.7671 |
Sulfometuron methyl | 0.9296 | 1.0270 | 1.0433 |
Sulfoquinovose_1 | 0.8488 | 0.4939 | 1.6573 |
Sulfoquinovose_2 | 0.7193 | 0.6807 | 1.6000 |
Sulmazole_1 | 0.0593 | 0.0504 | 2.8903 |
Sulmazole_2 | 1.3542 | 0.9733 | 0.6725 |
Sulochrin | 0.7723 | 0.3361 | 1.8173 |
Syringin | 0.2032 | 0.7527 | 2.0898 |
Tabtoxin | 0.7929 | 1.6486 | 0.5585 |
Tabtoxinine-beta-lactam_1 | 0.8805 | 0.9347 | 1.1848 |
Tabtoxinine-beta-lactam_2 | 2.5636 | 0.2192 | 0.2173 |
Tarennoside | 1.3406 | 1.2707 | 0.3887 |
Tauropine | 1.0872 | 0.9425 | 0.9703 |
Tentoxin_1 | 0.9128 | 1.0180 | 1.0691 |
Tentoxin_2 | 0.6663 | 0.2564 | 2.0773 |
Tentoxin_3 | 1.0012 | 0.9485 | 1.0503 |
Tentoxin_4 | 0.6662 | 1.5449 | 0.7889 |
Tentoxin_5 | 1.2762 | 0.7142 | 1.0096 |
Testolate | 0.6347 | 1.0474 | 1.2558 |
Testosterone glucuronide | 1.0556 | 0.9220 | 1.0224 |
Tetraneurin A | 1.3523 | 0.6495 | 0.9983 |
Thalassemine_1 | 0.8690 | 1.0325 | 1.0984 |
Thalassemine_2 | 0.2495 | 1.5945 | 1.1560 |
Thalassemine_3 | 0.8800 | 1.1322 | 0.9878 |
Thalicarpine | 1.6623 | 0.4960 | 0.7641 |
Theogallin | 0.8410 | 0.5013 | 1.6577 |
Thiamin diphosphate | 0.0332 | 0.0318 | 2.8704 |
Thiamin monophosphate | 0.8026 | 0.4873 | 1.7102 |
Thienodolin | 1.2509 | 0.3458 | 1.4033 |
Thiolactomycin | 1.1279 | 1.0635 | 0.8086 |
Thiorphan | 0.6182 | 0.9427 | 1.4391 |
Threonine | 0.9699 | 0.9602 | 1.0699 |
THTA | 1.6991 | 0.6119 | 0.6890 |
Tobramycin | 1.1064 | 0.9210 | 0.9726 |
Tolcapone_1 | 1.6877 | 0.5590 | 0.7533 |
Tolcapone_2 | 1.3026 | 0.7710 | 0.9264 |
Tramadol | 0.3072 | 2.4346 | 0.2527 |
trans-Cinnamoyl beta-D-glucoside | 0.7621 | 0.6063 | 1.6316 |
Traumatic acid_1 | 1.0372 | 1.0443 | 0.9185 |
Traumatic acid_2 | 2.3918 | 0.2065 | 0.4017 |
Triadimefon | 1.0876 | 0.9570 | 0.9554 |
Triadimenol | 0.6496 | 0.8348 | 1.5157 |
Tributyltin chloride_1 | 1.2911 | 0.9684 | 0.7405 |
Tributyltin chloride_2 | 1.0863 | 0.4150 | 1.4987 |
Tributyltin chloride_3 | 1.3749 | 1.0628 | 0.5623 |
Tributyrin_1 | 1.7708 | 0.6991 | 0.5301 |
Tributyrin_2 | 1.6617 | 0.6537 | 0.6846 |
Triethylene glycol diglycidyl ether_1 | 1.0208 | 1.1870 | 0.7922 |
Triethylene glycol diglycidyl ether_2 | 1.4184 | 0.4616 | 1.1199 |
Triflumuron | 1.7930 | 1.0537 | 0.1533 |
Trimetaphosphoric acid | 0.9231 | 1.1268 | 0.9502 |
Trimethoprim | 2.4511 | 0.2700 | 0.2790 |
Triticonazole | 1.1480 | 0.9311 | 0.9210 |
Tryptophan | 0.9599 | 0.8152 | 1.2249 |
Tuberonic acid glucoside_1 | 1.3922 | 0.6919 | 0.9159 |
Tuberonic acid glucoside_2 | 0.9673 | 0.7966 | 1.2360 |
Tuliposide B | 1.0644 | 0.8735 | 1.0621 |
Tussilagine | 1.1028 | 0.8780 | 1.0192 |
Umbelliferone | 1.4241 | 0.8822 | 0.6936 |
Ungeremine | 0.9101 | 1.4733 | 0.6166 |
Urate | 1.0163 | 0.9213 | 1.0624 |
Urate-3-ribonucleoside | 1.0850 | 0.8730 | 1.0420 |
Uridine | 1.0383 | 0.9277 | 1.0340 |
Valacyclovir | 0.2435 | 0.2692 | 2.4874 |
Vermelone | 1.0588 | 1.2900 | 0.6263 |
Verrucarin A | 2.0243 | 0.2387 | 0.6784 |
Versicolorin B | 0.2268 | 0.2224 | 2.5508 |
Versiconal | 1.1074 | 1.0643 | 0.8283 |
Vitexin_1 | 1.3733 | 0.5029 | 1.1238 |
Vitexin_2 | 1.2723 | 0.5249 | 1.1711 |
Xanthosine_1 | 1.1023 | 0.9826 | 0.9151 |
Xanthosine_2 | 1.1786 | 0.8508 | 0.9706 |
Zalcitabine | 1.1224 | 1.1574 | 0.7203 |
Zinnimidine | 0.0107 | 2.9741 | 0.0149 |
Zizybeoside I | 0.8716 | 0.8134 | 1.3149 |
Zoxazolamine | 1.3089 | 0.9201 | 0.7710 |
Factors:
F1 | Treatment :Baseline urine |
F2 | Treatment :Urine after drinking apple juice |
F3 | Treatment :Urine after drinking cranberry juice |