Metabolite_name RefMet_name B01 B02 B03 B05 B06 B07 B08 B09 B10 B11 B12 B14 B15 B16 D01 D02 D03 D04 D05 D06 D07 D08 D09 D10 D11 D12 D13 D14 Factors - Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Bipolar Condition:Control Condition:Control Condition:Control Condition:Control Condition:Control Condition:Control Condition:Control Condition:Control Condition:Control Condition:Control Condition:Control Condition:Control Condition:Control Condition:Control 2-hydroxybutyric acid 2-Hydroxybutyric acid -4.2918 -5.9606 -7.3758 -5.0507 -5.9999 -5.6100 -6.6648 -5.3119 -5.7602 -4.9985 -7.0949 -5.8431 -5.4493 -5.0368 -4.1655 -7.1939 -5.7942 -6.4765 -7.6499 -7.7219 -5.6489 -6.0892 -4.8601 -6.5661 -6.0426 -5.8430 -6.1039 -5.8828 2-ketocaproic acid 2-Ketocaproic acid -9.5558 -9.4430 -9.5054 -10.1050 -9.3481 -9.7211 -9.8572 -9.7635 -9.6416 -8.6713 -9.6316 -9.8225 -9.9462 -9.4539 -11.2423 -9.9263 -9.6037 -9.5491 -9.4664 -9.6843 -9.3345 -9.5130 -9.4356 -9.2700 -9.4287 -9.3203 -9.5225 -9.4367 2-ketoisocaproic acid Ketoleucine -7.6606 -7.9963 -8.1435 -8.0074 -7.9997 -7.7328 -7.8437 -8.0789 -7.7091 -11.4130 -7.6240 -7.6029 -7.7026 -7.1386 -6.9494 -7.9161 -7.7632 -7.4328 -7.9833 -7.9284 -7.6972 -7.2013 -7.4746 -7.7038 -7.7467 -7.3959 -7.9332 -7.4313 2-ketoisocaproic acid 2 Ketoleucine -8.3994 -8.8684 -9.4324 -9.1116 -8.8377 -9.3391 -9.3644 -8.3745 -9.0005 -8.2352 -9.1559 -8.8542 -8.5261 -8.5913 -8.1213 -9.8559 -9.1242 -8.5656 -9.2174 -8.8878 -8.2174 -8.7216 -8.9008 -9.2777 -9.7991 -8.8525 -9.7125 -8.7254 3-hydroxypyridine 3-Hydroxypyridine -8.7528 -7.5042 -9.0425 -10.0046 -7.4272 -9.0612 -8.1835 -9.5342 -8.3204 -23.6865 -8.1620 -7.6173 -7.6227 -7.5384 -21.4055 -8.3114 -7.5030 -7.6598 -7.8500 -7.5420 -7.6854 -7.5993 -7.6573 -7.2569 -7.5175 -7.4762 -7.6079 -7.4890 3-indoleacetic acid Indoleacetic acid -10.8026 -10.3168 -12.7309 -14.0229 -8.0881 -12.9136 -8.1512 -13.4021 -8.8842 -11.4295 -12.0287 -9.4230 -7.8980 -8.0700 -21.4055 -10.5057 -9.8878 -10.9616 -10.0089 -9.4170 -9.3516 -8.6616 -9.9253 -9.4689 -8.9882 -9.8858 -9.8499 -8.8517 alpha tocophereol alpha-Tocopherol -11.2011 -9.8910 -11.1078 -12.4938 -10.1919 -10.3249 -10.8097 -10.3912 -10.2046 -11.0411 -11.9182 -9.9813 -10.0241 -9.7889 -21.4055 -10.7053 -9.3819 -10.6350 -9.5163 -10.7419 -9.4300 -9.6120 -10.2598 -9.8064 -9.7124 -10.1362 -10.4196 -10.5261 arachidic acid Arachidic acid -7.1703 -6.7472 -7.8428 -8.8421 -6.4925 -8.0811 -7.0971 -8.3613 -7.0864 -7.5574 -8.2887 -6.5470 -6.6128 -6.7815 -9.3484 -7.3304 -6.5376 -7.0680 -6.6261 -7.3388 -6.3507 -6.6137 -6.7423 -6.5242 -6.6062 -6.3503 -6.4241 -6.5063 aspartic acid Aspartic acid -10.6280 -10.0630 -14.3316 -22.7815 -11.1815 -14.3873 -10.0507 -14.6123 -12.0030 -13.7884 -14.6019 -8.3312 -8.5922 -7.9487 -21.4055 -9.7626 -9.6458 -13.0337 -10.4520 -13.2882 -8.7998 -8.7842 -8.0702 -10.5367 -10.7808 -8.9360 -9.0608 -10.9394 aspartic acid 2 Aspartic acid -11.4645 -8.2404 -23.5045 -22.7815 -9.6095 -23.5638 -10.0420 -23.5983 -10.7759 -23.6865 -23.4551 -8.6597 -8.3111 -8.1382 -21.4055 -11.3747 -11.5567 -11.1387 -11.9462 -14.9555 -8.0511 -7.4638 -8.2142 -8.4429 -8.9397 -9.7084 -7.8835 -9.3589 benzoic acid Benzoic acid -6.6595 -6.3885 -6.5021 -7.1137 -6.2556 -6.5537 -6.7709 -6.7422 -6.6470 -6.4566 -6.4088 -6.4935 -6.4190 -6.3935 -5.8705 -6.8989 -6.4895 -6.7391 -6.6743 -6.6490 -6.4666 -6.5211 -6.4406 -6.4563 -6.5907 -6.4213 -6.6411 -6.4268 cholesterol Cholesterol -2.3878 -2.0763 -2.4444 -4.7086 -1.1956 -2.7323 -1.9309 -2.0860 -2.0007 -2.3274 -2.9579 -1.9016 -1.6067 -2.2839 -7.4094 -2.2141 -1.5886 -2.2707 -1.4941 -2.2716 -1.3575 -1.5700 -1.6370 -1.5580 -1.4006 -1.6503 -1.6756 -1.6753 citric acid Citric acid -8.6199 -8.5949 -23.5045 -22.7815 -7.4572 -23.5638 -6.6321 -23.5983 -10.7794 -23.6865 -23.4551 -6.6178 -5.8139 -5.5767 -21.4055 -8.6008 -6.9474 -9.8092 -7.7910 -23.5165 -5.5679 -5.4933 -6.4829 -7.1390 -7.7010 -6.5385 -6.2563 -8.7862 D-glucose Glucose 0.3391 0.3744 0.2032 0.7706 0.3095 0.4381 0.4456 0.3689 0.4707 0.5956 0.6937 0.4583 0.3785 0.6542 1.8034 0.6835 0.4777 0.8631 0.5730 0.4594 0.4310 0.7025 0.5406 0.5032 0.6650 0.3165 0.6939 D-glucose 2 Glucose 0.3293 0.3744 0.2032 0.7229 0.3095 0.3496 0.4456 0.2687 0.4036 0.5006 0.7470 0.4491 0.3785 0.6542 1.7787 0.6940 0.4777 0.8537 0.5323 0.4854 0.4118 0.6533 0.5406 0.4399 1.0272 0.6234 0.3274 0.6484 DL-isoleucine Isoleucine -5.1017 -5.0881 -8.9379 -16.1265 -7.2029 -10.8528 -5.8867 -10.6674 -6.3691 -10.2438 -9.9527 -4.9054 -4.9504 -3.8521 -9.4544 -6.4151 -5.5303 -5.1988 -5.4598 -10.4235 -5.2049 -4.5465 -4.4615 -5.7906 -5.6770 -4.6925 -7.1979 -5.5696 D-threitol Threitol -9.5450 -8.5665 -8.7457 -9.5167 -8.8206 -9.6902 -8.9024 -9.1467 -8.7193 -8.7968 -7.9878 -9.0714 -8.9413 -8.2507 -8.3109 -9.4298 -8.7711 -9.0503 -8.9309 -8.4826 -8.8026 -8.6774 -9.3580 -8.8244 -8.8990 -8.9570 -8.8847 -8.9955 fructose Fructose -9.0565 -7.7807 -7.0080 -8.5020 -5.4959 -8.8092 -6.4175 -8.6619 -8.6014 -8.7438 -7.3634 -7.3749 -8.1524 -7.7198 -7.6299 -7.9945 -6.4933 -6.0506 -8.2823 -6.5831 -5.7064 -8.0700 -8.7457 -7.8772 -7.3185 -8.0209 -8.5499 -7.4494 fumaric acid Fumaric acid -10.3120 -9.7877 -11.1620 -22.7815 -10.0190 -10.5529 -10.3339 -10.4501 -10.3349 -10.5224 -10.3155 -9.7781 -10.0570 -9.3670 -21.4055 -10.3987 -9.7538 -9.7899 -10.0861 -10.2770 -9.5386 -9.6601 -9.9915 -9.8331 -10.3219 -9.9672 -9.8569 -10.1413 galactitol (6TMS) Galactitol -0.8625 -0.8615 -1.0200 -0.5030 -0.9012 -0.9088 -0.9578 -0.9401 -0.7248 -0.6739 -0.4489 -0.7979 -0.9752 -0.4828 0.3180 -0.6242 -0.8725 -0.5520 -0.8129 -0.7596 -0.9309 -0.6117 -0.7299 -0.8140 -0.0138 -0.6608 -1.0419 -0.5381 glucose 1_6-anhydro-beta (3TMS) -7.2069 -7.2070 -7.4841 -7.5834 -6.8415 -7.5855 -6.2802 -7.3660 -7.0455 -7.1667 -6.5241 -7.0472 -7.0485 -7.0097 -6.7838 -7.6317 -7.3506 -7.6529 -7.3001 -7.6080 -7.2331 -7.4781 -7.2670 -6.9051 -7.1197 -7.0841 -7.2775 -7.0693 glyceric acid Glyceric acid -9.4389 -9.4352 -9.5989 -10.6404 -9.1548 -9.2166 -10.1180 -9.6092 -9.8119 -9.7971 -9.4468 -8.7244 -9.4177 -8.7288 -10.6935 -9.1425 -8.3531 -8.7855 -8.7109 -8.9822 -9.0299 -9.1586 -9.0312 -9.6196 -9.9130 -9.4830 -9.8585 -10.1128 glycerol Glycerol -4.3833 -4.5276 -5.7423 -4.1984 -4.6832 -3.7022 -4.7273 -4.0235 -5.2921 -4.5138 -4.3490 -4.5945 -3.8852 -4.4627 -3.0342 -4.8553 -4.2859 -4.9976 -4.9406 -5.3972 -4.8892 -4.1426 -3.6760 -4.7834 -5.0070 -4.3507 -4.2397 -5.6034 glycine Glycine -4.3521 -4.2855 -4.1929 -4.5456 -3.9856 -4.5179 -4.5875 -4.5992 -4.3864 -4.2123 -4.1570 -4.1901 -4.2254 -4.3858 -3.4679 -4.4545 -4.3471 -4.5611 -4.4415 -4.3822 -4.2540 -4.3955 -4.2561 -4.2792 -4.3914 -4.0373 -4.1684 -4.1064 glycolic acid Glycolic acid -4.6026 -4.7591 -4.3934 -4.1674 -4.5271 -4.7373 -4.3327 -4.8862 -4.6185 -4.5476 -4.5322 -4.6741 -4.6980 -4.3633 -3.2022 -4.1545 -4.6521 -3.8912 -4.7279 -4.5373 -4.7601 -4.7657 -4.5780 -4.6119 -4.1269 -4.2956 -4.2680 -4.1861 heptadecanoic acid Margaric acid -5.2536 -5.1148 -6.2858 -8.1586 -4.8441 -8.8442 -5.4133 -9.2818 -5.3351 -7.6517 -11.6180 -4.8948 -4.9456 -4.9730 -13.1454 -5.5191 -4.9919 -5.3928 -5.0505 -6.2588 -4.8484 -4.9652 -5.0128 -4.9301 -5.0582 -4.7685 -4.7779 -4.9390 homoserine (4TMS) Homoserine -6.5984 -6.1359 -6.2151 -6.9199 -6.0025 -6.3585 -6.3512 -6.9975 -6.5091 -6.2460 -6.5712 -6.0494 -5.9377 -6.0656 -6.2525 -6.4068 -5.8684 -6.0185 -5.8415 -5.9879 -5.7332 -5.8362 -6.2136 -5.8767 -6.1850 -5.8076 -5.9506 -6.0063 Isoleucine (1TMS) Isoleucine -4.7371 -4.6678 -13.0498 -14.4339 -7.1635 -12.2863 -5.2321 -8.4779 -5.5809 -11.4100 -13.8650 -4.3258 -4.1546 -3.4346 -14.4956 -5.6600 -5.2448 -5.0533 -5.1961 -15.4603 -4.4405 -3.9898 -3.9583 -5.5505 -5.5786 -4.0065 -5.8510 -5.1841 lactose Lactose -23.4800 -10.5344 -12.4735 -22.7815 -11.6506 -23.5638 -10.5359 -23.5983 -10.1897 -15.0387 -23.4551 -8.5753 -8.6525 -12.8947 -21.4055 -14.3870 -13.5187 -14.1087 -10.4534 -11.7328 -12.4208 -12.1202 -13.4569 -13.0609 -11.2662 -12.6197 -10.4585 -12.5221 lauric acid Lauric acid -7.6885 -7.9984 -7.8475 -8.5751 -7.8636 -7.6430 -8.3237 -8.0601 -8.0574 -7.3825 -8.1052 -7.7644 -7.4858 -8.0040 -8.1863 -8.3789 -7.4885 -8.1597 -7.9202 -7.6076 -7.9992 -7.7506 -7.7772 -7.3585 -7.8114 -7.8710 -7.6237 -7.9645 L-(-)-fucose Fucose -8.9301 -8.5941 -8.6449 -9.3846 -8.3151 -8.8270 -8.6738 -8.6176 -8.6215 -8.4862 -8.5801 -8.5298 -8.4004 -8.2516 -7.8381 -9.2117 -8.6458 -8.9590 -8.4171 -8.3927 -8.5459 -8.3863 -8.5971 -8.6156 -8.3407 -8.2761 -8.9366 -8.3754 linoleic acid Linoleic acid -7.2762 -8.0563 -23.5045 -22.7815 -8.8102 -9.2868 -9.3501 -10.8013 -7.5139 -9.9605 -23.4551 -8.5104 -6.1849 -8.1889 -21.4055 -8.6235 -8.2437 -10.2620 -8.8028 -23.5165 -8.3695 -7.6027 -5.9054 -6.4426 -8.9826 -7.6735 -6.0854 -9.5339 L-(+) lactic acid Lactic acid -0.8103 -0.4930 -0.9366 -7.4757 -0.5897 -0.8723 -6.3961 -0.7170 -0.5951 -0.2955 -1.1079 -0.0126 0.0388 -0.2303 -6.1898 -6.9756 -0.5348 -10.9422 -0.8816 -0.4292 -0.3112 -0.8916 -0.6173 -0.8754 -0.0959 -0.7964 -0.8186 -0.3153 L-methionine Methionine -9.3118 -8.3222 -12.9170 -22.7815 -9.7100 -12.3869 -9.1409 -23.5983 -9.2472 -13.6516 -11.7998 -8.2190 -8.2882 -6.9371 -21.4055 -13.4381 -10.9826 -23.0134 -9.9060 -10.5794 -7.9747 -7.8953 -8.2890 -9.5287 -10.2366 -8.6325 -9.3126 -9.5098 L-pyroglutamic acid Pyroglutamic acid -4.5303 -1.7891 -10.7943 -22.7815 -2.7794 -10.2218 -2.8253 -11.8869 -3.9224 -9.5377 -10.6025 -2.3976 -1.7881 -1.2887 -21.4055 -4.0110 -4.1091 -3.5357 -4.6818 -6.9632 -0.8460 -0.9504 -1.7598 -1.8077 -2.4241 -2.8274 -1.4379 -2.6457 L-serine Serine -5.7707 -4.2896 -10.3679 -12.7557 -4.1299 -10.2554 -6.0599 -10.5247 -5.0595 -10.3209 -10.3111 -5.1651 -4.1038 -3.9855 -11.6697 -5.7017 -5.7298 -5.8148 -6.2452 -10.1881 -3.7438 -3.3564 -3.9998 -3.8778 -3.9754 -4.7110 -4.3439 -3.9311 L-threonine Threonine -7.4498 -6.5096 -15.1928 -22.7815 -7.9677 -11.6838 -6.4012 -11.9901 -8.1006 -11.2594 -14.4337 -6.3879 -6.4241 -5.4235 -21.4055 -6.1210 -6.7594 -5.6921 -7.5450 -16.1557 -5.8660 -5.8588 -6.0894 -6.7536 -7.9763 -6.1936 -6.7440 -7.4419 L-threonine 2 Threonine -8.3503 -8.2669 -8.4253 -9.3391 -8.2231 -8.3090 -8.4877 -8.3502 -8.3832 -8.2779 -8.0853 -8.2509 -8.1418 -7.9760 -8.4449 -8.7274 -8.0062 -8.2528 -8.2163 -8.2315 -8.2370 -8.1741 -8.1564 -8.3201 -8.5910 -7.9304 -8.2715 -8.5418 maltose Maltose -11.1728 -10.4566 -11.6731 -22.7815 -10.5406 -23.5638 -9.3461 -23.5983 -9.4467 -11.5910 -23.4551 -9.2521 -10.5937 -9.0965 -21.4055 -9.8490 -9.6014 -10.7043 -9.8942 -9.9953 -9.6934 -10.1258 -10.1753 -9.7837 -9.2683 -9.5828 -11.0013 -10.0733 methyl oleate Methyl oleate -7.2520 -7.2094 -8.6264 -10.7979 -6.7784 -5.1780 -7.5275 -6.2067 -7.3689 -6.0755 -8.7012 -6.8606 -7.1213 -7.0867 -6.4211 -7.5566 -7.1704 -7.4460 -7.2184 -9.6262 -6.9789 -7.1452 -6.9779 -7.0378 -7.0780 -6.7795 -6.7968 -6.8851 methyl stearate Methyl stearate -3.9663 -4.0445 -3.9602 -4.5791 -3.9023 -4.2214 -4.3956 -4.3616 -4.1903 -4.0411 -3.9765 -3.9578 -4.1525 -3.9798 -3.4358 -4.4751 -3.9809 -4.1159 -4.0675 -3.8698 -4.0533 -4.1014 -3.8359 -4.1981 -3.8942 -3.7627 -3.8839 -3.7285 myo-innositol Myo-inositol -6.1598 -6.4176 -5.9351 -6.7731 -5.9469 -6.4242 -6.3006 -6.0963 -5.0921 -5.9876 -4.9278 -5.1695 -5.3144 -4.8345 -5.5068 -5.9183 -5.7951 -5.7729 -5.6542 -5.7198 -5.5209 -4.8856 -6.1186 -5.9479 -6.1017 -5.6663 -6.2110 -5.9761 myristic acid Myristic acid -2.2137 -3.1472 -2.6302 -2.6408 -2.7019 -2.0451 -2.9406 -2.1597 -2.7943 -1.6561 -1.7406 -2.0552 -2.4315 -1.6848 -1.4373 -2.5797 -2.3609 -1.5909 -1.7703 -1.4103 -2.3235 -2.7511 -2.5303 -2.4645 -2.8826 -1.8645 -2.8116 -2.1642 octadecane Octadecane -6.2135 -6.0944 -6.0699 -6.1713 -5.7929 -6.1612 -6.3717 -6.4001 -6.2681 -5.9398 -5.8249 -5.8754 -5.9469 -5.9908 -5.4322 -6.3237 -5.9168 -5.9610 -5.9741 -5.9351 -5.8977 -6.0694 -6.0134 -5.9742 -6.0028 -5.7279 -5.7892 -5.8231 oleic acid Oleic acid -4.5644 -5.2065 -14.9747 -14.0893 -5.6037 -9.2466 -5.9144 -11.8433 -5.3047 -9.6585 -9.2564 -5.4119 -3.6694 -5.6019 -9.7575 -6.0706 -5.4323 -7.2288 -6.5982 -14.1646 -5.3304 -4.7743 -3.1959 -4.0338 -5.7802 -5.0777 -3.4696 -6.1927 palmitic acid Palmitic acid -9.8780 -10.2108 -9.0349 -10.6044 -9.9577 -9.3214 -9.6148 -9.6027 -6.9733 -10.3491 -9.7185 -10.2736 -10.3387 -10.3119 -12.8927 -10.0964 -10.2078 -9.2291 -10.4139 -9.6716 -9.8898 -10.1948 -10.0391 -10.2243 -10.0444 -9.8746 -10.0038 -9.9755 palmitic acid 2 Palmitic acid -1.0863 -1.0572 -1.0476 -1.4457 -0.9004 -1.0615 -1.2318 -1.3855 -1.2462 -0.9124 -1.2011 -0.8506 -0.9036 -1.0278 -15.3146 -1.2624 -0.9329 -0.9862 -1.1043 -0.9925 -0.9496 -0.9970 -0.8773 -0.8989 -0.9720 -0.7826 -0.7247 -0.8581 palmitoleic acid Palmitoleic acid -9.8139 -9.5039 -23.5045 -22.7815 -11.3358 -8.6953 -11.6421 -10.3615 -11.6350 -8.9772 -23.4551 -10.5927 -7.9015 -10.9633 -21.4055 -11.7576 -10.4889 -11.8301 -12.2676 -13.8753 -9.8998 -9.2915 -8.3992 -9.0946 -10.9311 -10.5214 -8.5700 -11.4755 p-cresol P-Cresol -9.0201 -7.0557 -6.1857 -22.7815 -8.5196 -7.9519 -6.4693 -5.6351 -6.7558 -7.1406 -5.3511 -5.1941 -7.4571 -6.8485 -21.4055 -7.6351 -8.0644 -8.7398 -8.0987 -6.0493 -7.5968 -5.6597 -8.9362 -8.3986 -6.4507 -7.3587 -7.1912 -6.3662 phenylalanine (2TMS) Phenylalanine -9.9874 -6.8994 -23.5045 -22.7815 -8.0077 -13.6362 -11.1906 -12.2093 -8.2911 -13.1144 -11.4608 -7.5393 -7.6601 -6.4539 -21.4055 -13.0999 -12.4704 -12.0884 -10.9152 -14.0106 -6.5246 -6.5155 -7.2549 -7.5245 -6.8810 -9.7654 -7.2518 -7.5000 phosphoric acid Phosphoric acid -1.9758 -2.0768 -3.4558 -3.2702 -2.2686 -1.9364 -1.2817 -2.3773 -2.8294 -2.9466 -0.8389 -1.4588 -1.1488 -1.3263 0.8322 -2.6342 -1.6828 -2.0335 -1.8499 -2.6998 -1.0856 -0.8346 -1.2584 -2.0890 -2.4353 -0.9970 -1.7557 -2.5526 stearic acid Stearic acid -0.8370 -0.7052 -0.8222 -2.1371 -0.4340 -0.8334 -0.8223 -1.3359 -0.9026 -0.6597 -1.3800 -0.4528 -0.5130 -0.5757 -5.0039 -0.7485 -0.4649 -0.4600 -0.5809 -0.6739 -0.4616 -0.5290 -0.5821 -0.4999 -0.5907 -0.3752 -0.3411 -0.4145 succinic acid Succinic acid -9.1802 -8.8193 -8.9541 -8.6874 -8.7589 -8.4324 -9.3837 -9.2533 -9.2053 -9.0353 -8.2011 -8.1307 -8.1789 -9.0353 -8.5400 -9.6222 -8.9861 -9.2361 -8.2052 -8.2797 -8.8994 -9.0068 -8.9722 -8.8334 -8.2984 -8.8633 -8.0618 -8.8718 tryptophan (2TMS) Tryptophan -9.0738 -5.7221 -23.5045 -22.7815 -7.4779 -14.0423 -6.0321 -23.5983 -7.2998 -23.6865 -23.4551 -5.3552 -5.1766 -4.1820 -21.4055 -9.7483 -6.4892 -23.0134 -9.1412 -23.5165 -4.0154 -3.8332 -4.5920 -5.3422 -5.1078 -5.3637 -5.0693 -5.3927 Unknown -7.4948 -6.3779 -9.0454 -10.2955 -7.3625 -8.8373 -7.4254 -10.9544 -7.5437 -8.9420 -9.6202 -7.5671 -7.5972 -7.7735 -12.6368 -7.7559 -7.4643 -7.4467 -7.7142 -8.0700 -6.7556 -7.6984 -7.2119 -6.4388 -6.3405 -7.4931 -6.7532 -6.4586 Unknown 1_2-diol -7.8690 -7.2373 -8.9484 -22.7815 -6.7441 -9.6940 -7.1534 -10.5713 -7.3280 -8.8351 -11.4548 -6.7684 -6.7067 -6.9814 -21.4055 -7.4801 -6.3681 -7.7319 -6.4164 -8.1439 -5.4249 -6.4390 -6.5556 -5.9305 -6.3092 -6.4690 -6.4407 -6.8956 Unknown alpha aminoacid -8.5012 -6.1699 -10.7318 -8.6274 -9.3611 -7.5278 -7.0822 -8.9693 -8.3267 -9.0498 -10.0456 -6.6910 -6.0577 -6.4131 -6.9486 -7.6956 -6.8123 -7.4000 -7.5928 -10.3568 -5.6610 -6.3810 -6.0768 -6.2784 -6.8423 -6.5513 -6.6441 -7.3410 Unknown carboxilic acid -8.4364 -8.3202 -8.2316 -8.6786 -7.8339 -8.4363 -8.1930 -8.6206 -8.1731 -8.0930 -7.9438 -7.9449 -7.9648 -8.1679 -8.6628 -8.3653 -7.9600 -8.0657 -7.9836 -7.8882 -7.8329 -8.0082 -8.0589 -7.9333 -7.9232 -7.8291 -8.0141 -7.9953 Unknown carboxilic acid 2 -4.8928 -4.5305 -3.7295 -14.0640 -4.5019 -5.8259 -14.3068 -3.6983 -4.9657 -3.9237 -4.7771 -4.3819 -4.0164 -4.8533 -10.6627 -13.3803 -4.8398 -12.0998 -4.8161 -4.7238 -4.7254 -4.8159 -4.7387 -4.3732 -4.0632 -4.7485 -3.8808 -4.0686 Unknown carboxilic acid derivative -13.3649 -9.7587 -23.5045 -22.7815 -9.3493 -23.5638 -23.0829 -23.5983 -12.9913 -23.6865 -23.4551 -12.1921 -11.1285 -8.6600 -21.4055 -23.0242 -23.3511 -23.0134 -23.5285 -23.5165 -8.8512 -10.8342 -9.5312 -9.3058 -10.6910 -23.4041 -9.7921 -10.6088 Unknown carboxilic acid derivative 2 -4.7920 -4.6842 -12.1560 -12.0329 -6.3368 -8.0803 -5.2346 -8.2329 -6.4212 -10.6483 -11.4402 -4.3278 -4.2093 -3.4490 -12.9195 -5.6760 -5.5867 -5.0843 -5.1777 -12.4836 -4.6234 -3.9905 -3.9974 -5.5654 -5.5849 -4.0150 -6.3636 -5.1941 Unknown lactone -9.5589 -9.1376 -10.3687 -22.7815 -8.8871 -9.4250 -9.5120 -9.9501 -9.4957 -9.9864 -11.2085 -9.0727 -8.3893 -9.0462 -21.4055 -10.0184 -8.3412 -9.8432 -9.1027 -10.0422 -8.8558 -9.1636 -8.6639 -9.0536 -8.9494 -8.2924 -8.6171 -9.0977 Unknown metabolite -1.6875 -1.4312 -1.5005 -1.8400 -1.2908 -1.5444 -1.6670 -1.7312 -1.6688 -1.3765 -1.3172 -1.3848 -1.4272 -1.4299 -0.8021 -1.7569 -1.2971 -1.5381 -1.3461 -1.4470 -1.2885 -1.4026 -1.4709 -1.3848 -1.4948 -1.1924 -1.3435 -1.3221 Unknown metabolite 2 -6.4922 -6.0143 -6.1030 -6.4369 -5.7536 -6.1887 -6.0589 -7.1043 -6.1582 -5.3799 -5.7055 -5.4866 -5.7220 -6.0011 -5.2767 -6.2326 -5.5331 -5.8112 -5.7723 -6.1115 -5.2745 -6.0192 -6.1820 -5.5824 -5.8789 -5.7713 -6.7175 -5.8973 Unknown primary alcohol -23.4800 -13.4967 -23.5045 -22.7815 -12.3375 -23.5638 -13.9927 -23.5983 -11.6990 -13.9921 -12.1992 -13.0531 -8.7626 -11.7126 -21.4055 -23.0242 -12.1158 -23.0134 -12.7794 -23.5165 -13.7701 -11.7187 -14.5561 -12.6624 -12.0974 -13.5746 -14.2532 -23.2466 Unknown sugar -5.1290 -7.2027 -5.1784 -5.0072 -6.5536 -4.6066 -5.2168 -4.7919 -5.8633 -4.4131 -4.1053 -5.5278 -6.1851 -5.4640 -3.9526 -4.8195 -4.4471 -3.8979 -3.9430 -3.9122 -6.3922 -6.6458 -6.5427 -6.3757 -6.3292 -4.7262 -6.8138 -5.9821 Unknown sugar 2 -9.0800 -7.9285 -6.6795 -8.6457 -5.0382 -9.1680 -5.9561 -9.2051 -8.3615 -8.8410 -7.2695 -6.9982 -8.2678 -7.6238 -7.5448 -7.7493 -6.3578 -5.9954 -8.3704 -6.5612 -5.7080 -8.0226 -9.0338 -7.7879 -7.0451 -7.8630 -8.4325 -6.9941 urea Urea -6.4612 -0.7567 -6.9632 -7.4524 0.2794 -7.4590 -7.1749 -7.2356 -0.6556 -7.0261 -7.2615 -1.9151 -1.1181 -0.4934 -6.5154 -7.7145 -7.0638 -7.7733 -7.1808 -7.4678 0.5677 0.7025 -0.7474 0.5724 0.5337 -6.3796 -0.1898 0.6204 uric acid Uric acid -23.4800 -7.9884 -23.5045 -22.7815 -8.8632 -11.5071 -13.2691 -12.5559 -14.5180 -14.6697 -23.4551 -14.7685 -8.7130 -6.0468 -21.4055 -12.2531 -11.1299 -13.1478 -14.9342 -23.5165 -6.8321 -7.6477 -7.4546 -7.8147 -8.5347 -11.1314 -6.9693 -7.9745