Metabolite_name RefMet_name C-1FRE1-U-00 C-1FRF9-U-00 C-1FRG7-U-00 C-1FRH5-U-00 C-1FRJ0-U-00 C-1FRK8-U-00 C-1FRL6-U-00 C-1FRM4-U-00 C-1FRN1-U-00 C-1FRP7-U-00 C-1FRQ5-U-00 C-1FRR3-U-00 C-1FRS0-U-00 C-1FRT8-U-00 C-1FRU6-U-00 C-1FRV4-U-00 C-1FRW2-U-00 C-1FRX9-U-00 C-1FRY7-U-00 C-1FS06-U-00 C-1FS14-U-00 C-1FS22-U-00 C-1FS30-U-00 C-1FS48-U-00 C-1FS55-U-00 C-1FS63-U-00 C-1FS71-U-00 C-1FS89-U-00 C-1FS97-U-00 C-1FSA9-U-00 C-1FSB7-U-00 C-1FSC5-U-00 C-1FSD2-U-00 C-1FSG6-U-00 C-1FSH4-U-00 C-1FSJ9-U-00 C-1FSK7-U-00 C-1FSL5-U-00 C-1FSM3-U-00 C-1FSN0-U-00 C-1FSP6-U-00 C-1FSQ4-U-00 C-1FSR2-U-00 C-1FSS9-U-00 C-1FST7-U-00 C-1FSU5-U-00 C-1FSV3-U-00 C-1FSW1-U-00 C-1FSX8-U-00 C-1FSY6-U-00 C-1FT05-U-00 C-1FT13-U-00 C-1FT21-U-00 C-1FT39-U-00 C-1FT47-U-00 C-1FT54-U-00 C-1FT62-U-00 C-1FT70-U-00 C-1FT88-U-00 C-1FT96-U-00 C-1FTA8-U-00 C-1FTC4-U-00 C-1FTD1-U-00 C-1FTE9-U-00 C-1FTF7-U-00 C-1FTG5-U-00 C-1FTH3-U-00 C-1FTK6-U-00 C-1FTL4-U-00 C-1FTM2-U-00 C-1FTN9-U-00 C-1FTP5-U-00 C-1FTQ3-U-00 C-1FTR1-U-00 C-1FTS8-U-00 C-1FTT6-U-00 C-1FTU4-U-00 C-1FTV2-U-00 C-1FTW0-U-00 C-1FTX7-U-00 C-1FU04-U-00 C-1FU12-U-00 C-1FU46-U-00 C-1FU53-U-00 C-1FU61-U-00 C-1FU79-U-00 C-1FU87-U-00 C-1FU95-U-00 C-1FUA7-U-00 C-1FUB5-U-00 C-1FUC3-U-00 C-1FUD0-U-00 C-1FUE8-U-00 C-1FUF6-U-00 C-1FUG4-U-00 C-1FUJ7-U-00 C-1FUK5-U-00 C-1FUL3-U-00 C-1FUM1-U-00 C-1FUN8-U-00 C-1FUP4-U-00 C-1FUQ2-U-00 C-1FUR0-U-00 C-1FUS7-U-00 C-1FUU3-U-00 C-1FUV1-U-00 C-1FUW9-U-00 C-1FUX6-U-00 C-1FUY4-U-00 C-1FV03-U-00 C-1FV11-U-00 C-1FV29-U-00 C-1FV37-U-00 C-1FV45-U-00 C-1FV60-U-00 C-1FV78-U-00 C-1FV86-U-00 C-1FV94-U-00 C-1FVA6-U-00 C-1FVB4-U-00 C-1FVC2-U-00 C-1FVD9-U-00 C-1FVE7-U-00 C-1FVF5-U-00 C-1FVG3-U-00 C-1FVH1-U-00 C-1FVJ6-U-00 C-1FVK4-U-00 C-1FVL2-U-00 C-1FVM0-U-00 C-1FVN7-U-00 C-1FVP3-U-00 C-1FVQ1-U-00 C-1FVR9-U-00 C-1FVS6-U-00 C-1FVT4-U-00 C-1FVU2-U-00 C-1FVV0-U-00 C-1FVW8-U-00 C-1FVX5-U-00 C-1FVY3-U-00 C-1FW10-U-00 C-1FW36-U-00 C-1FW44-U-00 C-1FW69-U-00 C-1FW77-U-00 C-1FW85-U-00 C-1FW93-U-00 C-1FWA5-U-00 C-1FWB3-U-00 C-1FWD8-U-00 C-1FWE6-U-00 C-1FWF4-U-00 C-1FWG2-U-00 C-1FWH0-U-00 C-1FWK3-U-00 C-1FWL1-U-00 C-1FWM9-U-00 C-1FWN6-U-00 C-1FWP2-U-00 C-1FWQ0-U-00 C-1FWU1-U-00 C-1FWV9-U-00 C-1FWW7-U-00 C-1FWX4-U-00 CHEARUrineRef2016_b1_020 CHEARUrineRef2016_b1_021 CHEARUrineRef2016_b1_045 CHEARUrineRef2016_b1_068 CHEARUrineRef2016_b1_091 CHEARUrineRef2016_b1_098 CHEARUrineRef2016_b2_020 CHEARUrineRef2016_b2_021 CHEARUrineRef2016_b2_045 CHEARUrineRef2016_b2_068 CHEARUrineRef2016_b2_091 CHEARUrineRef2016_b2_098 CHEARUrineRef2016_b3_020 CHEARUrineRef2016_b3_021 CHEARUrineRef2016_b3_045 CHEARUrineRef2016_b3_063 Matrix_Blank_b1_014 Matrix_Blank_b1_015 Matrix_Blank_b1_016 Matrix_Blank_b1_106 Matrix_Blank_b1_107 Matrix_Blank_b1_108 Matrix_Blank_b2_014 Matrix_Blank_b2_015 Matrix_Blank_b2_016 Matrix_Blank_b2_106 Matrix_Blank_b2_107 Matrix_Blank_b2_108 Matrix_Blank_b3_014 Matrix_Blank_b3_015 Matrix_Blank_b3_016 Matrix_Blank_b3_071 Matrix_Blank_b3_072 Matrix_Blank_b3_073 NIST_SRM_3672_b1_017 NIST_SRM_3672_b1_018 NIST_SRM_3672_b1_019 NIST_SRM_3672_b2_017 NIST_SRM_3672_b2_018 NIST_SRM_3672_b2_019 NIST_SRM_3672_b3_017 NIST_SRM_3672_b3_018 NIST_SRM_3672_b3_019 Pooled_QC_b1_022 Pooled_QC_b1_023 Pooled_QC_b1_034 Pooled_QC_b1_046 Pooled_QC_b1_057 Pooled_QC_b1_069 Pooled_QC_b1_080 Pooled_QC_b1_092 Pooled_QC_b1_099 Pooled_QC_b2_022 Pooled_QC_b2_023 Pooled_QC_b2_034 Pooled_QC_b2_046 Pooled_QC_b2_057 Pooled_QC_b2_069 Pooled_QC_b2_080 Pooled_QC_b2_092 Pooled_QC_b2_099 Pooled_QC_b3_022 Pooled_QC_b3_023 Pooled_QC_b3_034 Pooled_QC_b3_046 Pooled_QC_b3_057 Pooled_QC_b3_064 Factors - Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR 2016-1407 Study Sample Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:CHEAR Pooled Urine Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:Matrix Blank Analysis type:NIST Smoker''s Urine Analysis type:NIST Smoker''s Urine Analysis type:NIST Smoker''s Urine Analysis type:NIST Smoker''s Urine Analysis type:NIST Smoker''s Urine Analysis type:NIST Smoker''s Urine Analysis type:NIST Smoker''s Urine Analysis type:NIST Smoker''s Urine Analysis type:NIST Smoker''s Urine Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC Analysis type:Study Pooled QC 1-Aminocyclopropanecarboxylate 1-Aminocyclopropanecarboxylic acid 136968.7329 2404.2061 2512.9789 2279.7313 100164.3953 1178.9063 4074.2524 35702.2739 779.7413 15286.4874 15499.8197 5678.6744 4464.7432 38731.5200 8693.4126 978.9867 69307.5189 75025.6408 61570.9772 75709.9448 75492.4165 78368.5544 62016.3447 1565.3680 4152.2978 2172.7194 6742.2983 6354.8301 1-Methyladenosine_R1 1-Methyladenosine 3429329.8930 4390791.2600 2653311.4350 2914828.8990 2632375.1180 3066426.1250 2515771.5560 4098911.5100 3053614.9510 2372492.0330 2674016.0300 2989848.5350 1393817.1080 3612025.9410 2902131.7350 4386334.3080 2545974.2900 2795192.0600 3365445.5940 3746924.2250 3772408.6120 3763916.3160 3409339.2760 3359797.4990 4012051.5670 5434993.4690 3508372.6760 4501244.4060 4768494.5580 2848271.8510 3403402.3890 3220253.7760 2982423.5510 2907620.4280 2199237.5780 3550711.5510 2502734.1260 3988790.9620 2730664.2020 5353875.4160 3793385.8660 2761520.6140 2407456.3450 3808659.5110 1907649.9660 4158926.7550 3447953.3130 3052428.5870 2631508.5410 2522195.8410 2862193.5130 4979534.7080 2285752.3100 3222479.5050 3514450.7600 4301754.8170 3941339.0540 4117521.6400 3036980.0090 2687348.6870 3138845.7040 2633403.7870 3431821.8100 3243830.0660 2746035.0210 3133436.3290 3227778.0540 2851945.9150 2370281.6660 4245575.6690 2723806.4970 4846645.0110 3819908.9330 2370571.3400 5108279.2650 3216589.0220 2570893.8230 3019132.3350 5246114.8470 3082335.9060 2334124.3830 4038153.4780 2210300.3400 2122742.6340 3720322.1600 6022251.9550 4364235.7900 2278126.1940 3460504.1880 5781955.4900 4000727.0500 3217386.2830 3629094.6300 2738115.6500 3545429.5010 2769950.6950 3675340.1280 2884313.8470 2250605.6850 2043942.2410 3804202.0700 2696888.0190 2782449.7450 4230182.1360 2385325.8430 3940566.7270 4456244.2150 5086522.0850 2795208.0320 3466977.7230 2875666.9590 3169072.6830 2112973.9200 3101756.8820 4296355.9570 2535404.5430 4402286.0520 3278274.2020 2517094.0240 3374524.4060 3449940.4650 2991157.5200 3138008.0490 2693457.9480 3983733.4940 4832504.2340 2371917.0070 2660445.8130 2507776.7480 3735784.7060 3554599.0950 1847664.1790 2759147.0800 2739773.1330 2127494.2050 2462744.8880 2841559.0680 4267932.2120 3342520.5360 3074608.9780 3080970.9210 2691840.5050 4139027.0330 3419869.9390 3339290.0790 3566077.3440 3819751.4630 3926337.4750 3803544.2040 3734538.9860 4760170.0160 3733341.9510 3143636.6610 2841071.6260 3628029.0260 2966313.1370 3075298.1850 4311650.2760 4039577.4360 3914431.4920 2494019.1640 2575600.5790 3632731.8020 4069616.8500 2872086.8410 3134182.9490 3099584.6020 3072047.7270 3002380.7810 2374934.6290 2317783.1720 2703571.4560 2551739.7010 2480070.1300 2377291.1340 2131077.2430 2199710.9170 2825724.6980 2585702.6810 2515404.6690 2247607.4920 4534901.8080 4301846.3100 4541063.1150 3915924.4090 4116341.3980 4055890.8090 3799144.5670 3688366.7200 3780938.6760 3359375.8490 3389210.3340 3374867.0680 3252716.4530 3240031.0080 3092829.6400 2971084.7270 2887464.2930 2752232.9140 3213104.2390 3241404.3070 3032230.2450 2992487.8200 2933708.6780 2928439.8760 2846863.1250 2962066.2810 3073878.4180 3308586.0550 3121691.2690 3068496.9050 3117350.8840 2931375.6370 2773466.0660 1-Methyladenosine_R2 1-Methyladenosine 3307513.1590 4283894.4460 2567542.2670 1184836.8180 1262248.1140 2951642.5670 2427184.3140 3935481.2880 2619483.9980 2266102.4030 2584441.1150 2905193.9180 1342064.1990 3427040.4720 2796693.9470 4064400.1790 2445623.4320 2687225.2590 3264318.7490 3599832.0860 3648801.3840 3645075.4870 3292546.6860 3240801.5260 3729640.1060 5262426.0590 3199108.9150 4315695.1290 4478943.0660 1284932.4000 3221083.4440 2782839.5570 2859067.3450 2779902.4590 2114435.6070 3393427.0150 2389461.4460 3775868.9480 2553166.0740 5216330.2040 3625772.3700 2668810.7710 2253878.6010 3721976.6840 1848575.5230 4019318.0140 3343779.2700 2924957.4180 2494959.9400 2426051.5420 2649139.5260 4771824.3440 2202196.0600 2948001.2530 3403402.5670 4138973.5780 3799421.1350 3990185.9030 2911468.2020 2592507.9840 3049594.2310 2547683.6930 3284132.5040 3139093.6320 2635778.0130 1420508.2960 3144030.6020 2765652.9410 2285291.3940 4116587.8900 2591487.3670 4687097.8590 3689361.6030 2232559.1680 4845134.4810 3104086.8940 2473432.4580 2900488.7730 5066082.5680 2959838.6420 2246301.6000 1849027.2330 1995748.9980 2063812.0220 3588037.0750 5857211.0900 4226679.5290 2198637.5470 3357925.4310 5512153.2630 3867560.7210 3116559.6630 3507291.6000 2634069.1910 3419518.9960 2517138.5430 3548972.4470 2794861.9070 2162928.7160 1957006.2300 3656857.7090 2593382.7340 2671685.0810 4063156.3910 2246776.2280 3854706.5010 4263655.5670 4853902.8580 2673060.9600 3366241.5040 2625210.7560 3068909.9090 2029226.6840 2914500.0630 4162216.0630 2429131.4820 4099306.9280 3180334.1340 2403420.6540 3257924.7110 3278537.3250 2893764.1400 3011653.8690 2600134.7540 3863500.0120 4671830.8660 2268916.3080 2541998.0350 2428686.0370 3652847.3120 3439354.7920 1771217.7020 2613317.0720 2580902.3270 2042685.2050 2343085.2930 2715046.1660 4134235.6710 3235929.2440 2930072.7900 2968575.7620 2440778.7700 3976156.6510 3324516.5950 3253730.6620 3442530.4590 3701380.0680 3792513.1850 3330115.6550 3612466.2750 4595803.3770 3556788.7990 3033583.8070 2716475.3510 3482854.9940 2840849.3460 2892744.3350 4180955.9430 3932041.5580 3793561.5000 1077710.1150 2461910.9400 3507811.1410 3902074.0140 2759146.8740 2868249.7380 2849912.1920 2824777.4270 2755914.6080 2158783.8910 2117594.0030 2485790.3880 2352561.8940 2279122.3770 2174335.3610 1923814.4620 2003741.6840 2535660.0500 2325864.1820 2231312.4920 2011946.2960 4072619.2230 3877505.2870 4078412.4030 3478357.5550 3687325.3990 3600329.0960 3379109.2580 3268347.0360 3248589.1230 3241554.9220 3276071.5540 3273367.3290 3140023.3810 3144254.6710 2984734.0050 2867068.8010 2780015.6250 2657753.2220 3102939.4030 3126060.3000 2943848.8850 2889381.9130 2832137.1100 2825028.7590 2744672.3020 2829196.9200 2946926.6590 3142576.5300 2987796.5020 2939619.2950 2955735.2170 2766875.3370 2647936.4330 1-Methyl-L-Histidine 1-Methylhistidine 7117981.2170 15035010.6500 16085103.5600 12453233.3400 5799584.9100 18092331.1700 3458045.5770 14500223.5600 19536024.1400 15656470.5200 18873116.3500 6729534.5520 12568537.9900 11708914.8100 20627135.0800 23490093.9400 5996102.5920 9851368.7230 17859755.9900 13241630.0700 14572449.4200 9351527.0270 17445203.6300 10060909.4600 5273356.3420 14949863.1000 6094856.8290 9662133.4130 10401518.4100 8628626.9540 15423799.8400 9758286.0110 35555640.4100 20888032.4400 6721330.7870 27966009.1300 11389208.1600 12190561.7900 4299392.3190 53859370.6900 58970983.2900 12426841.6300 30665117.6600 9565937.6210 14350085.3000 11426801.4600 7442698.7730 6024898.4040 17635192.5300 45055275.6100 10408893.5900 9716147.6630 7196196.6010 9714209.7450 15170076.5500 13117489.5100 74889923.3200 10178855.6500 21031948.2800 13068231.5700 24609036.6100 16320455.7200 38527807.8300 8384389.0750 9028013.9730 8428471.7080 17193290.9200 16361376.5600 24363383.7000 7582552.2410 13699145.2500 16131842.6000 51280880.4300 9393565.3290 11094677.4500 21011390.3700 23284741.7100 6050857.7360 16770637.4000 6950671.0400 20906889.2800 24948197.1800 38046497.7600 11681814.7700 14800160.9500 19051777.4000 17171064.7900 29951854.0900 51802269.2000 10591980.1700 13048456.4300 12288087.2700 11515892.1600 8722716.3060 18736457.7200 49620729.5900 26778563.3800 22181455.1200 20987461.4400 119312947.4000 9441974.5100 17035675.5300 43426405.0600 9786389.8160 10744139.2700 29956131.3300 18594519.5400 12875948.5900 7519042.5930 12558591 12691984.2700 6370847.2570 4908168.5930 18217929.4400 10764911.2800 16477784.0400 5885886.8670 66410771.5100 6161902.0140 8547777.2550 8598528.0770 5220374.9780 27538259.1600 6817861.0940 8777199.8010 6676557.7410 5862350.9970 35479632.6800 23038258.4500 19469620.8100 36836005.2000 9521557.7490 11632304.3500 4859888.0420 17934509.4600 51934535.8700 4975812.9620 16766580.3000 9638672.7930 5360823.8520 8834819.3520 45777337.6200 9812358.4290 18194504.4700 16160840.8200 8785457.1050 56710798.0900 15879960.1700 9943832.2450 15603851.1300 13085214.7100 18178453.1000 27301753.1700 8219274.0930 13950545.9400 4341146.2210 35579370.0700 12145987.2000 7186400.9180 12239463.7100 22646587.2400 123215243.4000 11506495.5600 18360328.4200 10042557.7300 38593153.4100 35809192.5200 36516460.6200 31966876.4900 27893269.6500 28491829.1600 31221902.1400 27918384.0900 27014791.7800 24759501.8000 22203604.7100 23488990.3900 37703855.8400 35130389.8200 31759800.0700 30125832.6500 11926952.0700 12330927.1300 12570630.2200 10799654 10976623.8100 10037789.2700 10769834.2100 11696314.4200 10965002.0100 24364954.2800 24897846.3000 26143698.5100 21315759.1300 23743048.2000 23830086.9000 19867057.3000 20625190.8800 20281887.4300 23936641.8600 24575909 24186400.2800 22063344.5000 16849927.9400 20517180.4700 18385790.9000 21352970.7700 24150585.9700 27206458.7000 25995937.3800 26842242.3800 23356115.9800 22373221.4500 23645913.3100 1-Methylnicotinamide 1-Methyl nicotinamide 46779.5894 70375.7906 40585.4615 168534.5129 76581.4338 99134.7462 10209.0015 146756.6486 83268.5929 1542773.7210 56255.4140 32211.4377 80520.2684 50475.4223 73249.0140 68055.4669 57376.7245 82016.7503 70710.0284 113003.8915 57963.1218 127292.3836 181767.1987 91007.2144 50560.7860 66333.4763 28270.3730 58721.0319 87018.2620 81974.4558 71032.7888 51943.1524 62746.2575 46412.6470 47490.7931 64065.9431 42410.9314 70142.1828 38574.6227 23167.7701 53180.3521 49869.3556 37434.2768 83279.2726 65042.8540 83067.9946 89472.2688 56757.0545 88872.6536 53366.5210 71042.2801 62094.7903 46094.1196 29055.3508 93184.4896 45718.7453 55055.5599 90987.5484 73144.3013 57964.6938 52242.9382 40427.5807 56213.7636 52120.8633 31624.2052 47650.5629 92698.4196 54828.6337 42650.0675 40224.8523 41602.7579 116946.6007 61981.1853 54277.6018 87368.1194 51546.9314 59952.4981 59515.9349 121714.4018 67415.7270 47330.1886 52429.8923 71869.4196 90722.5959 81812.8927 73226.2687 39462.8492 52052.7269 31848.3327 70541.7929 98712.9495 80883.8686 70488.6968 61762.6341 59847.8351 41980.6564 82443.7309 60350.2263 103085.9120 86576.6101 157100.9860 64727.4388 32580.8598 61384.4621 66288.8342 75345.0965 31799.7164 138503.4158 39097.8773 71689.6909 50049.6527 45468.5769 36390.3504 38295.6450 82762.7391 34456.7976 40056.6784 54926.5229 57989.3010 72484.2135 39134.7817 45137.5647 71252.9676 92106.2126 187278.1538 47633.4162 36509.4973 49637.3082 48341.4421 100630.8707 62859.5872 37124.7138 45416.9103 73748.8961 70954.2434 34863.1799 51379.9881 31611.3078 62277.1100 35134.7534 62801.5550 56837.5857 55980.7989 41352.6277 58471.1697 51737.2620 30480.0393 32740.9899 37358.2752 53793.8089 115609.0355 70513.8811 97935.9033 53914.9962 58068.9680 82286.1028 70128.3866 65464.5261 61357.3133 88691.2856 44950.9165 74389.1271 60131.1398 95458.3099 74677.4985 72886.7574 86207.6494 75942.6879 75050.5044 64879.0132 69035.2505 73749.6260 70692.3351 60417.5684 70193.0174 53208.7847 54197.4571 86113.8538 70155.6526 72145.1561 66857.2082 61014.6770 65596.0813 50912.2401 51204.2185 60107.2535 62559.1142 46851.9168 57777.5603 47873.2191 62800.6377 76872.9130 68278.3838 62563.3796 65595.6771 53385.5312 34589.2168 66828.3410 67715.6927 82193.6051 65436.5443 67911.1117 55799.8269 62137.9268 56686.9513 63501.6553 59118.9268 62235.1014 81931.0371 63065.7754 81192.4465 80551.9331 8969.6150 78329.7693 1-Methyluric Acid 1-Methyluric acid 193699.8909 998509.4879 199329.5766 409501.2214 183300.6477 223926.4291 105868.9383 207590.9332 817643.4556 532564.1805 126109.7820 165944.1963 154120.5177 1633378.0160 460848.3088 847269.1229 251493.4167 935655.3964 264167.5498 687054.6789 596351.6067 278800.6169 676994.9644 218943.5378 625085.1011 355274.0855 336623.9536 383742.9705 967924.2531 204522.4385 222799.8627 666492.4804 228410.5192 229790.8824 128504.3782 1510921.4420 267819.3853 342164.9414 181267.0278 338062.5142 314328.9974 196721.3246 1680567.7270 311714.4195 116290.4106 238432.9846 817340.5969 144542.7276 168712.8771 752026.6774 362258.6911 395826.4607 531155.0038 1386928.0520 262473.9436 534078.1169 309122.2839 342016.3442 971319.3030 166191.5996 422105.5683 205076.3585 636887.4946 143702.2228 356472.8785 212328.1975 223474.0086 198186.8783 121338.9430 668787.5969 611102.9114 431750.9729 186227.1061 965138.8651 738776.0083 205024.0822 356998.3226 729160.5240 1721082.0980 777497.9570 103947.2121 431086.5712 187560.1180 193753.8490 166956.6043 370180.1364 261249.9258 153995.7168 273812.9959 1205012.5520 843671.4829 243722.8863 333260.8895 175050.1611 238457.6221 452945.1907 573674.0805 222505.4610 439347.0159 332374.1520 399121.7197 216787.2565 392478.6067 189556.4448 987968.5997 577034.4423 960785.1571 681219.4498 734037.2985 327994.1966 472459.1704 285884.3669 130275.9353 290024.6386 584388.3214 138452.3444 643309.0842 470416.2775 228907.4469 186245.0296 439863.9529 287835.0368 377720.0665 258857.1106 376865.7037 513963.8822 232077.0727 591295.9378 179165.7070 324385.8311 167618.4665 203232.5135 682069.4282 297926.4720 836114.8680 303887.2263 147051.6846 246279.3430 563675.5570 670043.2732 282709.6203 440623.9408 168722.7092 614108.6995 350317.6277 316253.0729 314440.2701 300594.8115 2137287.6130 200869.2137 1470986.7140 284638.1675 371218.5963 214789.9972 564653.3311 201424.2320 2234833.1610 660744.1835 142883.5426 292457.0324 810160.1745 215328.8454 237782.7396 848257.0711 293462.5829 2246245.5050 2212629.4350 2361831.2520 2253545.5230 1930206.3760 1907942.5300 1899080.1240 1814153.0030 1712285.3810 1729274.0250 1643673.2490 1734719.5820 2072427.3320 2060512.9710 1728139.5570 1788437.6320 3914145.8760 3590686.1930 3732761.2290 3243252.8270 3303816.8950 3175007.3250 3025149.1960 3103743.5670 3104175.5330 524147.1974 524523.8064 520106.1948 501444.9761 535814.7159 507185.1575 413794.9931 389233.7129 379515.1219 486572.1060 497861.1675 442546.8493 420320.5957 410651.8784 450002.5969 389877.8551 404768.3626 442893.7492 518323.9599 486847.9097 495010.0064 458961.2694 426852.0927 409534.3129 2-Aminophenol_R1 2-Aminophenol 26638.2762 15358.7721 39660.1533 33861.7859 10300.9147 15483.4444 34662.1813 70301.1142 44704.9679 44141.0582 22392.2415 7105.3520 72211.8980 1077257.1130 37016.8987 49800.7500 30185.7506 29455.9425 44550.8688 19543.4163 34175.7158 8700.3563 1776334.5150 35329.8369 393191.8746 28324.2522 24365.3301 30075.7763 15956.4597 1898509.3150 10003.9784 229276.4142 32319.6355 16047.1902 12133.1994 39617.9119 17083.1754 762049.7159 24170.4710 40471.5556 12053.4883 20792.4905 129614.0494 27489.0613 52324.5155 6479.6847 26338.4485 32613.9255 36562.2728 2907024.8640 16203.7747 14412.8914 100655.8971 17683.2409 690090.8427 42921.8450 7330.1294 23966.1611 23839.8756 14274.3547 15471.7217 10632.1566 11808.9421 11990.2696 34281.1416 30814.5233 4838.3533 16565.7165 29733.0132 27563.0013 11444.5152 19749.9291 24252.6628 26960.2844 49016.1380 35096.6519 9816.1105 26967.1121 12523.1189 16602.1899 24638.8983 29397.0217 32430.3999 24247.5835 15522.4946 275734.0567 19942.4674 10737.2791 85843.8346 16732.2252 22048.3449 17735.6927 31464.6249 28040.5219 26950.5281 17166.5679 12653.7565 9199.2099 11768.1662 11199.8664 26999.7294 36275.5987 55575.2614 180651.6992 196313.3407 29300.6864 2056932.2450 85067.4089 24108.0678 2351221.7770 57659.6284 40659.3735 1756024.3830 13171.5781 28836.2967 21150.5180 17963.0810 16767.5367 66021.5349 21270.7939 14085.5622 65395.4456 23167.8890 21828.9471 41220.8069 11032.5947 18134.3269 59135.2895 2550080.9760 17690.9329 16702.6814 49929.7145 30139.4605 150497.9710 10408.7401 72481.7591 13390.8619 20945.2134 15680.2353 22396.1045 80069.2589 18900.5782 29285.0352 39823.8872 21433.5000 52694.8690 27946.6612 59178.2121 8782.4361 47466.1785 64256.6577 51948.4327 9416.1192 33712.9238 9349.0050 8401.2993 30041.1280 14761.8110 12902.9946 40201.9447 1362983.3890 1284608.5370 1298492.0160 1346248.1140 1097152.1330 1065309.0870 941816.9313 925385.6089 973843.7779 944883.0386 853736.0531 970212.9683 1146151.1650 1130443.0600 995900.2646 842623.6479 2425337.0240 2405835.4350 2445029.1630 1818804.6580 1830479.1490 1739336.7950 1773858.0280 2012991.9940 2000898.8340 177319.3835 168234.7095 169673.8017 161853.4373 156598.9699 146635.0068 145201.3144 138589.3292 147149.4791 127392.0336 133428.5509 126322.3163 121122.3854 132119.7980 132564.5464 129886.2944 134934.7607 159946.2587 155159.5184 146783.0579 145364.9193 132936.5512 131851.1955 115342.2764 2-Aminophenol_R2 2-Aminophenol 20396.3263 34892.0698 26324.5455 60258.2839 32936.8893 29710.6370 39497.4514 1041984.4330 23955.7010 31498.8209 17040.4216 31837.6476 1720010.8430 377106.5577 28841.1796 14875.3283 1825506.5120 214022.8630 735966.8857 11877.5909 36212.6663 115235.7255 19090.2004 35062.5169 36665.2641 32111.5611 24379.1493 2804518.7870 92101.2983 656940.3102 33765.1620 13032.6848 24223.7759 18992.6550 16732.9276 15478.5170 37893.5091 20691.4851 15234.5495 30731.1954 261775.8361 75309.8384 19850.7473 17225.2404 21610.9233 28719.0499 25789.8025 32530.0286 174932.4390 179524.4357 2006373.1920 67306.2686 15558.2381 2265150.6520 41061.4340 32103.5663 1690752.9660 58265.0396 41632.3119 33461.3627 48150.9352 2459529.5660 41977.4991 19635.5246 148799.9274 47834.8482 71415.9617 30821.7510 13983.2029 49521.9334 48724.8686 31443.1693 51290.3804 27193.9335 1325876.0180 1213716.6280 1249129.1600 1286898.1530 1054668.2590 1026222.2850 915324.5946 886529.5351 969510.1735 948525.2835 841059.1584 972046.2010 1103259.3030 1087549.2880 962270.9587 846990.4905 76926.5115 2384221.7330 2352105.6410 2384706.6470 1777983.4340 1781611.2000 1764577.6680 1773186.6480 1946844.0110 1910856.8210 169383.7341 162258.2805 161274.3676 148975.7726 150254.2954 139549.0583 130475.0558 125704.4435 130789.9155 132106.5390 131460.0795 123133.8234 133975.7590 127657.6505 134133.4921 125506.2705 138139.8121 142950.1692 138607.3035 139283.1403 141777.3262 111846.0129 124076.8736 109452.4160 2-Deoxy-D-Glucose_R1 2-Deoxy-glucose 174712.6897 120213.7172 1106883.8290 383534.9494 118590.7420 133736.3279 160511.0899 170553.8585 108316.5289 124208.7704 122483.0494 152441.8646 79834.5763 92346.9708 992219.0751 335607.7250 166953.9784 969799.5035 137143.4715 201801.3086 247397.9797 275794.2848 329949.0295 150337.3589 119790.1375 194095.0617 179732.0975 145632.3738 273231.2707 107381.0132 128079.0587 781875.7346 99328.2669 235361.6734 98019.3461 95136.1137 161166.6005 112565.9588 542985.1862 159490.7664 163237.6467 468040.3333 188122.4733 366329.3240 124763.2482 83175.1317 177031.8324 113282.4268 188796.0652 115767.9692 137134.4185 140741.2958 606467.3655 453691.7478 568840.4452 121702.4190 265762.6167 1270452.8330 147849.2723 854994.9080 129464.3046 93259.3764 175459.3209 523469.2794 93246.5865 118258.2989 166686.5772 70462.7655 125356.1317 184179.3950 62797.3677 190833.1150 157250.2702 143802.9429 235472.5607 88640.6646 106538.5759 168490.4966 228296.4879 182274.7379 122476.0016 101244.9003 95030.3637 110762.5956 123551.8148 199279.0990 176212.0045 161414.4639 121208.4379 270219.3012 148126.2819 528399.3483 165527.0112 123510.0886 227643.3846 109706.6252 149123.7961 1145875.4250 232769.4014 132419.5991 82743.4744 115203.4053 112807.1352 165943.8352 155321.8258 201225.4494 168611.3614 316578.8190 134433.3383 176454.5513 112590.8838 112914.2260 202374.2728 101434.9152 220085.4074 134063.6132 119071.5384 611709.2493 190930.5613 267612.2899 101025.3592 137997.1473 338022.4126 109381.5018 138569.2897 273135.7772 168686.3433 144145.3802 241950.1738 127963.5898 177256.1237 76011.2119 731338.6647 101584.5158 126495.3128 343735.8739 81078.0201 192669.9775 701173.4544 94259.3782 147020.3035 112471.0379 74550.2232 116825.5996 118602.8443 320190.5366 129112.5561 263404.3208 227849.4622 621767.3253 122007.3017 188323.9542 367488.9714 118550.8870 240250.4508 154771.6657 141983.4252 106307.6864 378857.4684 312235.0357 251468.0063 84980.4930 211160.6833 114913.2127 122562.6646 319837.3299 314205.3473 341042.2332 300616.2725 281482.1733 265654.2726 288321.7895 295482.7671 269804.6576 280654.2917 260249.1328 266668.7712 307321.0468 301026.1407 320802.6891 286284.7888 453292.5948 426574.8477 445463.1420 442059.2274 434681.7533 430467.2513 388630.1016 306570.5569 418162.8109 178547.0832 193837.4584 188746.7671 198711.1128 178162.8199 192141.1203 183345.7688 161223.8686 176605.6734 218683.6879 226597.1216 211267.0918 195914.5552 188904.7139 186477.9403 182525.3904 214746.2058 218525.8745 209559.1067 218551.8767 212770.1783 225491.6208 215300.5679 213058.9522 2-Deoxy-D-Glucose_R2 2-Deoxy-glucose 151365.4008 120172.1190 766728.2824 256608.7443 84990.5280 131421.5671 150162.2529 115229.5058 92822.0509 100032.7786 96470.6012 57784.5773 83476.9984 95916.2138 663854.9043 317358.5284 113649.4539 669716.5815 114664.8734 189868.7977 241769.3728 199042.5059 187334.5438 102707.3142 115053.4451 141366.1629 160562.4807 94018.1689 194012.4545 88734.9829 69682.0750 533619.9094 77163.3717 174046.8168 74783.6321 101331.3755 101112.7100 112680.4422 368947.7258 131728.8762 96596.8908 314880.8000 138696.6773 263827.8351 81859.2927 94825.0283 154164.4157 127052.4321 122939.7143 124168.3795 101148.5850 101756.4012 404086.1131 332861.5309 387293.0711 80938.6137 174022.3447 851594.4216 105315.3170 578485.4536 134569.1704 83292.3779 162820.8113 401517.1322 62294.3728 111954.7344 135397.6652 63688.3663 122275.7725 126615.7551 68755.5853 130100.8308 144028.5330 112479.9297 150721.9585 71359.9637 89792.2147 137898.4285 144636.7571 155474.8956 104717.1070 90181.0140 63297.0448 99229.5773 113963.1706 138765.3032 153893.1349 148777.6410 123438.9422 252415.9856 82793.1613 373177.1782 171771.3379 104388.6054 127724.0798 91532.2390 139168.8042 746930.0064 161713.8884 118606.4660 77776.7796 98733.5312 95274.1563 82133.5986 110002.9340 162044.0576 169516.3681 195975.1877 110236.7018 171860.7277 106682.4678 83391.5005 167236.1333 82002.2884 124229.6012 93542.0576 116627.8857 433891.4239 144141.1548 194916.3711 74932.7360 110799.0158 217850.1562 93168.3786 74109.9428 229335.7560 126075.3550 98258.5885 163955.3067 121410.9503 162027.9647 65554.7478 496449.4794 72131.6986 121627.3936 263174.3924 76261.4189 150958.3797 455985.2511 65116.6660 138084.1570 85293.3396 73182.6899 123573.1547 94274.9295 225323.3763 127789.5785 167123.6649 169929.3138 417300.8137 120588.8538 178457.5757 247664.1553 97968.6537 241997.8244 110026.9773 127235.9096 89142.4891 257095.3075 303328.6227 193369.0731 76024.3471 172713.9350 88890.2514 132578.0106 238408.9416 223777.8262 238787.8075 214345.5202 198294.8047 191490.6661 209617.5314 199190.8382 199469.9844 192868.8603 185061.1304 192784.3519 206983.9651 200459.6377 209771.4249 197971.3942 313487.6353 304163.9056 306385.4217 309248.1367 312692.4572 298058.4642 295330.3590 296075.1001 294920.8361 170832.6750 168338.4705 174925.7961 168890.5625 175691.5698 166143.9735 157275.9458 149402.7127 160170.6523 192864.8407 197196.0406 187623.2272 182898.8737 163661.6832 176576.6802 178769.7843 188550.0817 196462.3243 190663.0959 181386.2788 180973.6661 189198.9602 183717.7976 182672.4472 2-Hydroxypyridine_R1 2-Hydroxypyridine 3547.5208 31938.6651 10765.6699 42373.5047 14684.0985 6529.5482 9081.4205 14926.6520 20372.2143 19339.6188 30354.1666 9248.3154 12335.6574 16354.1341 23905.2247 12244.7289 11348.9689 7534.4430 6714.9204 14645.0984 19183.1296 12661.9072 6327.2410 26321.2202 25692.1557 19474.6719 8489.6259 7644.1506 14422.1438 12413.8346 4186.6146 8198.5939 5408.7505 10733.9336 7847.1960 11924.0972 3403.5416 4068.4612 22663.8692 5742.7981 5734.3707 4405.7206 24913.7382 17483.4103 7245.3614 11618.2921 17748.9438 21343.9423 8387.7369 13054.5497 13381.2854 9040.5546 13254.9268 6495.6548 12490.3868 10489.3237 9985.6772 6573.1032 7654.4034 5226.4380 8508.3422 5572.8351 15164.4161 4127.6778 22456.6539 18178.5331 7724.9808 5111.8880 8496.0756 5685.6439 6979.4340 15943.7860 19283.0742 11586.5035 4539.3389 106558.1626 7184.7891 9056.2956 5298.8762 27706.1898 12516.5216 3395.5213 15648.1657 7211.6637 17692.0792 7431.2958 10812.5678 6667.4707 20511.3499 11451.1766 16963.6152 21588.8793 9186.9065 21315.0147 8378.5334 15091.2833 25913.1130 8609.5018 15207.2456 33414.6706 29499.3114 24966.1454 23766.8198 23685.2936 28155.9372 22075.7050 25507.8461 23345.6012 23004.5470 23443.5910 19835.5145 20533.6060 25336.2419 17976.8444 21229.0501 19159.5064 22322.9198 20351.9872 22533.3252 20785.4944 23169.4955 19516.9175 21027.3611 16584.5537 21909.4288 10439.2963 10551.7288 7321.7499 7732.8840 11027.8084 9124.0144 7823.9676 8252.1699 7699.8370 10694.0112 12010.8456 10912.3446 12175.8965 9549.4540 9957.2717 7923.1619 10811.6238 12462.1722 9654.8457 8752.2692 10310.2538 7927.8914 9009.9358 6879.4569 2-Hydroxypyridine_R2 2-Hydroxypyridine 35038.6025 17053.6109 44377.3281 14552.1670 8179.3451 4723.3134 18148.9841 30507.6949 18573.7687 35144.0214 18144.3859 20622.6336 27325.6867 14381.4224 3133.1475 6293.6676 5631.1440 13048.9226 15131.7379 24293.0526 14326.8080 27476.8469 27122.6987 19609.3486 14400.6177 3595.9024 9863.4453 3296.1378 15763.7278 19980.6641 8929.1110 16837.9228 8020.9801 18118.3857 32708.7054 4945.6293 24115.8610 18684.3779 8565.0027 14353.7636 19954.1574 22603.5815 11026.5199 5452.8464 12224.8139 18188.7045 14785.3356 8221.9443 16058.3741 12961.1662 5636.6127 9865.1736 7015.8520 7484.9073 18828.7448 26479.8295 18936.3858 7770.8153 7422.3757 12778.2525 20156.5822 47757.0852 3760.9289 11712.9427 103756.8084 6458.2693 11929.7674 31248.1068 14465.2426 19444.4158 17041.7515 13023.5336 8313.3678 4551.9103 8256.3383 21614.8891 8287.9922 19877.6824 22011.8280 12741.3935 5852.9131 12488.5274 8033.5960 14565.8412 27636.3324 5760.5601 22300.5393 33828.5296 25158.4253 30419.5444 27398.9555 25464.5418 27079.5724 22799.3740 27671.4404 26627.6403 25769.5044 24426.5717 26399.1838 25378.5485 26737.5029 25095.5973 22370.4340 20212.5547 25232.8520 44824.5033 23962.5965 24121.5675 25397.0640 20947.8181 22025.3504 21944.3294 23188.6952 15694.2728 5900.1158 11041.9929 12587.0455 14742.3687 14668.8522 17080.1315 12652.6033 11440.1351 10931.9650 10132.0454 18261.5649 11497.4851 10486.0173 10875.6762 10690.4414 8042.7416 8523.0047 2-Oxobutanoate 3-Methyl pyruvic acid 2154.1400 3394.8220 1781.5169 8931.4130 793.0531 3658.5875 3048.3590 3534.5272 5789.1293 4368.2628 1812.5027 3432.9684 2957.0299 1763.9491 1656.5704 5247.1508 2242.5819 3062.7165 1770.7290 6505.7016 2534.3421 2927.0647 6984.1446 744.6010 5629.8627 5217.4556 3747.2081 1172.0975 8354.0249 1166.8477 1556.5251 9222.7963 1659.9893 3392.0640 1052.8896 3310.4173 2240.7460 1580.5749 10250.2082 1384.0303 1499.7448 1473.6747 3972.1506 6931.4984 6742.7109 1458.4144 5704.9416 2723.7868 2690.9294 1760.9004 1558.2238 1816.2396 3932.8954 8086.8871 2207.9535 1996.0314 4639.8946 3624.5379 1384.4467 2463.6847 1341.6284 7106.0648 5417.2654 2533.9071 3539.8288 1670.6206 4690.0651 2724.4222 3217.7914 1010.4092 3087.8309 2499.5948 4205.6394 4473.9932 5117.5076 6637.0724 5926.9201 7312.2789 4202.7986 3615.0688 447.5955 3768.1963 560.3087 1856.4433 3008.8421 5972.4599 2432.0789 4484.9667 2385.4008 6443.3061 3354.0830 1762.8156 45450.6987 4441.3056 7854.2427 1931.8242 1664.4156 3307.5422 3818.6097 2201.8654 2182.6546 2890.9177 1421.9959 2753.4579 7035.9514 2701.0978 1381.4348 13909.0663 2985.5502 4246.6544 5384.3460 2494.1003 5438.5974 4527.4921 3593.1437 1899.2494 5303.0490 3270.3985 6780.0661 5398.9700 7418.5532 18438.8964 1978.7993 3932.3874 3697.8125 7973.5096 5940.6107 3706.4092 1193.2880 3927.1428 3684.4358 616.5217 11179.4723 2901.4607 1890.9205 2311.0517 3098.4416 2084.1065 7216.2319 1864.8174 39161.8849 1528.8480 3131.6661 5201.0872 844.5750 2781.6758 2270.2649 2795.6035 5460.0307 2063.5244 2235.9059 2042.0038 2254.9780 597.6296 2119.7508 1365.8280 3207.4927 4076.1971 4385.4841 2895.5412 1336.4758 2475.9923 1388.7042 3112.2589 1986.2599 5097.2925 4174.3596 4132.7794 4913.4642 4635.2098 4011.7921 4962.5637 5227.4309 4789.1851 5445.4451 4722.4607 4232.8329 3480.0813 4293.6791 4529.1110 4275.8245 7548.0334 8006.6214 8841.8321 10002.0178 11618.1488 8477.2520 10143.7268 9463.9881 7740.0313 4074.4669 4655.6074 4707.0918 4625.1282 5218.1599 3566.8773 3407.1513 3489.7787 4206.0734 5375.2624 4558.7889 4709.3027 4857.2276 4491.9652 5271.8982 4356.7912 4683.5144 5436.4379 4370.6332 3698.6338 4801.0040 4552.9520 4708.3497 3875.8747 2-Quinolinecarboxylate Quinaldic acid 9272.0423 13320.1245 12789.6935 9346.9414 7511.6755 6433.3248 6084.2359 6083.5329 6140.8737 19905.8763 8356.7868 7661.6965 6456.3720 7895.5786 9921.9124 9594.2445 9725.3210 9114.8432 9333.7797 4684.2075 11660.2558 40519.9759 10924.2521 12213.3545 7851.0848 39962.2882 8641.0936 5813.9277 7889.5602 8043.9132 9534.3716 10147.4447 15166.2263 5985.0012 25111.5978 10179.9439 10917.4206 9164.0476 14522.7663 10028.4229 11478.8235 7995.0834 9041.6899 8418.4717 26451.8816 13407.6126 6234.9811 9555.3835 10683.1251 5214.4674 11449.4611 11306.3045 9168.3780 9298.9471 8802.2724 6518.9992 3070.7698 5189.2264 6427.4221 11777.1263 7624.8242 21947.8145 6986.5858 12077.0024 9506.1534 5547.7297 7928.6597 8616.0148 6717.7844 10590.1971 7534.6931 6007.5292 4736.3613 7034.9255 7260.1241 21584.2130 10304.4942 17063.4370 9686.6111 18326.1058 10335.4593 14292.7222 6946.6908 8039.2538 8087.5432 14129.6246 10076.2231 11612.0535 8712.7684 18131.1245 7169.8665 19765.8881 6046.8652 6047.1673 14562.9666 28321.7464 5261.7030 25254.6844 6340.2907 7615.0303 6348.9745 17055.4142 12734.8540 9669.9084 10790.4441 5875.1376 8468.5876 8356.1596 9953.5619 6824.8352 6753.1117 5959.6154 8257.5683 6997.2036 6397.8939 10788.8955 8351.4675 6274.0780 5752.2751 7931.0382 6062.9560 34400.7077 22444.3883 10085.7923 9712.3530 5704.0808 7443.9768 12649.5979 9476.6597 6895.1176 14016.4220 13296.3341 11993.1157 7128.7170 9002.9595 8867.5193 11164.3861 13621.7908 7157.0676 5032.5292 10173.8249 4546.9967 6565.1576 10077.3305 9506.4198 4952.6637 26016.1284 9427.0178 12537.8665 23843.6810 21500.9562 18953.7310 23523.0973 19493.5148 15713.3378 20467.4963 19288.1907 12680.6510 10943.6349 18328.7599 14326.3910 16409.7281 17036.4831 16464.7637 14537.5292 15333.4088 17340.3726 15843.5946 16570.4477 15293.1510 14528.4881 15349.8047 14606.5949 13774.3857 11520.7189 10349.4904 10089.7353 10281.6208 9543.1908 10411.7814 9592.5989 9283.3355 9812.6988 9937.0806 7925.9492 9487.5236 10200.9144 8278.1693 9958.0252 8178.8091 9391.0812 9690.7478 10526.4729 8514.7912 9519.9420 9922.7019 10191.1657 8706.8379 3-(2-Hydroxyphenyl)Propanoate_R1 3-(2-Hydroxyphenyl)propanoic acid 58054.2500 38821.3352 41026.4359 47018.1527 26416.5507 26835.3223 39865.5976 25664.1184 34606.6981 29183.5993 31536.6763 46957.4019 22495.2967 17123.2627 31628.2792 49678.1102 31812.6653 26111.7290 25201.7386 35208.8430 39823.9360 39185.8840 19889.0482 49090.5978 29030.3851 30754.5129 29952.9656 19937.7684 23527.8562 35734.2948 38585.9655 28292.9813 23206.9016 33586.3244 36083.5300 33580.6965 24092.1637 33174.7486 32879.9194 38440.9834 23549.5774 33701.7512 37481.5166 38872.7041 17140.3908 29677.7895 26896.5093 38613.7428 27162.8617 22335.2036 53844.3048 31417.0124 32485.6608 46864.7041 31573.1862 22963.0863 21624.5371 57118.9860 31449.3328 31950.3238 39025.2936 30267.6018 26223.6352 30809.5583 39838.6147 10901.3877 30566.3753 28485.7506 23008.5725 33068.3627 51715.1766 33378.2545 28372.5217 14126.5129 24850.8674 32777.1194 23281.9360 66480.5947 33620.2348 51779.6860 23153.8638 18665.5574 20469.1808 19900.4091 35809.2105 30137.5383 18704.1207 57183.4758 41152.6039 37205.2414 35668.4847 42993.5525 47536.7548 28085.3581 30330.1920 38106.4926 46206.0394 58307.0766 14626.7989 24784.0572 20271.1077 42103.2074 24304.8007 27778.4880 26320.2194 23371.3795 32469.4106 39732.9031 28331.8374 29898.4029 34247.5195 36420.4820 30339.2078 41123.5858 49922.1347 32857.3461 29425.0429 54439.6690 21028.4541 29507.3040 29347.1724 35392.3722 30465.4824 45631.1405 51059.5503 33389.7142 32434.3784 40873.6115 20572.7812 24146.9903 57245.7150 38460.7459 34335.2483 25063.5039 16864.5582 20910.8445 33578.2092 21927.2799 35044.3207 27955.1548 55606.1750 31677.4584 42245.9335 33440.4535 32985.8081 28375.5194 28970.5588 31258.1621 30469.8685 34287.2741 41680.3293 30020.5871 29708.0751 21520.0547 25695.8179 28424.6388 17024.9336 33571.1662 30101.2978 43497.8424 18173.1886 42026.9892 25614.0614 44785.6427 30217.7825 33320.4598 36702.6172 30231.3523 36663.3257 33142.3475 31668.9405 45859.0980 44690.0825 46938.9348 49265.0724 40069.2496 41663.1462 47996.0734 47066.1482 59813.6442 35415.6283 18216.8279 16921.5040 17663.2627 31546.8169 31495.1566 24605.5267 38932.4197 42142.2769 37749.0781 16317.0987 16287.3799 22460.3286 20709.8144 27516.1633 30936.4400 22123.9883 27418.4480 19728.6382 29614.1309 26388.5927 55096.9952 29420.1699 33730.7638 35914.7745 45984.1457 68627.3523 67574.3163 48808.9567 42343.5116 46977.4580 39436.1558 32534.2930 27674.3311 3-(2-Hydroxyphenyl)Propanoate_R2 3-(2-Hydroxyphenyl)propanoic acid 58557.7483 38278.2037 46892.4673 44134.2042 29264.4386 31628.9443 18035.1235 30924.5551 39598.6670 31002.1210 33782.5385 49313.7602 22636.2257 30590.9802 48576.8939 27833.0702 31861.8808 24542.9942 33103.7606 41116.6218 41695.1425 22406.9323 46468.5008 29072.3291 37175.4059 35579.7336 25214.2446 26893.9319 39451.5957 45299.9614 25384.6198 32140.8725 40725.5289 33407.8447 27151.0985 36946.7190 39966.3029 35327.7522 25279.1404 35854.1068 41387.6086 38203.5159 18071.6648 29610.5944 39184.4665 24590.6167 25369.8020 49186.8916 35681.7915 30318.2244 54504.7782 31305.9201 27732.9446 24916.8149 61286.9991 34706.9997 36491.0490 38773.6839 23786.7862 31631.9196 37766.4445 40003.7483 15012.6771 28935.4877 28698.4823 32491.8663 49242.6800 31358.5441 27813.2711 19888.1679 28899.3506 32716.8919 27477.9307 60120.1986 36616.5990 50409.8112 23720.2060 21118.8167 20609.8902 37013.8871 35890.8569 22819.6582 43342.9666 42968.8400 37007.2293 40270.7190 41388.5019 51399.3797 34334.8445 32232.5635 36530.3781 45345.1327 58195.5009 19527.2687 27970.2025 26238.4950 42443.9966 26266.0339 35525.6322 30531.6223 32666.4400 43812.3602 31091.9777 35654.1067 36026.7992 36920.1999 35784.0149 53130.2455 51565.8098 33918.1068 29530.2926 54140.4411 26005.6471 35395.0912 30240.2286 35923.3036 52196.7555 53386.9794 33753.7539 48330.2327 22061.3999 32268.6045 34112.7099 41419.8613 35847.0711 27590.9604 23304.5249 30196.5235 26943.7324 39900.6711 31460.0119 61374.7243 29719.1335 44381.3419 34631.4293 32675.7486 27718.9381 31520.0542 28617.8781 42639.7062 47431.6607 32545.7821 27292.8781 26610.9274 22498.2945 24171.9865 18958.0460 55880.2159 42322.1173 39608.1234 34054.0437 47604.3999 29708.5487 32739.8719 34854.4194 35333.3860 29857.2019 44184.1219 43336.3573 47096.2403 41736.3735 40336.3897 42210.6183 46953.1687 50070.8023 47755.9984 35646.8548 8492.7606 33025.5781 30916.6330 33889.4760 31154.9140 34858.9941 31803.1257 20696.8912 22264.6022 17820.0579 17663.9358 17099.1599 31391.7515 27682.8481 27641.8036 39869.1146 42735.5142 37242.1263 17104.8568 19204.4537 20223.7989 28029.3243 34003.6533 21537.0345 22076.3809 21986.6664 29119.5663 27056.1310 31803.5676 33261.0922 32574.3934 38655.1040 36110.6594 41181.4384 44319.1679 42376.9640 44341.3696 38459.4856 32548.4278 26506.5874 3_4-Dihydroxybenzoate Protocatechuic acid 2475.9949 4219.3067 4337.0832 11051.8605 2387.1145 5641.8556 3103.0030 3187.0779 3433.7492 1708.7818 1348.6500 27630.9352 9941.0305 2471.8259 6420.2697 6046.3643 2844.9318 4708.3886 7208.0232 7692.6122 5129.6739 5073.5428 3935.0121 5671.7452 11771.8584 12805.5815 2972.9899 1240.7084 17646.6455 7877.4557 4065.6494 3614.5010 4113.1339 866.4232 2472.8541 8213.9686 10023.6881 11478.2009 3417.7084 1819.2625 2187.9077 966.5379 4913.7920 8226.3962 721.5205 1530.7292 10062.8186 6737.2583 3157.5999 9713.0303 4085.0169 3273.2568 3804.1610 2051.6261 1975.1929 6191.5357 4936.0525 5431.9736 3660.0357 3753.0162 2338.4155 1838.0692 9498.3807 5503.1108 4781.5713 2544.6806 4124.2736 4088.2051 1081.5906 3237.4115 8240.5811 17635.2966 3174.4914 2981.4078 1262.9732 2844.5499 4929.9075 4607.9442 5178.1147 5101.3593 2988.8431 8829.2541 6296.5854 9165.5592 3490.9030 2720.0104 5143.9033 33471.8136 2946.7531 5249.0965 9095.5244 1300.9149 1822.9039 7714.1501 48894.7728 3204.1878 1464.9226 4506.9047 3163.0673 2563.8418 2938.4739 2241.0535 8897.6070 3855.8892 5191.7505 4534.3450 5091.0895 3631.8061 2288.4747 4055.9952 3512.4183 3616.2743 1600.2182 2243.6055 5680.2447 5760.1296 2783.2147 4019.7569 1904.2895 3721.9599 2088.0329 2311.5949 2172.9391 2910.7779 3471.1040 3158.5539 3199.6799 4261.6589 2354.1561 2405.7359 3809.0814 2393.8039 4095.3727 4028.9954 3680.4237 1948.6218 1522.7011 4205.0909 5476.1879 4479.9292 2873.1801 2933.0486 3214.7053 2047.4829 3353.6511 3886.3856 4617.2752 4492.3259 2495.8394 3147.2371 3-(4-Hydroxyphenyl)Pyruvate 4-Hydroxyphenylpyruvic acid 6710.5579 7383.3482 43529.0730 320265.5379 14601.9388 308670.7315 162164.6964 63957.0236 89559.9775 355320.2955 8061.8012 53354.4341 141003.3944 32419.4467 524986.2249 8292.7111 44649.6686 8897.1681 5390.5288 123142.9806 79660.6321 143822.0077 4280.7148 28670.6892 7567.9581 121359.3469 105054.3428 4725.4252 6292.8280 47864.3192 6412.4746 7192.8656 60457.5159 42896.8429 21237.1855 4102.4539 31684.9957 665115.6203 46743.2941 42697.6233 103034.4383 58599.8828 10264.9913 81807.4633 126433.6565 331652.3335 493935.7285 4732.9511 90797.7828 5764.4428 23797.2745 165324.8789 5902.8534 174483.6820 199007.4489 472781.8077 4900.8804 7950.1621 40659.6269 379215.7916 4963.8937 5862.2513 35758.5749 7212.6708 124512.9060 7926.5990 26868.6360 7517.4958 213038.2522 27001.5943 5366.6728 356801.2980 205313.2674 9059.7049 146857.8983 8972.1705 14430.4983 4962.5944 5939.2689 9946.7300 19785.8266 62785.8592 101409.9833 56076.4296 33268.4324 58499.7664 16694.5400 6355.2519 7557.4123 88807.4376 5266.0350 42228.4175 8048.0504 80471.3437 18992.9793 19397.9037 78302.2181 6510.3930 10212.9943 95075.5016 58103.6664 67353.9422 82315.0215 100125.7181 98379.3063 88288.7739 5153.3507 15419.1724 19388.4554 21062.9499 47567.7288 53531.1003 53056.1930 6718.8951 8173.4068 2582.6465 3614.3006 3125.8228 4256.9539 66694.4267 25954.8997 29632.4906 30594.6934 43174.8447 42506.0996 66838.0252 166079.7803 28464.8904 24168.9091 3-(4-Hydroxyphenyl)Pyruvate / Caffeate 6934.9532 5874.7037 6589.1184 7810.8736 37022.6377 3679.0069 4569.8996 6032.3163 287879.5986 7939.6793 13604.5783 276917.8162 4366.5484 4144.3039 151584.5656 56964.3304 81703.3341 4668.8162 320150.2702 8456.3502 36748.0037 128261.2508 30865.5823 21125.1484 489510.0570 6355.2492 5703.2327 6205.9771 41201.3470 8733.5456 6220.5248 113407.6972 5358.9231 71537.3254 3501.0067 134461.1782 4718.5821 5232.6485 7512.3673 25104.2571 16992.0520 7667.8227 6433.6063 112343.5792 98187.0410 5335.8463 3380.3373 6368.8349 36888.9830 7155.5228 8027.6149 7194.1864 4835.6247 56899.2462 39879.0716 5553.0713 5909.8253 8382.5306 21167.0278 4530.9611 24635.5012 5766.0226 4282.4988 610112.7448 37407.5823 2835.4811 38315.0886 92434.1042 46911.0121 7682.5111 76946.8749 117020.1277 6532.9462 4018.7303 308255.6711 456565.2589 5255.4585 6253.6262 4442.6637 84777.1771 5669.8152 2996.2063 4047.7564 9868.7842 20123.7787 5496.9008 3522.3856 6110.1861 154337.7737 6865.6501 6046.2115 161949.6671 5902.1996 3785.8147 6228.2951 186926.5439 3908.7135 444424.8721 2714.7111 6530.6312 7914.9371 38030.8817 352383.4322 4898.2426 5876.5479 5737.6951 34010.6140 10816.1819 7409.5436 5538.3618 7461.8132 107498.7757 6928.9101 6782.1640 25325.6318 7701.1791 197845.3724 26297.0577 8704.4900 4789.1426 330361.4478 191567.4947 3246.4332 6716.7467 134973.0572 6273.5820 6560.9517 13860.4542 4139.0672 4845.0591 5527.7153 6465.2609 4409.5249 3975.8587 6193.7615 4715.6060 7221.6292 5992.0035 10507.1941 5949.8621 13429.9045 54994.9341 92957.1721 52997.3021 31756.2509 16009.2455 45064.5121 15616.0039 6886.9686 4322.4470 7481.3262 77460.8469 4241.0351 6233.6893 29346.3776 8029.0727 72837.5739 7432.2827 17818.8908 16414.0206 72664.0153 4047.6411 6709.5718 10357.2477 88028.9348 52007.3581 58349.9339 72365.8852 88318.2417 85747.6846 82237.0757 4132.4439 3253.6028 5751.6781 7488.0251 7291.4652 8296.2631 4480.5316 2937.9775 3127.8124 4391.2082 61365.4213 22075.9216 28321.8844 2736.9662 3378.1937 2334.6751 3041.8529 2851.6351 3293.0129 12762.2755 11475.3953 20594.2439 42104.7821 34257.3625 54172.4238 145372.0189 21970.1623 16671.1778 3665.3019 3056.2138 3272.4778 3364.4737 3653.7648 3460.3049 3240.2018 2131.0222 3431.1649 2184.4630 1792.1950 2572.5522 5104.7214 1598.0595 2090.9439 3-Amino-4-Hydroxybenzoate_R1 3-Amino-4-hydroxybenzoic acid 132787.6699 260122.6160 243843.1525 200357.9554 114555.6130 219615.0569 166653.1750 184119.1145 212267.4867 152383.8405 156573.4992 411987.9042 280482.8655 179031.2553 166503.0225 237054.5244 217414.9285 133693.3932 237217.3433 136116.4976 178005.0802 212247.9041 299905.3240 88558.8847 137502.3707 389012.3596 388801.6229 213881.0478 197651.7645 69584.6844 142638.9019 286620.2403 105149.4919 81012.9783 167443.1740 172060.2500 176101.2259 308222.8594 96401.1721 326080.8550 250216.9856 203226.9921 164370.3142 148174.5186 92571.3865 259738.7618 254712.2861 90586.2266 127237.8007 259310.2861 166606.8619 238925.0002 180441.6157 157756.1396 104615.2669 142281.5082 152176.9322 269151.8000 153708.4499 167014.8982 156915.2682 215961.4760 164649.9971 46765.5628 190175.2266 150991.0125 204101.9267 170055.8794 154013.4253 100976.3583 237906.3424 297812.3511 233963.8030 114246.3807 253297.4634 288861.6331 264722.6025 98463.3969 210594.4126 232339.0521 474232.7633 281770.6609 121446.1288 323380.5879 378017.8852 372645.4949 538904.7657 215170.9197 60772.6983 250101.7771 179620.0601 98948.9747 204412.1624 88447.3743 199204.3436 199856.6302 186280.6806 172857.1712 464171.7045 90068.8629 296651.4720 150246.3294 110738.1435 281256.2632 107916.8616 243086.5288 193308.0950 290500.8478 191872.0505 90039.6779 334127.9870 141438.6850 238744.6970 188960.8265 315776.6781 150468.1479 152275.9629 89819.5928 153856.1235 181886.2616 123430.1145 128570.5791 390860.1745 258945.3850 380502.6481 158074.6275 162595.0771 156733.8520 93415.7924 230331.2591 155870.9412 158918.8007 119982.5578 160025.7903 240111.5694 116594.5086 48888.8665 548040.4198 183829.3069 276368.6672 171679.5818 208763.5277 133102.5815 193569.6914 147414.8300 165169.8071 65946.8587 147263.7090 187243.0856 186853.6600 133701.7965 116353.0540 404867.0394 142028.1849 155039.6030 179236.2885 132771.4420 258319.9929 208418.8965 111698.8581 239714.5805 144974.3859 170753.6464 334609.3393 223467.7353 186357.2270 163473.0495 188803.5790 193605.8801 167500.1162 160718.1668 171703.5516 175016.6888 171851.9876 173320.0031 169645.2898 185039.9955 165732.2392 170692.2405 163157.1273 165492.1253 286765.1260 293415.7314 303504.6041 259052.5462 285567.6746 266170.5015 239886.5301 267978.3101 231214.1411 208257.5418 203188.3951 221056.9857 195940.1423 216195.1151 216029.5127 185872.6855 172221.4766 163530.1722 215171.5405 203148.8427 208292.2516 200496.1555 199110.2293 198984.2236 190937.7003 205641.2606 212008.1496 180792.4584 181693.5055 168001.1216 181014.9139 189725.5892 179823.3651 3-Amino-4-Hydroxybenzoate_R2 3-Amino-4-hydroxybenzoic acid 105831.2192 202990.9662 197683.3453 152338.8773 89859.0967 162817.1199 132050.9696 147092.5316 160671.7893 129807.6919 128429.2959 309375.3772 210248.1514 138746.6942 122520.4093 175342.3419 164881.1118 105410.6592 186463.4341 104067.3233 131841.4636 158226.4759 227753.3765 63668.4363 106525.2088 308704.2188 305585.4746 166502.4402 152298.6870 61144.2802 120297.7557 222916.8917 78708.1241 63079.5494 130087.0604 128997.6215 134760.4931 237042.5193 81707.1191 252481.8661 192865.6394 151484.3942 125658.7069 112870.9663 73653.7759 200676.7193 193164.7863 73063.2684 102338.4470 193335.6728 133927.6096 179709.0639 139342.3903 123194.7753 79252.5287 106790.5617 118940.3651 213451.7000 120241.9388 133602.0613 118688.6058 172868.6164 130776.4566 33604.4070 142951.0171 113511.3156 149485.9933 131687.1510 128706.5998 79456.9598 182315.7986 232920.1102 190995.4423 90911.8910 192960.2018 224865.1684 201909.5427 71486.0618 156987.0543 177101.7429 357965.5059 214350.7540 97527.0088 254316.0153 288496.7606 298656.4788 421362.3956 179257.2884 51900.8811 190191.4377 136501.0092 74856.5638 154827.0222 66527.7202 159575.2179 154965.7935 142435.3402 136504.3506 357942.8718 68394.0690 228152.4498 123866.3658 85229.4743 204380.9376 84822.9718 190070.1526 143480.6079 215643.0600 151334.9768 74750.5180 259068.7108 108855.7621 180421.0397 146465.9714 254577.3714 120271.7725 117971.9589 66678.2216 130301.2016 138801.1872 95071.8412 104275.3819 304092.0262 197405.6359 295787.0622 120666.4006 125530.1426 118075.7880 72364.3396 179338.3229 121799.5457 115911.4441 95544.8676 113244.5178 180929.1149 91709.3985 35449.6024 421613.8237 142141.3787 212595.7607 132091.2966 164968.8012 99562.2154 143771.3081 115916.9799 126262.8463 52603.3646 113767.6530 144366.2904 140012.0297 97760.3096 88129.1429 312458.7960 106784.6513 116630.4787 126343.4498 101969.2806 203085.5251 174093.1355 86410.8972 190536.2427 114608.7594 131996.1785 260394.4081 178108.1950 161705.6408 148690.7264 158862.3096 159763.1260 133244.2761 128158.1080 150200.8872 140976.7518 141259.9203 147662.7984 133747.0187 149479.9828 138591.5330 137972.1352 128858.8799 128160.3554 240831.7415 228144.4372 243898.8197 219986.6585 233103.7391 224504.7132 194887.6620 211621.6862 190028.3423 155491.3233 159163.8744 160630.5675 161019.2249 166745.0848 166893.4380 147861.3996 134528.2865 126353.7976 176984.9351 167912.2249 158886.5320 153536.4523 154254.7976 160392.5594 145575.5042 159204.8825 162829.7190 149222.4402 135019.1279 134879.0112 137795.6732 146086.8281 133259.6534 3-Amino-5-Hydroxybenzoate_R1 3-Amino-5-hydroxybenzoic acid 381554.5774 54793.9984 245394.2823 2673.1502 5732.2584 145177.7929 20825.1136 2159.3575 2010.6394 188734.3219 48870.2496 37197.6018 242268.7443 17365.5441 23489.9718 47684.0223 8382.8168 16440.4553 24871.2079 32815.1654 19390.8235 415382.8866 71578.9360 53652.4484 70192.1723 79536.4686 74622.6245 79406.9300 55114.5661 58682.6832 58660.9762 62077.9339 58223.0399 63131.3184 62397.4651 69018.0891 53174.5995 62593.1555 38772.8112 36755.3391 35036.9119 25195.1652 36708.8176 24761.4067 30166.2725 23249.3266 22356.2347 15250.1705 19036.9316 17554.3036 11446.8027 17678.5354 19464.2789 17765.8033 21354.0416 14987.7215 14530.2885 13645.0651 18808.6538 17552.0804 12746.7147 17552.6365 16508.1138 16078.9321 10651.8070 3-Amino-5-Hydroxybenzoate_R2 3-Amino-5-hydroxybenzoic acid 369095.5492 65903.9884 7770.9328 240378.6651 3192.4978 7950.7880 135104.1648 22329.0516 3470.3034 175789.2689 40981.7170 3485.9374 30761.1080 249104.1363 19927.1032 3941.4088 18024.0835 39570.9031 8984.7067 1892.8696 3898.6065 23695.0523 7673.0328 2709.0561 407016.3747 62134.7599 64884.1620 67740.7051 71419.0713 58171.4874 63552.8605 58646.7728 52272.0102 54583.3147 52973.8718 44575.0833 49395.8061 56143.3116 56346.9837 50329.1759 49679.6394 36549.6517 38694.1724 32473.6236 25645.4223 25851.1076 27828.2249 26158.6847 22292.5513 29075.7346 16808.8529 9955.5159 20448.2503 14952.3639 20764.0033 20264.9754 16169.0103 15248.4123 15349.9804 15753.3069 15612.9104 12268.1900 14151.5738 13601.1352 9352.5486 9271.1833 9942.7061 12720.9741 13256.3375 10018.4321 9879.3891 13055.3972 12234.4870 11886.3832 3-Hydroxy-3-Methylglutaryl-Coa 3-Hydroxy-3-methylglutaryl-CoA 5035.4592 5268.3160 2153.5603 5131.7375 5150.2200 2239.8437 4244.7611 4855.4645 9411.5680 11422.7217 6652.7066 3370.5978 8493.8143 6427.2121 5073.6859 3822.1614 5125.3986 3908.6111 4245.0240 10725.9537 4079.1331 4252.5851 3955.6342 8710.5581 4961.7200 7486.9977 11133.8151 7233.4464 3867.6474 3997.6134 6528.3128 5991.8024 2967.7443 8230.0323 5633.0610 3564.0769 3559.4100 11843.8691 8120.0107 8700.1868 4216.3920 6268.2814 4970.3265 4009.2605 8581.8829 5551.6963 9722.9631 8084.9083 1565.4065 5274.6041 4587.6750 7489.4149 5531.9478 4554.4468 3881.8347 3658.8614 6943.9443 4366.0208 6374.6739 8769.5336 10175.3994 5433.5068 10107.7110 6016.4067 5783.3146 6276.2550 4877.6220 6666.9915 5519.3788 8207.0390 9379.9789 8684.2780 6041.7442 4719.2936 4293.0823 4659.4715 9588.0443 8355.9682 9464.8268 6869.9282 3-Hydroxyanthranilic acid_R1 3-Hydroxyanthranilic acid 292796.4763 158647.3223 161075.6378 107232.6258 185553.4694 98627.1777 146004.2678 126730.9959 257136.6326 104387.7394 221151.3962 222386.6699 233276.8309 45715.2769 71737.8872 144031.0365 221059.5059 198798.9567 349042.8295 168988.5482 106539.1314 71542.8043 247747.6433 146705.1817 112259.3757 186130.0744 93976.3756 59295.6355 75289.2130 95972.0313 121845.2394 132006.8034 124651.3577 248084.8592 38264.1559 123479.1984 133494.5364 173118.8196 71348.2030 127358.0897 244358.8926 139129.7111 60360.7424 246795.4820 107729.8359 208762.2579 163442.3078 81210.2638 100101.9325 434199.4503 60870.7984 157211.0079 124220.6024 148674.8531 84236.9448 221324.9163 189698.3555 146323.5453 203603.9013 177554.4184 178254.1912 38758.5057 99621.4322 89034.9922 110631.1702 291297.5441 130666.4044 122045.2546 53320.6507 106625.7714 149574.9641 40372.2429 61448.9436 46192.7060 12245.5981 326784.9063 90274.7126 128712.8685 368708.8056 286469.7186 145418.5037 211477.4685 437318.0976 731014.7364 178467.3225 293008.0695 183182.9171 98933.4248 84061.6891 149267.9520 135117.3978 80547.6607 127941.2460 321129.5431 363228.0862 293964.8111 107964.5123 285213.6752 242314.9925 103712.1836 150463.0633 67959.4733 118615.0400 56665.4032 219014.0664 185322.8435 403843.5306 174690.3705 94990.4200 266142.7563 143486.8117 221110.3579 282762.5708 99364.9453 216539.7462 187677.3965 79131.3012 56197.6797 70170.1797 75523.8301 107884.3640 174018.1584 68811.9505 24205.0036 54018.6442 80943.6720 219664.5120 167759.4202 189946.1070 79415.5051 129896.5981 99984.6962 200698.3044 260602.9140 193632.5110 150725.5616 294616.6590 543421.2968 550951.8878 65763.5975 364280.5506 122756.7775 103086.7263 85943.3866 212030.1151 107074.8600 29200.1925 109319.2448 56853.4441 127911.1012 177826.1846 171597.6114 120025.8516 70738.9081 72977.0532 185800.3347 102893.3714 110386.3610 115354.0157 128797.3796 152128.4802 120674.9927 154514.4930 409958.3722 89222.1206 99754.3573 78122.4069 78396.1907 65892.4404 59867.3053 88329.4952 90181.1291 96292.3614 93718.4609 90565.6950 93153.2984 96148.0767 78799.8430 85427.6717 88554.4404 150033.7895 150570.9346 153774.4071 162112.4381 172926.3368 133183.7329 134494.2644 140583.2238 138484.9546 154585.0927 153827.7128 178776.4525 149559.4064 169089.6400 171405.2715 153369.9321 150492.9788 154078.8692 205132.2947 200608.8960 170943.6583 192551.0982 185628.6212 196395.1954 172788.3849 173449.8938 178623.8395 170419.6468 168775.2751 161308.7509 174950.8861 157189.9018 143517.0714 3-Hydroxyanthranilic acid_R2 3-Hydroxyanthranilic acid 221842.8199 143961.8860 193210.1407 164091.8706 165780.7509 166174.0446 167520.4390 267633.1682 101542.0087 249190.0424 111671.3308 181287.2229 153622.3281 181589.8261 186214.0342 162431.3490 127284.0133 329981.2315 94904.4009 184774.8217 169721.8754 135926.7336 79087.9928 219641.3444 260811.6276 97413.8910 289848.4827 217583.0990 336693.5518 575076.4554 136138.2827 234417.5144 267679.3770 215418.5486 211573.6450 185278.4237 139157.0631 339415.1259 135847.3399 118816.7634 166533.6629 229716.1631 162255.2230 142950.5947 133275.4732 186469.5339 151910.3260 150868.7923 221900.4275 411716.6835 419059.5828 292368.2114 179218.2962 108922.0315 99994.4576 89050.0276 144784.8836 98821.7589 461053.9240 126941.4186 154962.8108 3-Methoxytyramine_R1 3-Methoxytyramine 7665.1502 167856.3675 212154.7762 103680.8385 19141.4004 326232.9886 349400.1932 161216.1895 12544.3930 1470.9534 183420.0844 182786.9185 6195.6099 4332.6855 1444295.0030 2002.4946 982.6918 52571.2462 123524.7193 242702.9686 36525.9662 65842.4192 47382.2821 34264.2558 42205.3549 44834.9303 37227.0695 32464.4389 39603.1158 38830.5426 34700.4755 27427.8958 26652.9803 26583.0508 32094.4337 36534.0290 33748.7808 21196.3651 43395.6499 45256.0501 43557.5573 42567.9696 48402.7067 46283.7721 41585.1811 35618.3048 32724.0032 39430.0550 43330.5641 38932.9976 33863.2397 36696.6099 37370.2671 34459.1487 31485.7891 29880.7312 38109.8858 37378.1573 32080.6492 38444.7958 33583.8014 27957.5537 3-Methoxytyramine_R2 3-Methoxytyramine 155664.4428 179552.0037 97843.3409 14408.5084 298595.3061 314254.2810 142593.4468 10201.2986 169488.5130 168337.5586 1349972.8460 45759.8103 109210.2351 219067.2722 31079.3493 60029.8305 40633.1187 39369.6173 40576.6018 31405.5293 32858.7737 36911.9954 32171.9779 30739.9773 26193.9537 25620.2976 20093.8660 35022.0729 21351.5767 27578.4442 22162.0183 40219.3256 35416.4779 40372.6553 31973.8896 42299.7096 36281.5697 27957.1181 26311.6241 35191.1318 39193.3388 33779.1273 29732.8007 20970.1204 25550.2530 32153.9366 28204.3254 31877.1284 34531.5792 30434.1062 29752.5377 35477.6351 30562.3540 27688.9813 3-Methoxytyrosine 3-Methoxytyrosine 27197.3505 16411.4624 8571.4595 23967.4881 92539.9453 24859.1751 35053.8835 13453.9490 15188.7196 49459.3426 15787.7067 17339.9528 52752.7413 43740.3801 41735.7473 6960.0953 20510.4007 59572.1923 18508.0562 137903.1863 21953.4173 52687.9010 29062.2713 10006.6106 12348.3525 14959.1078 9758.4577 10187.0983 19288.4222 12804.2959 63579.0708 7820.5926 24826.0570 21926.6392 9987.0892 12420.7794 40142.7810 16759.4226 13650.4954 29926.0919 50433.6682 19409.4785 22880.3125 48792.3614 25690.9732 24438.9504 41082.7479 27844.3476 25459.8735 11706.9535 24859.5925 23908.7360 25991.3799 9209.9123 15786.5308 49052.5572 13546.8829 18097.0405 42615.9014 10448.2589 11375.9330 48685.9226 22993.1755 12694.5312 44878.2138 43581.7823 19212.8808 2384.8239 29834.5242 20308.7280 19317.1539 63951.6588 45459.1685 14561.2232 55980.3546 37895.7280 28262.2591 25567.9946 16122.3302 84074.7683 27883.5969 25662.1947 18985.7933 16879.0496 14032.9212 21041.3920 7822.4101 53634.8513 11580.5228 16872.0468 25844.9986 61315.8420 13270.3190 44569.4964 21384.8471 25416.3263 73528.9382 38715.2078 51581.4974 27248.5441 15382.9614 35179.1948 24466.3538 18399.3055 35954.0690 30910.4676 19694.2729 7430.4581 5939.7325 24089.1097 23878.5226 33738.0442 19035.2138 6424.7729 12849.3504 30700.1896 32364.5908 40821.8229 25355.5653 37412.4779 24178.8048 9185.0394 18690.4779 24715.5156 24999.0072 54910.2123 9200.5747 32345.6551 44162.0628 19655.8566 42285.5885 29058.6446 8372.7150 6516.7609 7972.1393 33119.7169 29755.9388 39449.3930 13219.0664 91628.7486 11546.5712 41792.0429 21400.2084 33771.1288 52703.7130 16518.6945 19596.1200 17549.4850 14798.3279 11989.4268 16190.0439 20503.8629 16828.9897 15278.5824 17877.7740 13909.4178 17007.9560 17794.2487 20548.3995 15668.5732 11669.1655 8650.5320 14186.2221 15312.4797 13153.3608 11026.3802 10210.2689 8647.3255 15676.9538 10251.4876 24685.5976 29221.3092 29712.3460 29817.9181 21486.4177 28983.5276 20539.6133 19564.0868 22126.6921 24031.5011 26002.8477 19923.6338 23351.4226 22303.2664 17032.5705 19657.4930 18670.4755 18997.0297 22645.8032 18144.8194 23299.8064 21299.9144 18488.9731 18368.8446 3-methylhistamine_R1 3-Methylhistamine 93845.3413 50214.2776 33582.2992 50016.7065 39244.3084 37752.2071 29985.2187 30981.0647 52578.7642 47911.4148 47508.7924 29907.3429 27833.8026 31460.2259 58345.4088 37835.7159 37109.3144 42531.5474 50235.7895 38191.7240 81436.8504 54276.6107 60358.7000 52668.5684 43853.8213 57828.4054 24021.1512 61055.1760 44580.9534 107101.7415 52352.0482 33008.6268 36073.5962 36169.6271 38437.1927 42111.3072 28591.1114 51172.4297 30816.0905 61132.8952 50911.2694 37189.2830 37867.5789 56581.9063 36895.2472 77827.2430 29643.0725 33372.0281 23731.7124 55599.6179 31196.7624 63843.6856 28710.0137 33494.5865 38815.2854 52459.4066 55591.2041 32320.4054 46665.8198 31815.3807 41124.8085 68294.1947 46153.7428 49432.6758 28117.2051 28478.0816 57116.8167 33977.7626 27448.5627 31110.3475 27802.7460 48518.8936 38493.8083 27748.2510 47554.4180 56924.9941 36060.6620 37806.4821 50653.1176 30249.2201 29317.1583 32916.1618 54674.6718 53293.5094 50080.3126 48063.4002 70388.9904 28089.2031 43446.9500 85943.4292 59178.7803 37902.4444 25135.2324 46412.6418 70642.7741 49069.2983 52476.2743 38628.8870 73775.2100 60041.0150 32521.2833 65692.5949 40445.1283 43338.2950 39975.3174 44138.0550 56118.9229 92640.9315 33916.5404 44977.6796 42737.0587 41276.7471 30302.3910 27518.4706 48485.1059 29908.1522 50559.6176 47290.3758 51286.8499 42189.1901 40536.4783 69550.9136 35654.2997 43581.9808 38389.7131 43148.4909 49440.1014 46022.2360 29026.8558 48936.0058 28627.9154 33465.7546 43910.9588 44638.3031 33873.0774 39717.8450 50954.2770 64891.2476 20289.3678 33601.5978 25967.6784 44889.8091 36630.3795 34258.7654 48429.4899 65818.7977 53299.8068 41357.5327 30196.8874 39302.0624 56814.7973 53394.6375 41356.8538 33688.2181 81859.7940 25481.4049 22700.5035 60657.1518 45166.3601 82197.1871 37426.3261 47331.0326 34389.2992 29950.0868 28531.9459 44388.8795 43169.1344 47491.2773 45940.5376 39033.5497 34378.8951 35183.0420 34554.9723 32075.5883 33490.3641 24974.9211 38736.4337 45246.1660 41341.7482 39272.8487 37891.3398 58567.0280 64519.3464 60396.8983 47844.6485 50981.2103 44724.1973 58214.1246 53700.8195 59464.9822 49951.2835 55459.8902 51723.5246 47318.2421 51090.6826 45759.8757 44743.7902 34767.3741 42109.6334 45719.4281 42396.7285 46038.7074 49667.5896 43629.6373 42962.5385 45830.5637 40706.5262 43345.7552 55208.6121 52155.2476 56723.2075 50242.0620 39849.0548 47573.8340 3-methylhistamine_R2 3-Methylhistamine 90551.7682 48893.5268 36250.2081 48721.8712 37983.3101 36680.5761 29485.7492 29459.5953 53425.4747 46927.0196 43888.8624 29672.0650 27128.9825 31259.6087 61137.1261 37834.4836 35202.9071 42949.9100 49941.4881 36188.6490 81581.0491 52366.5684 60519.4892 50638.4699 43940.0098 56311.6024 23179.2085 58725.4427 44153.3063 105942.4816 51172.7702 35044.1332 36194.3971 37401.2370 36868.5974 41298.8459 30043.6889 48640.1200 29645.5620 62812.5408 53782.0309 36773.1306 37743.8610 56467.6327 36809.4955 75529.1352 27672.7627 33469.4088 24231.8560 54913.8266 28072.4795 60444.6849 28386.2553 34818.3952 40828.0312 52169.0244 57589.6415 32835.7272 45375.0016 30510.8856 41897.1166 68903.8210 45801.7935 51210.3820 30012.0156 27294.2634 56922.4253 35002.2842 26828.0830 30074.8223 25958.8600 47381.4685 41838.1660 26489.8257 46677.9539 54893.5474 35662.1870 36839.0491 49260.1150 27135.6993 29307.6632 31005.9890 53330.8103 52902.7955 49574.0430 47406.7058 70565.4445 29221.6875 44530.1248 86518.9974 58308.9476 36595.9894 26657.7914 45034.3439 75781.1134 46975.9131 50545.2508 36033.2178 74526.4335 66157.1582 30207.0794 66207.1553 41037.5726 42241.6906 41398.8953 44435.1769 54891.0088 88440.1883 28692.0678 40513.7946 40165.9153 43353.2371 30009.5621 27645.5424 47158.8278 28530.3014 52025.9879 48251.9320 49492.5994 39203.5196 43102.5263 66721.4173 35555.7781 42316.7732 39259.6174 41337.9641 48612.5112 46159.8949 30490.1811 52967.5924 32525.4110 31171.1630 44772.1703 41230.3800 33554.1217 40934.3833 50171.1756 65037.0390 20014.0871 34549.6378 26302.1096 43528.1214 36880.7822 34619.1173 48492.8568 65752.3613 52861.0456 42007.8132 29671.1845 38061.2777 54933.6425 51771.0410 38198.0831 33322.0179 83409.3043 26145.5927 25110.6232 68610.6480 44008.1524 81080.2691 36689.6806 52380.7296 35845.4952 33624.3824 28419.4968 45676.2659 44059.0647 45644.2581 42916.5185 36424.8232 36192.4700 33799.4206 35257.4382 34725.9076 32779.0402 25304.2552 37467.0632 44912.2375 43514.3371 41115.9560 37057.1574 60506.9848 63621.8791 62003.3581 46539.2874 50098.1750 46216.0964 56021.9850 52627.1951 58682.5263 55863.7954 57008.9079 49976.6720 49704.4758 53079.5137 47923.6349 42610.0330 40129.1982 42819.2034 43387.4288 45632.4164 47256.8803 46378.2834 42669.9630 41029.0689 42588.2479 38495.1102 42612.1324 53434.2046 50396.8498 57534.1870 47103.4977 37799.9786 46030.4864 3-Nitro-L-Tyrosine_R1 Nitrotyrosine 1281719.4420 2280358.0090 1402235.5880 2211842.8720 1150715 1859564.2870 1338466.6240 1804140.0320 1363064.0360 1419591.1730 1123428.6720 1276065.0180 1267136.0590 1656829.2810 1850069.8840 1978979.6470 1413936.9700 1324133.8180 1452853.6180 2005614.3850 1971567.1050 1723561.8970 2752576.8870 1422551.1120 1779641.7530 2121467.7300 1357458.3540 1899032.3100 1994902.0370 1540454.5740 1959798.8020 1562338.9450 1331391.2900 1431902.3330 1103140.3430 1652126.2160 1365934.6840 2074647.4160 962733.6449 2385206.6790 1815705.9980 1094746.6040 1327471.4880 2044368.2180 1026849.8110 1939486.4000 1463790.7420 1191462.8840 1546647.6090 1409076.6920 1732789.2980 2112491.9280 1237629.1000 1180111.8510 1582077.5750 1886015.3290 1948654.2620 1757037.6970 1709875.6750 1315992.7740 1632343.0040 1530723.0260 1591432.4140 1283486.3940 1099365.4320 1228416.6630 1569579.9980 1466694.9240 1158755.2430 1732602.6800 1441890.6100 2162250.3310 1752373.4200 1243727.8830 2292393.4500 1879189.7590 1363874.6950 960883.3778 2049592.9590 1197017.4220 1263602.8600 1812932.7360 1382410.1090 1325574.3140 1436490.8300 2186879.2500 1924129.2470 1284067.8900 1292667.0130 2255192.2420 1918913.1200 1342009.3610 1615564.1450 1282644.7460 2326189.4260 1495628.3630 1517490.6900 1517246.1140 1562118.0310 1542358.3020 1710211.7980 1570781.0320 1300837.5530 2179801.8710 1241684.8460 2182108.6000 1883204.6770 2837043.0280 1198735.2240 1908714.6860 1216062.3160 1377986.8210 731307.2741 1154732.8950 2763756.2400 1107290.7030 1739667.8810 1833020.9210 1673542.9480 1357628.2580 1353855.8060 1639958.4990 1298495.8200 1642084.3520 2379524.3610 2006809.8740 1523014.7700 1421175.8790 998540.7537 1736426.8690 1623991.4720 988218.6054 1401222.1850 1364499.1920 1538475.0420 1661820.9250 1198381.3630 1832580.7580 1449300.4420 1238632.1190 1399094.8000 1430528.8130 1696582.5450 1844342.5650 1981244.2690 1313010.3980 1415299.5690 2056348.5030 1808132.9830 1432933.7130 1749086.2240 1615119.2450 1365469.0170 1303576.9460 1948239.1690 1481418.8820 1492703.8740 2237205.7560 1943429.6710 1985134.6890 1358517.0310 1403048.2650 1897591.3400 1862889.9220 1482712.0820 1794515.8350 1770199.5960 1886157.2980 1818636.0210 1538117.7120 1526921.0250 1570138.8030 1573052.0740 1473221.9280 1423953.6660 1246240.8060 1334263.0420 1767161.9720 1628396.4390 1573717.9440 1374953.3060 1953406.0330 1914125.6250 1949910.6600 1848472.1870 1895795.4250 1841166.9600 19953.0168 1892742.0960 1850179.2440 1841123.4270 1734279.4900 1899690.1070 1778119.1610 1728466.2880 1750476.2460 1547984.0170 1480075.6380 1486381.9980 1712549.4000 1775602.1430 1606208.4750 1565861.9780 1406234.2030 1459369.2970 1446645.4810 1515923.6530 1668463.3950 1767459.1450 1661176.9850 1705928.5300 1648083.8580 1569028.3820 1418291.7890 3-Nitro-L-Tyrosine_R2 Nitrotyrosine 1205397.8240 2159978.7420 1321199.4840 2129939.2450 1091185.8930 1783180.4660 1264944.6410 1731806.1700 1304991.9820 1338236.9620 1064869.7870 1216484.7280 1189142.0660 1562911.9110 1750930.0340 1877808.9340 1335176.2700 1243927.2560 1377684.1680 1919982.2830 1865423.3520 1630622.3280 2608954.0870 1362312.6420 1686200.6800 2002194.4670 1280027.7030 1795224.0290 1891562.7090 1454692.0200 1852368.1900 1481713.3910 1252556.5580 1354848.8220 1041528.7310 1568658.1080 1299706.0520 1950812.2190 911668.8875 2261602.5690 1719714.8070 1031143.0550 1249080.9110 1952531.7190 972836.7023 1824606.1490 1399161.3890 1123718.1320 1459204.3570 1320038.1470 1646485.2650 1982621.6970 1167628.0550 1118672.0700 1498280.4830 1776760.2480 1851886.6870 1658518.6930 1623966.6970 1238871.2780 1543968.9310 1441733.6600 1501662.7830 1223828.6670 1044989.8660 1164757.5120 1486940.3480 1402661.4530 1094439.9530 1631073.6800 1377990.2650 2049097.8850 1655675.4740 1173225.8960 2181371.1470 1774301.3330 1292850.1140 905865.6285 1935058.7610 1162132.0710 1187041.4070 1706622.2330 1300320.0800 1255750.0780 1350211.6900 2067883.3360 1823123.7940 1228418.7420 1227445.6370 2125398.2560 1811171.7490 1267837.5640 1529628.8560 1203963.2210 2193896.0320 1414841.7990 1427800.7540 1465881.8570 1484303.2910 1443854.2290 1628341.7740 1487862.4110 1234071.7730 2047892.4420 1166353.8830 2071993.8100 1788776.6290 2661292.5140 1125183.8200 1816028.3330 1145709.1500 1306736.3430 686430.8712 1083805.2110 2621941.3210 1045055.8990 1665016.3510 1735011.1900 1586348.2230 1291515.6780 1277848.8390 1555920.1220 1242566.6610 1547470.7990 2258315.0310 1888932.2250 1432508.6220 1345725.1230 938798.1180 1634081.4370 1531548.6650 933903.5300 1343216.1430 1293407.4220 1447934.8740 1586195.3710 1134375.5830 1767735.5590 1364302.8130 1167601.5880 1310659.3900 1353158.2070 1605145.7610 1754180.4240 1877491.2380 1246463.5860 1340873.6900 1937534.4800 1734445.2480 1354184.8630 1650030.5600 1537372.8060 1285896.1990 586012.5917 1839802.6770 1402851.3250 1409106.6010 2122312.3260 1837207.0350 1893225.1270 1286255.5560 1326208.4080 1792148.0610 1762415.7870 1405562.5150 1696954.6770 1675944.4010 1784880.0930 1726368.1090 1469983.0190 1439302.7730 1480645.2230 1478261.6980 1388607.2520 1354963.9950 1182703.4280 1264355.4130 1668048.2200 1537126.1320 1479660.7430 1290472.3530 1874766.2290 1814437.2890 1852649.5280 1739501.8510 1787587.9010 1736420.7700 1634208.8420 1789552.2780 1759215.9080 1751968.3890 1642921.4020 1805826.5160 1679881.1730 1641138.5240 1660583.8080 1464130.9990 1398111.8910 665982.1035 1696149.0840 1675553.6650 1518225.0280 1483651.0290 1326575.1180 1375803.9810 1364806.0590 1428754.3800 1571636.0380 1672364.9630 1622869.4300 1603456.8580 1552156.0960 1479585.5550 1339482.8910 4-Acetamidobutanoate_R1 4-Acetamidobutanoic acid 539194.2394 625524.1645 418840.7469 840876.7218 337797.7326 589295.9456 553853.7986 739284.1792 395046.4800 617701.2803 328377.4830 350634.8879 544608.8044 568569.5163 687943.7477 646349.8265 480200.3630 430374.0832 525165.3271 697363.7021 690860.2368 471998.0147 768681.7623 535873.4118 488470.8935 539343.9911 402207.6326 739717.3295 516218.7944 1071971.9850 671209.7547 426986.5957 510474.0664 395633.2653 341457.4758 431326.3527 491782.9516 615981.9889 371582.3503 925927.8060 786786.8448 351309.4784 431919.2473 654653.9949 415958.8566 615651.6196 425861.4934 490499.9046 452597.4053 561413.6344 542976.2323 619034.0482 466332.6325 495534.9963 533043.1023 589295.1067 624008.7192 407811.1757 570804.8745 454217.7588 297600.9189 482157.3869 965920.8086 337795.1913 344017.9258 420768.4064 448215.5477 366676.9746 332879.2163 645482.8060 352894.2968 693648.7835 1244540.4660 389919.9055 779318.5272 596297.9028 340148.8759 392687.5043 724310.4100 322321.9342 475992.2286 481697.3263 387937.9063 355695.4911 453735.5092 610176.1288 469523.0914 334172.6546 526400.0703 690693.9513 580670.2305 498331.4073 486190.8551 417187.3262 649347.2424 419082.0547 428218.1928 492146.2420 365078.1237 456398.0182 681716.3862 489472.8421 400900.9370 1021749.1830 445822.8478 723856.5719 524869.9344 1184087.8620 272879.6399 624360.6383 266686.4661 535153.0922 215731.4057 313100.3986 643758.0911 329401.3697 512820.8036 668196.7157 601926.4827 402526.6535 545513.3202 610005.7927 475562.4949 499698.4975 777221.3624 718642.0971 583380.2391 287230.5554 481473.8800 422321.4818 453097.2281 256661.7673 400649.2033 358613.1267 469651.4049 658906.7403 515562.8549 496690.4499 353387.8655 369439.3687 392362.0442 404792.0305 737060.4019 688191.8898 720948.5069 573045.5123 561481.7660 572137.6471 443804.7489 459673.0683 783388.5789 435925.6174 528576.3569 414378.4074 722193.3070 562503.5833 595353.8505 1052645.5920 888946.2367 528613.1872 392353.3920 357870.8073 626299.0439 475402.3809 458604.7558 678602.8127 709273.1118 699487.2111 728222.7832 621826.3711 621083.4382 599051.8847 576825.4707 528354.3889 555396.0068 535218.1506 556775.6765 644227.1292 684582.8924 650462.2927 617432.2412 555488.6071 541291.9050 552259.0641 517931.1078 508743.2146 493923.4286 558344.4042 575876.6898 557262.3507 543050.9925 559022.3028 629483.1947 535327.5774 608225.4979 575995.5863 466942.1244 515710.7436 506115.9382 535297.3097 513998.7972 547040.0183 486075.9684 455822.0389 474750.7620 455985.9443 495145.4444 500154.4056 586036.2162 604689.9983 637597.1884 582482.3647 572349.8999 561706.2819 4-Acetamidobutanoate_R2 4-Acetamidobutanoic acid 407928.3008 528762.5543 336217.5327 721556.8207 301544.3614 503896.0445 462098.9621 623043.3414 314635.1241 495138.3623 260165.3474 295186.2683 441157.8653 481127.9809 538250.8029 537594.0562 375983.9636 347063.1714 435915.2753 560229.3615 573653.4755 397182.1776 666338.7691 452832.0875 382782.4990 444569.0208 318299.1951 581535.7487 430286.6865 913010.6296 552464.7578 332708.2383 412421.9837 320072.5521 271038.6301 363824.3330 421621.9214 504241.8268 289483.0601 778244.2879 659322.1193 275002.7974 353594.4063 538237.3313 316576.8146 524110.4410 345870.9954 409886.2351 384355.0328 467330.3281 460893.9622 475453.3830 368774.7916 390007.2852 447354.8354 483519.6227 511618.0011 334001.9152 493404.6955 376581.1195 251599.7843 388909.5700 794294.8549 272985.7895 263217.9065 345802.2348 375865.8450 300196.8598 270364.9517 549472.0414 282246.3195 605634.1439 570643.2187 338272.8167 675676.3895 500959.5147 271580.9444 315706.5792 592577.1300 252998.0565 391497.2187 394169.6258 319349.8281 293490.0318 372023.9826 494700.3569 403194.6208 263810.7416 450085.3833 556413.8393 474069.3596 418984.9239 380229.8593 337739.5673 539132.6792 358954.8157 362951.3292 405123.4813 292793.2350 381596.8242 584258.2403 394951.7195 343678.5933 873391.0060 380098.2584 600980.0788 434275.3904 953050.6037 216504.8422 514970.9500 206965.8483 427540.1517 176079.8768 261453.1600 540568.6024 295519.1559 424643.8488 558461.8754 495911.4174 340287.5118 456342.9389 495940.3977 376840.7064 412845.0156 667663.3954 587530.6623 482925.1552 225964.7583 402718.9207 350947.1986 378182.4954 233279.8417 395484.5743 289653.2462 401565.8186 555086.8636 411147.1311 404395.9750 272729.6225 300420.9930 332517.5784 340213.8975 611429.0598 580713.5519 606948.3686 459091.5776 480538.9772 478579.5857 349685.8543 373295.4108 656201.8981 347963.9127 417964.5423 343538.3212 592092.4436 467738.3634 493140.8580 898975.3959 766966.2322 473110.9709 329313.0130 284354.9638 518242.2029 388798.8030 391014.8410 547583.3065 573736.5589 579133.8775 576583.5966 510028.0170 505263.5769 491904.0974 472525.0176 423512.2390 433346.6648 410899.8295 433165.8922 527913.0969 540526.9518 519522.0270 511544.6120 458538.2363 458791.7533 465455.0601 434676.7959 414352.9238 421128.9083 465776.2068 475583.1876 461040.3776 454461.8679 477811.7615 547753.5288 460913.7214 505167.3005 474735.7137 399347.6057 428665.2442 438352.0422 447266.7258 430765.6326 458985.8045 401754.0608 378001.0214 390628.7326 369900.1540 416530.9946 415045.4848 486593.3211 509821.5900 526104.1438 477154.9797 482017.4037 468801.9820 4-Aminobenzoate / Anthranilate 9946.2759 11640.4739 7811.0101 12983.7735 8024.6735 9105.6068 7699.0015 6766.3680 8124.9393 8628.2064 6278.3269 8622.2725 12050.1865 3890.3006 10713.2822 13232.7278 7174.0933 8269.8178 10211.3142 11006.1789 11469.0188 4015.7743 15286.7734 7428.5207 9485.7237 40670.0359 12664.2063 20538.1610 33209.3412 8931.7563 12795.6039 12169.1081 6089.6179 6748.3799 4730.2589 7862.1145 6223.6876 10379.9221 12355.4102 13772.0405 6722.0677 4923.8446 8779.3026 7939.7406 4479.7073 5733.2380 10654.3059 7095.3482 5901.1274 6169.0312 10859.4855 19975.7264 8442.5170 8608.9124 5798.0941 6961.4632 10059.7585 70663.6159 11008.5589 8075.6523 5958.3122 11653.6495 12824.4492 4778.0759 6550.3506 5961.5787 5533.7400 6937.0504 7357.4846 7581.6614 7284.3722 7724.2634 15200.0518 6902.3511 8036.6593 6335.8569 6972.1941 4310.4722 18730.1496 8060.4731 5712.2494 8563.2007 4808.1072 8865.5805 7309.6454 40532.4790 13419.8521 9574.0249 6764.5724 13723.5232 6127.3115 5392.9221 13739.5699 5842.7183 8320.9506 7484.3177 7596.6408 6539.4165 10735.4773 8229.1296 5453.0878 9642.2188 5010.8173 5745.3495 6518.8667 8092.3633 6434.9034 13420.6224 15836.7431 11920.4960 9274.3197 9319.5939 8659.3855 9327.1048 13384.6089 9098.4397 9922.2880 6636.7029 6603.9028 7575.2970 5679.7208 9444.6798 9885.8102 7353.4228 11495.4296 11130.5351 4497.3898 7701.7491 5989.4064 16108.3685 6183.5541 7460.7403 6838.9395 6751.8643 6933.9252 9926.3007 9244.4717 11538.5770 7434.1923 7009.6411 12284.9693 7107.1815 11618.9446 5498.4933 12606.5445 11937.0887 6252.0360 8709.3479 7761.8221 7709.0881 7769.2781 6631.1030 9505.4833 5958.5865 10550.2742 5257.7928 8753.3832 11083.0356 9929.2446 10100.4103 4884.5547 10679.2725 8120.1340 9160.4512 25966.1741 14333.4123 13592.7756 12630.3358 11929.8583 8994.7862 10627.8906 12432.0596 12284.6957 13414.0936 11503.3810 10453.4484 11997.5612 11715.2219 11595.0049 9580.2990 10358.1714 13600.3397 14885.1437 11635.0644 18637.2696 15266.4340 15271.7683 12776.8934 12852.5152 13704.3739 12063.8592 11123.4086 10689.9133 9877.7843 11845.6786 11077.6065 9019.6884 9493.2049 10235.5745 12050.9103 11340.9919 12663.8382 11658.0187 10566.9575 13241.9528 11483.0464 11217.6075 11677.3892 10376.8271 11440.1495 10763.4433 10204.5602 8372.7334 9203.7786 4-Guanidinobutanoate 4-Guanidinobutanoic acid 16333.2827 1997.2213 1137353.9680 21108.2956 1199503.3750 1287705.2590 2970.6469 6539.8022 8284.6354 2369325.1650 13548.5491 1227717.8110 2170132.1680 1626277.6660 1248378.9660 2192.4958 7129.6385 1234392.9050 8023.0440 1148824.1680 108336.6104 8326.4222 43883.2830 15855.1255 25902.8907 22966.3696 642931.9380 16657.7460 24645.4250 10997.5908 8774.4803 6489.3355 1022357.3600 375470.8441 8293.9698 965466.6649 452309.5604 1159078.2080 7819.6302 1655309.4440 430187.2988 34707.4697 19617.9000 23956.0819 734657.3328 12812.6604 16573.4084 13007.7442 588231.2071 8743.0184 232361.8740 19084.2823 2049077.6800 22168.4303 1333686.3790 19683.2497 957649.1196 1372956.2180 12182.9707 954672.6919 6537.5443 423533.1629 1937.6879 20433.9392 20346.8625 416939.8762 13056.7584 3158.6844 13949.2979 16847.6873 3294766.7490 43828.9966 40211.2991 3827.0887 4609.7433 332670.0786 333555.5169 2137215.2840 500796.5271 11145.5874 429606.8273 894591.3008 45483.8170 33157.4642 46575.3866 32356.0756 25331.4529 30252.6028 29584.3873 24801.0341 29817.7130 24050.9350 28209.2556 26737.6022 21250.9858 21593.3726 21336.9258 21879.2177 18234.2042 8191.9979 24675.5286 33712.8118 24261.2101 35549.9948 23754.3251 20133.8313 30750.5014 18591.1214 14521.1837 23281.8429 22660.0008 14977.3243 22668.3134 23487.1431 22502.0444 20413.0493 22953.2530 17346.2519 20769.3102 18773.4598 20997.5987 16036.1071 15731.0851 17578.8342 4-Hydroxybenzaldehyde_R1 4-Hydroxybenzaldehyde 3467696.1790 1691412.1530 6268165.2010 5791178.2740 4175698.9810 3225594.1420 6560757.1570 16357357.0600 5286819.9570 8661772.4930 2885890.6070 1909348.6670 2380183.1650 2628114.6880 2893449.4500 7740839.0620 899702.8609 6678410.1460 5664204.7400 8225965.2230 7545526.3510 1471979.2530 3804107.7910 7675055.6190 4697362.0910 5224303.7790 3971737.5100 4109855.4240 15589952.1500 3190293.3430 4154760.5970 6535482.8740 5399186.1490 3248141.0750 5076675.2330 2922926.7840 3951041.8360 7499857.9190 1570000.5540 5811782.0970 3777594.5220 4965096.6470 1963866.9130 12757420.2100 8366892.5070 2151416.1270 3582460.4660 4877544.6670 8808760.0270 9329096.5560 2273095.1720 4311565.0760 4503184.2290 20931605.0900 2446763.5710 7811038.6910 1555138.8260 2362081.8770 4878535.7830 5508887.9250 2833006.8760 3074698.0360 5750736.2820 4717885.1820 4570179.0960 3567418.7430 2193295.3060 2059196.7360 4407294.7280 4920527.6540 5453816.9550 9024236.4060 6990540.4080 5860110.7440 4985195.9990 3150176.3810 2060102.6190 4712166.5090 4731862.0290 2044126.0240 1831582.0080 3058299.0080 3504343.7150 3033264.8630 8815960.9450 5581784.6760 3861198.3190 4946037.6190 2144069.0870 10229419.0600 8167576.8380 2235395.0970 5665118.3020 7400078.1330 5231474.8910 9490960.2170 12870505.5100 9091346.9930 4277661.3580 3085256.7790 2820019.6790 6108360.2660 1598417.0300 4612819.0190 5893257.0290 5101097.0060 684719.5509 9761294.0950 1455486.8160 6130149.7580 1687525.0430 2223101.1860 2483768.4830 6813653.2570 10901885.3800 2681183.1770 4936721.4330 4878160.3070 2687609.5670 6118650.0580 17303082.2600 7681458.2640 4447547.4990 10187362.4000 2138714.7080 2969698.7060 2490720.8020 5124853.6790 4501607.2290 8312146.4210 1825010.7680 1373193.4110 5597560.4780 2274672.2980 8815287.9240 8174996.8820 2149801.8080 3788952.4310 2458972.4330 4409015.9760 5335614.8010 9620436.5230 9172838.7150 1406683.5300 3270814.0180 4870528.2120 2256366.5100 4609321.8610 1272285.5980 1289118.5660 3219219.2150 4268122.3260 4527190.2060 3490402.9770 7234663.0920 1836600.9090 4039243.6700 11237317.4200 5084706.7210 10395778.9700 809992.3876 2965816.4320 7906523.9890 2443838.4400 12083437.2700 8143271.0600 8273303.5330 7835940.8410 8092110.5170 7075659.2090 6762102.4110 6789865.5060 7037949.4380 6120913.3450 6156310.6540 5915298.0730 6500087.1670 7502528.0240 7197471.7620 6699617.1920 5740746.3940 9323828.4520 9149049.3170 9254592.0760 7895702.4700 8296712.3140 7075214.0040 7589581.3080 7577808.8500 8108866.9300 6406357.6230 6267130.3870 6560478.8710 6169626.5220 6439839.4360 6228449.4140 5778679.5510 5614627.3370 5412005.9970 5648562.9970 5607578.0650 5547801.8460 5263320.2060 4899762.5990 5389045.5760 5087910.7180 5273862.3260 5732864.8550 6267240.2430 5610201.0560 6234334.2130 5668157.5520 5583132.6890 5162832.5580 4-Hydroxybenzaldehyde_R2 4-Hydroxybenzaldehyde 3370526.3340 1659116.7810 6080982.1390 5637799.0270 4074633.6140 3162241.8540 6370022.2330 15731054.0900 5155797.4560 8403216.1500 2822565.0280 1875005.3350 2325901.4610 2566340.1190 2834939.4170 7550360.7960 883214.9864 6490680.5360 5544288.1980 7962855.1930 7343668.6250 1440728.8960 3731718.3760 7460904.2090 4608108.0820 5095014.5900 3878120.1980 4008389.9770 15176642.9000 3107626.4410 4051019.4810 6377006.5430 5267140.5440 3167404.4200 2247467.5660 2855370.6330 3850043.6370 7270485.3270 1528331.4180 5698545.7330 3696011.6000 4822514.4210 1909161.0020 12435536.3600 8125205.3630 2088884.5240 3478464.5440 4751032.5940 8570726.1070 9034975.5960 2212536.9650 4187226.7930 4372540.2190 20447637.7300 2407757.7950 7583125.8630 1516217.1450 2298060.9940 4775024.7590 5369609.5500 2763031.7950 2984001.5300 5601686.4960 4606281.9530 4462490.9100 3470437.1870 2147984.2510 1718916.1550 4298604.8960 4801277.3610 5321240.6670 8795201.1480 6795870.7550 5689612.7800 4894453.4360 3071856.2280 2012150.1780 4563696.0490 4613699.8270 1998211.8580 1788798.2000 2975667.7150 3420041.9020 2963035.4850 8523647.0590 5428250.1120 3755428.9470 4843222.4400 2100275.8440 9916091.9710 7932770.2060 2183475.7360 5516231.3780 7171388.2620 5091018.6680 9268143.8060 12443431.4400 4050251.4360 4160273.3220 3007460.4360 2752041.7190 5951668.0620 1562532.8790 2016469.6200 5708188.5000 4988251.6160 668315.3830 9499725.6150 1418441.0550 5950920.5880 1644840.5450 2169988.0150 2421695.0210 6626196.3930 10621248.4700 2617559.5660 4833455.7120 4773479.1770 2621997.6110 5938878.7750 16761054.5700 7526523.7340 4323312.1220 9898359.3650 2102760.4260 2900219.8500 2433388.4610 4976070.9310 1836818.7760 8063356.4550 1778939.4340 1316264.0930 5440598.0390 2214642.5860 3374118.4820 7920659.5660 2092255.8300 3689112.0890 2406302.0130 4287315.0150 5207303.6100 9387761.7630 8929044.0300 1375291.6460 3198065.5650 4756490.5140 2205467.4040 4483178.4840 1240746.7050 1267205.1550 3126022.6870 4179481.6420 4412446.6140 3389506.9760 7038806.2930 1793196.2460 3945144.4220 10850366.5900 4957667.6690 10158923.3200 797406.8526 2882518.3180 7665788.5600 2372321.3470 11775055.8800 7974544.7780 8072041.3570 7652722.6740 7894062.4600 2923110.3600 6578200.3970 6623421.8640 6849545.7740 5953380.1720 5966863.2230 5739270.5640 6336523.4930 7276796.7650 6980764.9750 6487545.9940 5566628.7830 9141842.6350 8935395.6390 9060991.2000 7681897.0010 8053951.1100 6873002.8400 7363283.8880 7353028.3250 7881200.2880 6275507.5280 6144237.5950 6401240.6460 6027561.1170 6296643.3370 6079780.1640 5627868.6540 2261946.1590 5268008.1240 5488850.5380 5439705.2250 5383248.2910 5129738.1050 4784740.4340 5232331.8130 4943555.9820 5137073.4000 5564496.4480 6086827.5180 5440364.9740 6048030.7340 5501786.3860 5421034.8150 5021894.9090 4-Hydroxybenzoate 4-Hydroxybenzoic acid 667.4739 6034.7067 1986.7440 10167.4991 20958.1920 2201.5599 3879.0323 957.2711 20232.7671 3772.4123 3090.6350 86844.4884 15206.1688 3781.3362 9595.2619 3195.0303 3259.6280 8258.1639 5167.4612 5751.8395 18252.2141 875.3333 12181.6088 638.1611 2949.9807 2977.7162 3167.3993 6136.1815 3709.6847 2512.8736 10331.9950 4360.5746 3444.1411 2399.9250 8850.7949 3096.7416 832.7242 904.7241 1522.0746 2675.4783 810.3024 7049.8898 1535.5987 7507.1473 5958.3259 3947.5634 4810.6200 20844.3496 3738.1327 1716.0544 14997.3901 3937.8799 6859.5873 7681.9697 5405.1941 2823.1273 2741.5740 3287.3964 41482.5698 3869.5415 3181.8567 4842.8123 10802.0091 8889.2720 7200.7781 3358.7718 2129.1810 658.1616 1882.0451 32799.6300 3995.3917 3258.6342 3590.4940 3509.9677 1071.4258 1994.2180 704.2687 3721.7545 1470.1814 6683.9784 3794.3014 7049.0478 4631.8377 5282.1582 4314.9250 1898.1664 4918.1097 2890.3991 3793.2304 4730.0309 3203.2561 3110.3914 7972.3159 3733.6213 2749.1391 4-Imidazoleacetate Imidazoleacetic acid 279291.4399 133515.0824 3740.7915 48902.5383 2636.0776 131522.0875 7356.2725 3776.4160 5504.8863 8519.1362 8392.7687 4507.6268 12434.7996 5279.7034 4160.9428 3491.0039 1991.6798 73431.5922 109677.2771 6489.6935 7467.2644 7210.8649 6546.6195 2319.0990 465919.7531 7088.7096 18643.2821 8739.7715 144236.6584 5413.7078 5267.5823 12291.1666 8462.4402 23679.2520 59433.9770 17781.5667 16709.3374 17672.3212 15042.8815 14660.1496 11811.0462 13180.6500 12712.3750 10535.8939 6805.7984 6770.7858 5850.5785 7594.2264 5516.6192 4382.5255 3989.2670 4738.1840 5516.4134 6444.9354 6127.7001 5997.2283 7827.1170 3553.2563 6035.6758 2536.9370 5390.4337 3557.5087 5295.9188 3917.7148 5662.0467 5439.2099 5432.8922 5184.5273 4-Pyridoxic acid 4-Pyridoxic acid 345238.2225 854923.4173 361977.0754 262305.9200 280506.8807 333153.6189 527730.0187 365196.8556 237917.2555 385075.1015 636429.6083 715345.1059 192738.4891 427961.7687 196141.8981 201067.2615 218165.0530 277500.5698 709098.9483 181533.1060 125671.3615 465538.6069 442026.9485 238072.0154 459060.6000 261811.3043 640732.9367 213366.5105 370054.3363 310822.6577 235351.5881 250316.7770 280200.0837 316231.4522 360026.5752 584825.9073 184737.1971 384846.2178 166884.0237 298414.9290 786380.1430 615603.4318 300522.0074 328267.8187 416563.2243 407306.4216 266144.6331 456751.9069 487368.1103 404444.6392 500449.7133 207268.8255 255750.2976 232395.7167 317166.1475 253143.3476 606902.6513 274416.9969 357287.2134 187089.3426 406903.8929 247713.7269 262725.8585 160704.8006 564934.0893 219763.3334 424680.4853 429233.7216 414099.9751 517438.6212 368902.5582 506868.6474 314541.0558 178961.3767 514556.2614 606705.9812 294935.8600 333582.3243 267187.7025 259626.0919 481630.5421 540450.8549 439373.3219 1084720.0480 315398.2447 311550.4388 456538.1597 499681.1818 200319.6817 311354.3752 370451.4833 267299.4510 309955.7215 197687.6186 611363.9284 257447.4630 452982.8770 203647.5235 387404.2771 350652.8481 435556.0421 344277.5817 226893.8661 510036.8893 168270.1618 339897.8996 182110.1370 587020.4486 340572.4425 256016.7504 561864.7278 670882.5271 1124950.5050 452553.1417 241922.1631 643403.8822 544498.3971 212970.2926 340464.9071 420979.9738 181988.2902 681729.1082 541673.2455 258553.5795 426408.5189 507330.6308 292968.5451 225042.0513 221717.2114 251207.2008 175773.9091 549965.1994 278226.1302 497955.4850 252371.0665 344163.4862 259857.2124 428323.6846 964734.2781 492595.7149 318326.4641 284580.0988 132764.0611 213201.4462 333652.1430 517613.0371 187859.8306 283313.8725 669670.1088 294910.2211 172699.2251 303452.4523 554403.3850 198837.6373 127133.9619 296015.3073 346371.3939 480795.8663 548974.3174 321822.5208 581154.3263 309760.2728 604361.4445 405146.1023 273150.6500 419915.4271 443969.3618 384220.9524 435865.4919 329654.2501 302646.7119 406238.1014 406912.7461 404775.5900 415654.5547 406228.1674 420882.5987 323801.9596 316248.9696 276138.2081 244461.4555 372981.8295 418277.5944 391077.5069 303546.9604 342525.6699 317586.2173 281413.5078 296151.3235 302423.7968 355498.8629 349795.5843 380648.7491 321208.7185 366090.9027 312772.1684 283225.7567 335206.7858 298550.2045 311101.8983 311543.0632 324033.9778 369286.7427 320799.4186 338595.8022 293016.4086 320466.1866 367431.6432 341828.1366 331397.7743 292867.4055 288911.0507 276633.2662 343684.9275 4-Pyrodixic acid / Xanthurenate 338429.6134 845670.1646 331742.2084 181612.9389 286335.8353 314447.5367 488353.7297 370279.9721 224531.5590 308602.2650 607612.4998 690069.9118 163635.2014 403326.0980 183955.3684 187036.1502 203900.5732 268035.2478 681290.5985 195684.6921 141659.9089 437422.4849 426080.5305 294014.4832 436452.6874 270055.3987 668723.5425 222620.5524 354579.3010 276205.0930 220145.5804 224694.0679 281116.3529 330472.5025 350166.5767 556759.7218 171234.6133 358643.5167 167534.4066 327008.4289 764376.0372 587768.3484 254083.2269 321346.9444 396262.6612 359039.3781 219677.4453 427544.2343 450215.0229 385781.4727 440452.9130 226508.3236 282864.1317 244645.4114 307333.1983 240874.3347 528926.2514 291552.2265 349657.6201 211879.0482 413546.5158 264670.7634 264387.2707 165146.8723 557934.3316 200231.1151 424050.7814 422898.2851 335813.7652 393072.5657 372790.0189 507011.2973 328710.5821 168714.5260 522065.1854 562836.2266 282208.2871 318486.1895 248605.7867 283109.0833 465186.1500 537039.3476 380504.6795 1066003.6940 309540.5785 296555.3611 426865.3411 431731.0318 176060.8156 309040.1767 349371.2336 301738.7696 338388.7413 191468.8719 497401.6683 308359.6533 426135.6878 228410.5768 412989.9459 331722.9852 400843.8993 310525.2134 215221.4852 482088.5400 170041.4801 361832.2069 202041.1966 580671.2128 322214.6299 197247.9786 532684.9844 688360.8738 1081418.1530 426811.6075 244795.5792 611520.3997 491453.8008 205199.8123 260838.6006 402371.7620 164091.4926 662921.9640 515933.5384 245520.3628 393013.6258 470585.8348 243798.6171 240830.7005 188205.8944 243897.9034 155454.8204 563865.0207 216436.4478 462443.5533 219045.7521 308660.6854 248197.5562 420077.7811 923581.6061 455222.2734 299059.8122 295060.5602 226409.8825 222198.5470 343213.2424 517918.3467 198615.0202 242465.0348 637918.3088 300869.9656 161978.0052 297332.2388 545302.4532 195835.0421 119983.0256 285841.6230 343900.7338 432957.0722 528324.9985 358821.1831 588121.4610 299493.8300 582242.3266 369320.7286 243857.5189 443376.1192 461072.9514 423743.1083 476404.6040 363367.4735 348142.9619 371409.6671 374653.6668 387436.4251 381120.0179 379118.6612 386233.4236 374774.1560 353320.8537 331256.5182 290877.4788 394402.0451 392122.3101 404652.0808 309780.5278 340027.6970 310119.4796 304957.6605 304698.2685 311039.9952 356111.5170 351211.3515 387347.8956 349804.6261 382839.1640 388126.7391 340641.7544 319290.2657 284237.1664 360612.0057 369339.4837 340347.6406 353859.1747 326013.7762 354449.4388 334126.1437 336636.7685 390844.0344 324196.6372 305474.5732 311373.6879 303051.7939 274938.6472 308409.4136 5-aminolevulinic acid 5-Amino-levulinic acid 123903.6999 83605.6493 42119.9603 190781.6739 89972.7362 77521.4937 70177.8609 129691.8860 115785.8437 88865.4574 88821.1674 39982.2950 95769.0632 184730.0190 155462.3681 198410.1040 83159.6353 115828.5837 111640.6464 174764.2085 162821.4417 162353.9643 221168.9157 66210.4475 174710.1194 150746.3306 84888.3283 281411.0972 113541.1733 116671.4871 142919.1394 96954.8118 117856.2858 50311.2889 66910.4358 156705.4835 128254.2242 143447.3225 66026.6330 186119.0427 158235.1169 84191.4840 102997.4735 208674.1741 168720.6641 36371.8984 38849.2124 118546.0722 117372.6981 124101.1355 274302.9634 97629.9163 82744.2042 160054.6867 209540.1159 166105.7399 213096.1146 100912.0492 113005.0444 148661.8619 137101.0012 227297.4565 108805.3149 67933.9276 104210.0647 126392.0355 169117.6297 111504.2781 242915.1691 64522.1018 87801.4459 190876.1331 96110.9770 145188.3189 181002.9808 140200.3858 103759.1458 222352.6704 53357.0448 56755.4249 117431.4274 49530.7593 74081.5243 128342.4337 177909.0080 142044.8570 89459.7954 118450.8761 258508.3755 265086.4996 141475.4234 87610.4523 82938.4520 217981.7266 114413.4643 120246.2658 101473.9273 180492.8176 32381.2237 259049.0746 112506.9385 66091.5647 212378.5701 34852.1606 221605.4517 242097.6417 93950.6757 174048.8698 75676.2488 47488.7666 31385.5756 69305.3259 247174.8022 87583.7410 192958.1697 94962.4549 82354.2052 9912.0347 90598.4123 145949.1360 151744.8877 166012.0569 209025.5980 185898.3555 63038.4405 70079.5161 65952.8943 300635.7394 127019.9254 53474.7772 80280.5438 145636.2934 41562.1302 134232.4277 40509.6065 131797.3424 111776.0395 88197.8810 120668.5741 109854.8707 78305.5008 198674.2812 141482.3984 93726.4232 134146.6030 193336.3166 155090.2759 195377.6692 128201.4845 102000.9612 144094.3904 94988.5379 103323.7600 124356.6283 153873.0396 305980.7219 110340.1969 205807.6769 74885.6582 96661.1402 163969.5270 85746.1926 46356.8819 55611.6159 58548.0042 50636.6744 47590.5737 45313.6386 2325.0407 52737.8577 53591.3443 46005.9853 50067.2016 42504.1301 30413.1150 67684.5903 55703.3047 57156.0697 36356.8613 54434.7529 54726.2396 69751.5063 56519.6154 58809.8187 60527.0030 61440.8896 43065.8645 62472.5817 147980.4492 146123.7776 138251.7412 125213.6850 149131.8956 132433.7727 114374.8756 122345.3919 115808.4439 129415.7980 127006.9281 104460.6671 134410.8607 123390.2070 146746.3415 121212.9011 151084.3414 190672.1738 164561.9521 170438.1953 148925.4083 152216.5121 128730.4131 116964.4973 5-Hydroxylysine 5-Hydroxylysine 1878.4058 1227.6993 3257.4793 5519.6421 1773.8986 4212.9042 2426.1957 587.2570 7236.2277 4762.6346 4500.4303 2474.1192 3576.5434 3419.9432 367.5157 5883.1117 7251.4040 7883.7032 5487.6236 3303.2975 999.1668 9756.2219 6798.7334 11151.9317 6188.7391 499.4075 5143.6582 5094.6473 12915.9337 4397.1307 5365.1047 3611.7521 6314.2033 6382.8072 4987.4682 4041.0022 11702.3063 12113.4052 4910.7080 3088.2822 10640.0509 7986.5052 6527.1723 6410.7904 4732.6940 4865.3695 4981.8477 7872.1758 6624.1006 4252.4425 1460.3512 579.2688 3509.8760 6066.3537 13081.2522 8793.2144 4833.6059 6052.6073 2704.3289 3729.8513 522.5833 3062.6227 8663.5954 12478.5082 3322.6177 4005.8582 7913.2433 4914.4730 17880.4582 8771.9690 10306.6269 3380.6200 9908.7387 6206.4095 5563.9897 15101.4948 7763.2475 7404.7079 5865.1626 4225.7178 7104.5357 7491.7390 8840.2229 21206.1359 5149.9566 7101.7142 5652.2580 8068.2989 2824.1841 1952.4473 2529.0064 7566.6370 4892.9171 5217.2558 11159.2889 655.7562 5022.0756 1211.0335 6846.6650 1039.4045 7628.1867 7859.4961 11016.5606 2663.6102 5120.9493 4383.4564 9848.1159 6319.8984 6187.5802 4251.8397 5902.0916 7587.8652 7046.7448 6115.1813 4410.5365 5952.4212 2716.7040 5523.4351 10716.6239 1267.3243 3954.2424 819.2593 2177.5090 2170.5237 3806.9726 2326.6982 3159.9722 1815.8967 4629.7135 1326.1793 3362.0052 4173.4407 1745.4191 5-Hydroxytryptophan 5-Hydroxy-tryptophan 9283.5325 12339.2121 10174.2644 12302.7290 9939.3882 12402.7299 9360.7578 9032.0633 9484.5147 7399.8301 11934.5765 6528.2355 8081.6991 12168.4397 8911.1113 5862.6472 8219.1718 12092.5094 8718.8849 12687.0294 13346.2398 9500.1089 13890.3491 8064.4424 11270.6109 9052.9500 12819.1653 15474.5567 8096.0379 8123.6999 19280.6022 6803.9116 10580.2559 9550.8662 11120.6989 9179.6766 14384.4609 13600.8464 12171.8647 11998.5711 11927.8868 7611.4721 8171.8262 7683.4421 7157.4617 9834.3046 9679.8501 10290.1782 10441.7945 12932.5107 9855.7306 16773.3403 7881.0409 8943.0383 11380.1675 14941.1264 5248.5579 10279.9009 10867.7681 9570.9436 8494.3515 11166.0299 9842.3152 7314.1032 4594.4147 10157.0560 9574.4991 6316.8371 8899.3069 7290.4672 11484.7387 9418.9134 9946.9904 8271.9851 7958.4237 9477.4330 5043.2181 8410.7565 11644.1998 11375.9515 11625.6784 10513.2786 6113.7836 11298.0642 12054.7472 7239.1744 10991.6193 7491.1536 14942.7213 13816.7048 12150.4916 10975.9555 7498.4052 8595.8452 11216.6338 10380.9279 7213.3851 9434.5092 13419.9600 7103.8178 7809.3018 13533.4602 7370.1843 12865.3666 10286.1170 13859.9332 7829.8369 14001.1332 7365.7420 6290.8488 6877.3748 8455.8119 9569.4759 12299.0910 7054.9943 8296.7085 14317.4813 11949.9883 6974.6941 9020.6967 11565.9002 7393.4263 6734.0423 10773.3849 11110.6512 10100.4109 12875.7749 11753.5348 11751.4231 9589.7393 7673.3374 12101.5142 9136.8976 15122.1639 10138.5036 8205.9993 10248.3589 10242.1190 7893.7480 8769.9585 10075.3171 7291.4350 10782.3554 9990.4975 11073.2628 12827.0018 10568.5158 9516.6835 11080.0042 13041.3699 15264.6377 9545.0590 8907.8268 10742.4721 5911.5917 15526.7704 8276.3259 8335.6814 9657.1456 6360.0005 10357.1064 7275.3046 6371.6343 9874.7041 10881.4736 8136.8883 7280.8985 7967.6863 7931.3040 5734.1093 6344.7488 5738.3238 4093.6051 6263.4641 12137.0542 10977.6245 14299.0664 10555.4663 7169.9932 9077.4254 12120.1699 11375.7256 14433.2056 12194.9384 14081.1506 10683.4953 8782.7908 10924.3893 7729.4672 9923.7835 5106.6152 8570.2599 12040.1906 9178.1828 13189.3338 8894.1873 8992.1059 9931.4342 12443.9098 10844.9982 10886.7062 11863.9870 14566.3157 13158.0368 11388.5071 11288.3709 12538.8047 5-Methylcytosine_R1 5-Methylcytosine 195176.9601 235389.2880 106948.5287 233817.5469 148616.2110 225100.0855 154699.7080 239466.9609 109065.2412 132480.7797 152888.0388 171885.6062 61265.3063 140305.6589 159001.9786 253502.0343 110468.9084 150705.0713 224568.9948 247383.0740 215403.1606 207950.4398 363746.7170 184457.7073 166396.4654 391436.1482 174492.0714 275544.6107 293775.2378 182776.9655 181103.3020 138249.1102 128842.6402 184650.8840 102494.2709 184097.8499 90340.8641 170083.6134 146242.9974 341978.3980 221316.1529 161944.7408 79573.9012 214166.1198 113088.2752 213946.5236 174185.5568 157409.8700 162309.2587 113143.3602 152682.6628 317450.5880 137709.9820 186306.8229 220263.1680 214573.3983 334822.3532 192039.6477 131270.5340 207529.3623 147598.2676 171175.7388 167457.1160 124385.5714 127679.3775 197383.2933 229978.5102 166037.4724 120504.1421 296399.0096 82508.5669 283818.8632 283737.2043 92015.5482 339777.5353 219904.3814 151055.2147 181522.3746 348272.8264 193978.7713 143125.8064 203464.2768 79595.5475 104472.5744 242899.4755 386644.0403 279068.6442 135502.9138 183345.3931 441189.5976 258505.3850 186618.0168 229190.5808 125293.4584 353021.3648 134470.1449 266667.8158 137895.9858 189908.7314 125687.5306 242508.9437 139639.1713 108815.7453 238391.9602 128138.0989 221841.9486 174203.3491 407744.8015 167194.4164 243662.8215 161532.1927 155929.5357 124940.4352 134789.1507 330690.5938 158848.1714 167171.9314 201943.2056 88292.7821 258812.5692 214078.3317 178638.3168 136189.7459 185233.1239 253726.0816 317730.8530 108630.8700 135876.4600 134866.2804 226371.0059 229898.6636 120834.5503 132798.7964 123585.6522 121452.0229 109811.4450 173751.8354 247884.2827 143785.6321 193390.6782 188152.5492 117607.9837 154647.2452 194943.1533 208514.5026 104644.5330 216638.1547 185791.4816 147884.3157 210558.9993 271949.1316 154267.2758 166952.3597 186706.8085 143824.9967 159126.5871 177261.2853 276395.9960 255958.6417 250790.5233 162716.9921 155562.4855 149813.8258 270141.9732 196948.8262 202580.8436 201106.0864 131219.1575 73145.3516 112510.4553 99818.6299 98314.2081 98762.4926 132067.3171 184438.9891 101321.9276 121814.9243 103695.7631 95103.4457 121171.1703 72700.8525 325107.1998 259150.6246 271983.5097 188110.4351 263871.2223 244202.3705 183082.6027 170898.8009 172066.9100 183168.0190 184125.2883 161348.5439 163280.3093 246354.7514 176238.8609 188471.1318 129830.0441 137753.2586 199916.1592 210495.7538 248836.4847 158930.8186 158054.4841 146846.6200 174068.0973 209516.9193 222635.9564 195273.6626 189028.8628 183877.0897 180159.7278 173518.7184 152699.9403 5-Methylcytosine_R2 5-Methylcytosine 298689.3691 272213.4488 242810.7743 298642.1592 194248.0773 222777.3905 180814.0394 260743.8221 179728.4304 158482.4553 218798.7362 192216.0008 112039.9001 192874.4981 206716.3600 239609.6585 129936.6346 189609.4680 259404.7148 296164.6662 225843.3816 249385.8487 378418.0024 208047.7862 193700.5568 371174.1816 224264.7862 302474.9577 284446.7285 205550.3206 220502.9057 170642.4302 181791.7984 172080.8975 186728.5489 216817.8840 198761.2264 234958.6767 225349.8948 375875.9685 230692.1894 278849.5006 131273.6571 224735.6954 149695.6848 224685.8121 234695.6695 223769.0761 187515.0035 145244.5159 244122.3518 342492.2913 168936.9599 202166.2474 273946.2984 245323.2639 377261.1238 258298.5944 193832.2993 261121.0335 176375.3209 214615.1502 208861.4395 190126.4447 190633.3717 225527.6944 253236.1592 192878.8050 186681.9842 304610.7995 143174.9465 293253.9278 267215.9975 146058.1653 368234.2688 219760.8048 190002.1633 205513.6003 396455.5638 213844.4032 165539.3780 227318.6729 145864.4938 173330.8028 304203.8759 398281.7549 300774.9970 175537.5115 224841.7812 476510.7347 294934.0849 235553.6494 322594.7628 164272.0298 347305.9845 191916.6591 318617.8565 220708.3984 215022.8781 135149.6552 254046.8029 239552.2267 161890.8511 303412.0796 137108.5318 245305.3055 339770.5228 428276.4199 215541.8395 274731.8975 197975.6072 221383.4895 157359.2967 244663.4054 350204.5674 203598.2759 205109.5099 400019.3365 233044.8482 301498.9039 221325.1757 199629.3099 167263.8716 255692.9446 261778.6236 339220.8322 228477.3296 185016.5640 168575.0271 286794.9296 276943.5195 150720.9996 157778.1722 247951.8465 202540.2443 186881.0640 242514.6651 286409.7813 225024.6139 219963.9428 225684.1620 189580.1375 227695.8710 226872.0156 227011.7431 210318.0239 261047.1148 237686.5288 205836.5740 261596.7746 295014.6653 243387.4900 183061.7856 200446.3120 205675.3986 166923.6499 197739.5353 302773.2176 315045.7946 263824.3800 194290.2796 187626.0160 255600.3659 370000.5854 194176.6832 204736.2401 182737.9565 196146.8778 207692.8431 161008.8166 150580.5529 188294.0922 173347.5543 195512.5961 179287.5419 154281.0706 129779.0473 150216.6372 154451.4790 150186.9329 130358.2474 302824.6114 291650.9814 307784.4270 248242.2772 293859.9025 276368.3361 264453.3348 243330.5515 245897.0190 238308.0424 240192.5638 234155.2354 232257.2920 234383.4579 217707.6900 196896.9284 190844.6669 177344.7027 261714.6761 262787.8149 245285.7082 236189.1535 238850.9293 239996.3177 254862.7637 253612.6472 281841.3154 238594.0173 227179.4214 217576.5144 224711.2277 190552.6321 195250.5395 6-Hydroxynicotinate_R1 6-Hydroxynicotinic acid 2864.6505 27408.3389 31138.8792 26406.7420 38333.6800 25596.8206 37615.6357 6786.7230 12091.2598 43006.6061 18773.1763 5744.1457 8767.1984 27882.9686 28238.4271 14731.0428 43202.1416 46999.1401 37750.9768 32355.6497 63945.9254 13070.2499 25922.9190 26789.7179 12174.0900 45345.9663 4280.1120 2219.2369 28854.6389 21430.5774 54765.8495 27632.8783 32167.5300 50096.0049 9466.6142 2052.1406 71602.6438 2753.5878 19900.6336 6492.1353 40710.6102 6591.1715 21644.5051 10683.1906 10897.0362 17238.9470 29534.1740 24297.2255 28794.8969 26893.4994 23330.1315 59750.4167 4017.7669 27876.3604 33887.4880 25744.9324 8165.9587 111110.0167 27660.6846 14998.6533 115375.7280 91859.3511 16795.5939 27616.7043 69222.1671 10175.8570 19946.1787 9205.6811 7012.9273 33133.7888 48250.5435 36306.1293 16194.1494 5599.9933 69176.1243 35367.3531 12615.3041 46835.2660 49707.3076 25063.6000 4546.7255 31420.9607 28409.1999 3248.8988 26682.0736 11001.1972 29468.4438 54095.5307 37003.4326 47832.9014 142981.3511 24350.3577 17887.1631 2035.0360 2199.8161 10374.4328 29282.3317 20368.0116 9909.1056 32129.7674 17663.5448 8283.4842 49358.5912 126614.4822 50454.8464 58726.1176 19806.8309 9800.3901 2339.4529 14423.0801 1051.6180 65632.0155 19625.9842 23679.8469 4604.4315 4443.4634 69580.4631 10573.4505 27783.7428 2581.3178 7308.8943 2289.7535 13092.1535 42312.1313 19142.4039 20459.4183 5237.2795 21757.5229 7031.7691 113240.2998 10269.7501 4053.6056 17124.7549 18528.7807 73013.6918 3075.3170 23493.8626 12965.1140 23744.4296 44805.3319 87937.5477 45362.6598 104574.5150 151950.5454 82648.3733 62304.3763 70649.8414 79574.2385 80754.5460 88958.1885 80171.0543 56236.1588 107951.8479 102919.2165 85173.7314 89783.8859 33523.4263 36055.6059 25070.9443 15778.0224 4598.7210 17508.7888 92074.3718 91619.9311 60267.0731 3656.3564 22448.2185 12003.9478 17478.8677 46334.4036 30877.2585 20632.2949 24975.9967 31678.1227 34576.1006 8900.7185 14568.0734 26278.3730 25459.0243 16459.0687 19399.1253 6621.9640 7787.0764 32687.4373 19907.3760 16859.6221 30521.4852 18604.8127 18747.1823 6-Hydroxynicotinate_R2 6-Hydroxynicotinic acid 28575.1196 32019.2170 18710.1060 78443.9736 55276.0865 56636.1002 17935.1865 45051.0138 24575.8318 27920.3286 48805.8988 44286.8005 27708.3903 51219.3171 113605.2829 122099.6758 60975.7155 55692.2796 75552.2868 135249.7229 55389.0345 32787.5880 148964.4135 43304.0464 36927.4252 35530.0870 54758.3905 40508.0672 29394.2737 56475.7279 44841.5633 81965.3629 42018.3716 77399.2639 122699.6122 36802.4275 64402.2115 98420.0295 297664.5910 64509.2112 117820.8345 42753.8491 64802.1944 40558.5921 49464.3491 17041.6309 46880.9116 77910.2354 37266.7304 91853.6957 58017.5390 80859.9861 36571.0164 151341.3830 60701.9793 23614.3070 122560.3176 84480.9041 37249.8418 34326.9850 77769 29917.0288 55741.9797 46466.0746 28933.0251 68334.8557 70112.2048 56451.2472 53661.4161 25166.8980 66996.7244 72493.8345 42791.7502 50679.5912 115490.5286 72154.1914 48907.2766 45564.2764 39704.7464 37926.6162 108204.5361 51922.3933 53861.0555 152447.6369 38130.3815 96706.1083 136063.4407 47453.7775 32284.1595 36246.4332 15885.3813 42804.4096 69025.8762 25249.0272 61370.8954 229285.7577 109724.4920 23286.4029 19987.4852 86345.8343 61289.0343 70678.5839 30900.6883 60064.9854 100059.3643 33109.5260 68137.1522 35307.4751 22470.3653 54555.4826 53533.0519 48264.1306 46602.4148 51102.8764 66671.8956 38395.6171 68323.0622 24060.4720 46400.0408 156222.4388 28543.4722 38598.2098 40853.0503 42776.0161 25281.1343 73737.8728 21084.7912 48133.5714 25965.6553 36293.5047 114090.1060 131852.4902 118990.0652 168090.0719 99499.5729 94911.5348 136994.6032 87881.9163 139784.2099 143675.8992 129482.3158 93605.1606 98002.7472 138031.0564 119197.1001 106849.6019 119136.7066 137297.2717 165455.6038 115946.0715 134987.8231 103293.9824 133478.0549 132066.1344 96206.1622 63396.3761 47508.9364 50784.4578 49244.3196 60071.8162 48566.9352 72182.5690 70562.9671 39569.0408 44357.7567 49694.7491 48599.5176 51162.9415 39875.5074 53611.9987 41286.6122 42228.3934 49072.9868 49523.3999 48249.9353 39386.5109 38523.7285 33374.5753 40335.3621 Acetaminophen Acetaminophen 55790.3784 188252.3073 505565.5602 9371.5843 127088.9941 731932.1021 768575.9157 721928.6967 764605.3138 660542.2079 629017.9188 670326.6160 675299.6543 652115.3432 653083.8473 645589.6803 657157.9869 808020.5238 730239.2982 612911.7141 560830.8381 686416.3997 737046.2169 741668.4849 663462.4430 695559.6696 613026.4307 667510.5141 662695.3496 692782.6978 9181.5773 9444.7142 7839.2448 5253.0266 6120.5116 10939.5637 11726.8421 13330.6788 13233.9164 9375.0431 15173.3667 9733.9985 8718.0697 9126.5253 10429.8729 8063.1463 Adenine_R1 Adenine 128652.2433 388810.4146 129400.1790 295766.6339 170142.1290 231447.9154 165776.0923 246250.0741 89434.9865 165363.9745 206112.8282 126405.5893 101827.3788 205217.2182 242580.9522 287532.0471 98110.6270 179944.0716 191841.2325 284962.0518 233749.8420 265134.5196 172898.0008 139515.0106 174326.7333 276092.6811 159902.5782 265337.1544 240028.3596 171681.5703 178143.1308 171368.7961 99598.7767 135767.3567 88105.6784 99206.0837 134083.6767 193930.9350 92503.1510 310157.9681 315797.2866 118405.2629 175711.1563 147409.0902 120956.1418 305011.8370 154352.5130 186527.9347 157505.4149 154977.0195 136542.6953 340201.4456 147084.8628 125546.5486 345009.8303 278036.7327 252455.7762 147943.1438 131715.4276 159114.3522 228505.9231 160869.9246 179889.9163 117792.0248 179360.2349 160291.9220 236310.7288 174150.9247 187197.5985 249558.9749 164931.3575 304268.6512 220120.9979 109777.3875 259545.3749 205224.2613 124164.0435 95238.7186 193116.1564 152643.4232 141732.8181 120334.9363 135464.1588 171402.2830 108301.5969 275585.1399 226217.8872 193846.9925 145369.5675 237677.0106 160642.4034 317160.9138 189178.8833 92220.3897 217254.9927 159721.2810 130753.5986 147960.7804 149643.1608 137819.7054 260836.0661 167578.7560 110411.6985 232940.2566 118037.9374 272395.3825 236505.9576 353752.6664 166767.5569 183956.1154 191928.4754 176118.2458 120446.5617 83165.4126 263124.3760 160136.0689 171607.7226 139898.8165 230937.7309 162079.4859 181985.3608 166552.4421 232526.5739 195249.5278 233045.3013 295696.4582 225649.3856 121468.7881 111704.6589 169117.3943 191033.1149 90247.1376 248894.5644 170242.6263 132081.6654 178460.0632 99858.7366 206261.4038 265749.3659 142588.2667 185394.2250 133369.2464 192901.3213 247743.5861 163920.6477 217767.0299 145687.2584 188797.7191 195375.9666 200541.5778 113010.8888 228669.0898 205423.7311 136988.0218 224992.7175 117467.5646 145206.9624 335471.9694 203241.3225 296727.3852 143271.9454 156918.0133 199985.4403 140800.3550 190208.6799 101145.0997 102503.6826 95834.6333 114801.6017 79834.4238 71059.5387 81760.0647 95138.5207 68356.5045 73114.5797 63477.8053 71817.3337 84704.7798 85377.0969 64261.2423 54063.6829 291111.2715 281674.0108 298545.3088 217596.9472 218460.2667 211862.8187 184640.2237 202574.6497 182988.2629 266308.0796 252569.8317 252894.6459 221950.1265 238331.7626 221997.5246 183651.3258 192802.0097 182835.8932 201750.3063 207276.7055 168594.0984 185769.7241 163724.3589 177575.3231 172107.6560 151489.6616 178434.0701 212917.3358 179584.4555 178445.5738 180569.0580 147793.7812 142657.1669 Adenine_R2 Adenine 143157.0842 411723.7348 143007.3374 310655.0320 194541.7657 252587.2430 168273.3680 261205.5356 92804.3054 182777.4118 205669.0113 151308.1148 140465.7192 229670.7409 257800.9005 308905.9424 108781.2438 184285.0711 207284.2802 301375.6640 263687.0682 278131.5239 200343.8581 165044.3125 192491.7881 276594.3960 169575.8069 278671.3105 270163.1922 189570.3671 199591.4777 199941.5618 118815.2647 157016.6151 119077.1481 121232.4139 147404.8058 209861.7038 111105.5854 337129.7044 335544.8134 136220.3780 189907.2534 170898.2038 147183.7167 358298.2960 173096.3236 205216.6983 186023.3618 170209.4415 155495.5295 355986.2905 148994.9671 147917.8602 368507.3014 293380.7538 274740.6215 169579.5448 158768.6471 174385.5491 251965.9229 178707.5470 203375.4254 137064.1805 208123.7963 178394.5840 242381.0522 203583.7877 210503.9253 263558.2408 185915.6978 333762.6641 233262.9532 122167.1248 277676.9407 232962.2502 138443.0541 113699.7165 215629.5625 168860.3107 160131.5887 137843.8476 145691.0637 197193.0899 141319.8007 268614.2754 249439.1296 211022.4437 167618.4400 254727.4086 171742.3034 339649.8504 206499.2788 112741.9922 235204.5997 181351.0282 146366.5817 166497.8349 170212.9296 153765.3386 268611.2964 187592.8735 133258.8841 245473.1702 130336.9876 300162.4891 270933.9717 350935.5769 184988.3908 205671.1234 208342.9550 191881.9954 123415.4574 162728.7336 292910.7006 181001.0485 191469.9601 166456.6911 252472.2173 175022.6289 204401.6455 181293.4748 248806.9463 210240.1922 252370.9763 312011.5097 243938.6344 142599.9924 126648.2140 195910.6647 209448.5762 91969.1097 264864.2643 169923.1924 130394.6456 191031.4928 145208.3732 222949.8010 282430.2136 159715.0948 183712.2428 159911.5809 213930.7578 270640.0414 186475.4721 252057.6427 171253.4270 216220.3873 211438.7933 217906.7109 114519.3692 247673.0855 224487.2537 154199.2310 243010.1487 122672.7699 171404.6570 347652.8865 228338.0689 308588.4351 161301.1833 156923.5758 211620.8375 159396.4883 191955.4301 132418.6947 129189.0053 112541.4823 115883.3109 100076.7104 92575.2454 99664.1598 96675.7869 83521.4341 61823.7133 66028.7018 85568.5327 83420.4207 79472.8352 62270.2241 335241.1628 334108.7431 335218.1327 240200.4452 248965.0050 238427.2396 204757.9020 203090.4577 210129.4002 288839.4369 279239.5077 250644.2929 245141.2952 261852.1951 236702.3200 206511.2186 194037.5144 205354.0974 217264.4327 220524.1916 185029.1960 184071.6766 174658.0067 187512.8042 170157.0026 166825.8772 176899.5521 209682.8398 176975.9636 193010.6909 191562.4260 157503.8638 155053.8673 Adenosine 2^_3^-Cyclic Phosphate 2',3' cyclic AMP 4103.3315 68492.9512 8329.8795 8220.1464 7482.4015 7846.2647 6869.4738 6399.7539 6703.5107 6915.8590 6887.6437 5816.5643 5208.4529 6174.9044 7724.0544 5987.6521 6392.4967 5521.2535 Adenosine_R1 Adenosine 753485.4630 1863415.0380 708584.3233 1611639.9200 825083.7752 1365889.7020 899819.2758 1377121.6080 351927.3466 904064.1472 1128048.2580 678412.6511 628918.5662 1258021.1210 1178004.7360 1319947.8550 409036.5186 945426.5075 896200.8660 1597120.1230 1087218.3440 1299363.3340 900697.5947 713007.9943 816687.0391 1490114.0390 808137.8272 1567474.3940 1149461.3930 1151132.8900 956787.7117 812743.2867 622412.6847 686691.7871 511831.0221 513191.1490 736564.2845 1027283.3200 505189.0784 1579117.3770 1527062.2670 695848.0228 1001798.7040 743669.2986 626127.5201 1644011.2500 889669.1066 1042897.7480 786537.7970 841212.3504 815128.6337 1870665.1350 778589.6356 593031.1954 1707294.8490 1490571.0310 1457906.3880 836727.0989 681960.5392 848974.8858 1229635.5610 887760.8899 1016389.2300 568116.2277 875227.5114 899180.9225 1079454.2260 901766.8064 933723.2727 1392216.9050 919804.0945 1490104.9300 1208775.7080 633206.0940 1286697.9530 990922.2669 678339.4721 532829.4334 1137353.5560 713992.8446 756415.9459 665283.7426 723389.0094 896782.4982 665153.9383 1509521.4520 1218969.2910 1091554.6080 709148.7278 1337265.2570 909080.7717 1646061.0450 1063232.3300 554943.1822 1222788.6250 812023.6856 739691.3744 624114.4054 741976.6522 830793.4312 1546445.9670 902466.9880 536419.4875 1455020.2520 689862.3951 1310211.7620 1191170.9490 1948717.9990 943858.4876 997303.1045 1037632.1580 868159.6521 655572.2350 439022.6581 1226075.9400 966521.8263 915189.3092 736858.9705 1322666.6330 899244.7784 840490.2507 854198.7577 1168970.3220 1175071.4680 1138191.1950 1738792.5160 1274780.9690 673378.1245 632695.7494 943078.0242 1088233.6870 474479.8645 1282558.8660 876575.8769 678220.1042 934228.7817 560139.5851 1165422.5140 1423923.4000 739612.4868 990901.2315 731605.5000 917884.1507 1349450.1330 855971.3408 1053321.4780 731745.8209 1129505.7530 1081208.9330 1168604.3460 560723.3153 1207395.2640 1115159.0610 836208.0110 1075140.5210 683263.1888 643838.8057 1794273.8870 1005472.7400 1492327.1310 697416.1790 846352.3997 1033018.5020 798166.0742 900427.8023 530150.3569 539104.0123 428490.9448 495072.5989 395408.2498 379529.2554 431544.0281 418183.9590 391766.7156 358190.1943 340143.5339 345075.1810 393245.3073 374234.6387 369956.7151 322285.3320 1405328.5650 1396550.0750 1401796.7860 1089176.2640 1127872.9990 1098493.0300 1033498.4690 1017153.8770 1023841.7890 1225858.2620 1189455.2190 1177815.3720 1049538.2200 1174203.1680 1037135.1830 914296.9588 839579.0667 893575.8026 1049079.8170 1046987.9520 954046.4660 956059.9585 892922.2836 934580.1691 875149.3490 861233.0430 917028.3501 1013319.4920 907995.9279 951605.4189 982822.3642 827406.1733 856200.8346 Adenosine_R2 Adenosine 707186.1854 1777553.2240 664903.2904 1526396.8330 781234.8911 1294319.1140 831110.5739 1310427.0350 317652.5226 850990.5346 1075231.0100 643377.7578 591890.8397 1184825.2380 1108656.6320 1250688.7480 367497.5409 892606.4038 852370.1972 1516109.4340 1011467.5160 1251800.5140 856690.9725 694665.9205 780402.0218 1427544.0750 768362.8816 1499826.8680 1121420.6840 1077486.1460 918532.4781 765090.5157 581743.9391 639920.5010 469917.7497 469877.4412 695898.3973 953987.8607 471222.3777 1514609.5160 1457113.2480 649052.2457 950388.2914 701243.9200 594892.5138 1555385.6670 831477.2293 997385.1974 738352.8428 794223.9542 768204.4714 1783527.1940 718023.6868 560597.0646 1643709.8340 1406103.2610 1395929.9260 774762.8741 652989.4519 802592.4934 1169316.6490 835214.5609 953009.0301 541166.4264 835807.5238 843892.4827 1039605.3870 856729.7972 889434.4369 1333954.6770 874386.5541 1432784.4020 1142561.1360 589641.5911 1222290.4260 940986.1061 626895.9952 521407.2848 1083245.0120 671982.1892 714433.8337 620951.8419 690136.5538 848375.4593 621089.2860 1438432.1310 1177436.3720 1035255.1620 659529.4279 1266278.1170 866631.1648 1572089.7070 987479.5730 517711.9097 1137746.7650 781040.0641 717717.6134 578357.7769 695792.7744 796757.4160 1476469.3390 851200.6525 497883.6347 1393370.0540 648785.0323 1249170.5640 1139379.5390 1862430.9850 887928.2961 932013.3466 989504.9098 814967.1952 617003.1864 410535.2617 1177411.2410 915882.6578 860889.4720 681023.3696 1253191.3900 859468.4430 805421.0388 804010.1746 1116214.8620 1103680.2940 1085795.8960 1648367.0770 1202371.0650 622344.9183 588923.6271 876196.6314 1012042.4680 443457.6778 1213017.8350 831441.2771 627802.5738 906850.4096 525605.1411 1106955.9500 1355351.1760 697274.7585 922134.0745 699949.4049 865090.5049 1266011.6340 792987.1900 1001436.8050 688633.2220 1066343.2780 1019533.3060 1087079.1230 498116.4898 1158589.8470 1066639.8160 779779.4852 1013994.8890 627133.8977 605249.8233 1735146.3670 957566.5459 1430236.8720 660151.2724 795891.7898 988249.4968 744324.1641 867792.6003 450694.6550 459777.7246 403299.7314 428143.7444 329638.5789 314750.3706 376564.7398 366714.2839 335542.0758 310927.9297 287593.5017 318021.8985 343765.1665 330234.9958 323317.6038 284674.7058 1761.6784 6174.2361 5247.0272 5120.8484 3132.2957 1327179.8300 1321335.7160 1319745.2820 1015779.6300 1053096.4080 1032594.6770 966369.6454 944954.1706 967610.1253 1169775.8660 1128742.3780 1117824.2810 1004307.4450 1103322.6940 988965.1794 866722.6871 797735.9998 837492.4675 984271.7940 989301.3748 896904.8076 898738.2109 840796.6268 880888.7944 812328.1085 815655.8415 853880.7983 948326.4326 854533.5953 889807.6722 921708.5335 777916.3036 805864.9331 Adrenaline(Epinephrine)_R1 18945.3232 13973.6648 22053.9207 29081.6759 11589.6339 12869.5884 26657.4505 14363.9178 17274.8518 28198.5283 16061.0053 14258.7665 9058.1235 9552.0818 16725.9240 19252.0860 12294.2859 25491.8934 26841.5817 14041.0324 22111.6050 29458.1741 27770.8365 8444.7278 14898.1234 26039.4060 14446.8746 19598.2439 19313.2727 12502.2095 20855.7422 16425.7001 20220.4921 23441.8989 23643.0662 9861.2795 14330.8019 16003.7534 17322.2302 15487.1150 16431.6779 18241.5525 19606.9834 23184.1017 21145.6323 30291.4123 16284.9273 7755.0033 17107.7748 13127.4994 16600.0403 20660.2231 16064.4857 11630.4606 8332.1026 16108.3651 18411.8697 11421.2454 17722.7400 12364.6449 10538.4265 19205.3668 17885.3366 11822.7300 13649.5563 9174.4710 13619.4149 17590.5560 13661.9200 13908.7127 13173.3067 15858.9228 9748.8420 16582.7561 11591.5076 13409.6732 12825.6508 17269.5295 14328.9971 15528.8482 10808.9632 13007.4033 23029.0906 21507.3201 12007.7479 27903.3341 16630.4519 12324.1789 23537.4154 16263.5792 10546.5507 8555.3897 11697.7576 11840.3122 30821.4869 16727.9143 15676.1830 17850.5298 14967.0849 9493.0857 10538.6475 23052.6751 13561.7095 21603.2487 14267.8589 16081.1827 17772.7926 23988.1382 7453.4882 18009.7441 8553.6018 19801.7911 9069.6507 10369.3184 11557.8285 19790.7095 15599.1896 11377.1846 22296.5695 10624.1939 15714.5418 23599.6751 13608.6382 18257.2512 16758.0440 23124.7609 14296.6688 19600.6642 24312.3789 13746.5753 9856.6389 9552.9475 12541.4004 12084.4256 15970.7771 12206.3969 11967.9271 14482.3647 14114.5719 10253.4904 9743.5079 12738.7079 21767.6852 8830.8226 19158.3694 16282.3996 24093.8098 27308.5753 11455.8460 10092.0874 14442.9488 16132.2000 13746.8541 9845.3727 19641.1641 10732.7620 18735.4137 15146.8766 35937.7240 14285.8822 13205.4500 18587.3971 20843.0347 8139.1230 23643.4060 16990.2444 24958.1556 22864.6966 22134.7801 17729.8687 16125.0311 14120.0220 13695.4667 13432.6629 13668.7746 14252.3049 14956.0493 18505.0028 15847.2488 14153.8232 12767.4717 17311.8211 17289.2129 3962.5673 17714.7449 13018.0012 10315.7843 13983.7651 15502.1326 14828.4503 16640.7896 13638.2737 16389.5999 14839.1232 14876.1882 12383.6722 19767.3133 22999.1052 22082.5171 12908.4272 13439.2432 13363.2990 15069.9975 12246.0756 14639.4131 21450.2427 25359.3732 25288.0543 11646.1995 14986.0320 16348.4937 15447.1224 12651.9230 13912.6851 Adrenaline(Epinephrine)_R2 14640.1859 10706.1094 18798.7927 23721.9956 6540.5991 11560.7833 24943.4241 11230.1186 16838.3524 12449.0654 14046.3709 10669.8861 14160.5953 16671.5254 9826.6890 25549.3963 24289.2935 12763.2223 19809.0724 30373.4781 25901.4767 12900.5538 26093.8399 9052.9953 16121.6566 16820.8361 11196.3166 19172.0154 13615.6651 17361.4109 22482.4369 21829.9094 7109.4563 12210.4308 13825.3573 12893.7291 16307.5295 16405 17165.1996 25392.6104 19951.3021 28625.9975 14694.6951 16570.2145 12025.5125 15111.5872 13488.3883 8305.9645 14512.6023 14500.5498 16208.2180 10559.4952 16591.8797 14092.4702 10721.5975 14088.2152 12168.2841 15905.9355 12110.3942 10191.9104 14007.1838 7266.9130 13244.3019 11048.5464 11441.7390 9852.4776 15253.6540 11072.8937 16254.8750 8238.9652 9294.7478 19039.9041 18849.5408 24331.8335 15078.3895 20264.4092 14106.1849 8471.6533 8887.1695 10151.3658 29873.1974 19407.9637 7681.7553 9796.7450 11370.2052 18795.6459 11816.8103 16207.5487 16059.2377 20453.1423 13658.7591 494.5621 19503.9149 7305.7059 8786.3755 18448.1720 12275.9462 9520.8052 19085.1480 8812.9359 12826.1740 24432.0058 11760.6390 16627.2092 14716.9498 22144.9288 16014.5903 17653.4768 24014.9933 9029.8627 9690.0618 6212.3152 3726.1649 9169.9336 13941.7195 9896.0569 13043.9848 7109.7741 20100.7982 7838.1939 16953.1583 16761.6036 19653.0056 26255.0882 8544.7022 9077.7245 12045.5193 5715.3401 18703.3737 8440.3754 16015.5242 14248.3579 32872.5460 13980.8970 10075.4227 15240.3778 18928.6506 5341.8212 23006.5991 22401.2082 26862.2392 20496.8239 18832.9021 18256.3376 15796.4738 16168.0150 15521.4796 14615.4014 14936.9887 20112.0735 23874.3017 16987.5140 18151.3174 12100.2635 15799.6134 15572.9090 16447.3102 12224.6864 10761.5665 11921.5633 13303.8832 12372.0284 14657.2949 17855.4399 12983.5302 17342.7068 14953.8436 13550.1593 13490.8948 24992.8589 20214.8094 21598.9713 12566.7360 13388.6501 12300.2282 12048.4259 10834.8583 13927.1564 24322.2928 26379.9118 27011.6011 13717.4468 14575.8770 15096.6226 15271.2991 11379.7177 11641.9026 Alanine / D-Alanine 14983.1362 25538.5941 10082.9779 24036.0304 13683.0508 12768.4898 11326.2242 12664.4592 23574.0206 12712.3029 24625.2841 19762.5813 17037.1592 14024.6612 17537.1273 21964.4997 13894.6024 15665.5690 23414.3152 21498.5109 15884.7319 14314.6227 38309.2613 17235.8760 21124.0336 17751.2994 18806.9185 20585.5386 15973.8009 17340.7518 14440.7217 16625.0600 7149.8002 14608.2311 14478.3857 11989.7601 12688.6836 16445.1766 13875.1473 14192.3764 16638.8260 17036.4991 16765.1514 18565.5013 27597.6320 9471.0704 14447.4821 15154.8044 18060.7555 14275.3003 18240.7600 20210.6899 11632.6998 8901.8783 13623.3651 13433.4190 18867.9637 8201.9341 11984.4637 15517.0980 8865.5325 21443.7877 12145.7675 17861.4314 9627.7879 9881.0018 27065.2556 11719.1576 8908.0768 9876.9990 11931.4450 17919.6679 18059.8326 7944.8478 29514.7117 14052.3096 19386.6282 16693.7079 18521.3600 18125.7966 16034.7007 15765.3802 16959.6926 19436.2055 20077.1066 21343.6235 15306.6639 9292.2915 7610.2740 30897.9669 18511.3029 12789.2381 13255.2732 22458.3464 22007.2031 17313.1137 20246.8942 12694.9207 22804.8909 25362.9858 10440.3251 17728.1446 8826.0619 14337.7520 8753.9895 19672.2135 31174.1450 30451.1004 15786.0847 20939.8923 16873.5733 15827.1266 19076.0983 11889.6410 13772.1495 22917.3142 23517.1493 15484.2922 16113.7540 17103.8698 9871.3475 20482.7116 13864.5537 18478.5079 17790.3441 18204.1625 14516.6503 12421.1829 10848.1079 20248.0171 12794.8971 14303.6697 7668.3958 10437.6459 18373.0282 16259.0939 16940.7267 13249.5298 18915.5967 13398.5410 10096.0357 15939.5210 11289.4492 8618.3793 14924.8677 20011.1634 9514.8459 17550.4740 22115.8972 5729.2994 17488.3586 21005.8346 13896.8228 12906.8705 15376.0268 13067.6351 15322.8384 16059.8197 15184.2467 18580.8921 14712.6058 19416.6273 10047.0188 22756.4867 21688.7892 12511.2187 13907.1825 12363.4363 12354.2053 14195.4149 13290.0151 10063.7048 10419.0772 14873.3385 14564.5141 10720.9881 12483.5521 13702.0394 11211.8850 9833.4823 12811.3288 14984.7496 14949.6875 14322.0388 15373.7241 14516.1446 12723.7597 13537.2339 13043.1882 15273.9668 15340.4184 16954.2239 13308.9852 13981.4914 13320.2305 12650.5834 11727.5276 12729.5506 13432.9235 13956.0398 15186.8852 16912.6323 13682.5539 12945.9266 12752.6956 12151.2310 14960.9575 12351.7804 13781.1347 13540.2403 14266.8360 13882.5398 14369.0360 14725.0060 Allantoin_R1 Allantoin 55000.9997 28161.3086 93898.4691 57294.0555 41800.0480 54473.3352 35433.7012 243080.4247 47809.6327 123855.0810 189166.0724 168289.3941 45382.9651 68434.0572 41267.6335 16507.2320 17108.3362 56448.6926 196625.4607 39344.2199 47431.4806 47738.4839 232802.0160 45202.3963 52752.1745 98735.7159 53090.2626 22516.1986 104628.8204 30585.5192 39757.9861 40658.5042 52361.1542 37021.2869 49454.4794 14823.2762 40741.9633 93084.2168 46430.4954 32391.4325 97236.9334 78118.9555 43183.6809 60275.3026 177035.9481 46741.2733 32707.7822 78266.0704 55779.1309 36533.4232 50515.0610 22863.0491 41387.6387 22236.3982 43321.0532 38398.6950 111604.3773 22235.6535 55236.0264 46216.4461 11601.4338 44983.9575 22478.3156 32642.3907 42606.1555 44226.4866 48447.6100 49323.7487 53605.5514 47029.1562 25048.3260 74715.8007 35206.8611 30125.7766 49248.4610 43088.6877 49184.6183 132212.1829 101300.6248 64385.6694 24332.6510 41831.7986 56916.8064 112044.3191 67287.8152 98494.9824 54134.7791 53434.0140 39526.9862 58138.2482 43365.8605 40314.6582 49303.6834 19642.2712 81711.2263 40996.1179 50262.7326 55420.5766 111409.0501 61395.1550 39355.8915 46912.3878 24898.7883 42485.5919 32430.6734 44670.3719 31830.4872 252217.4654 32346.8264 55110.3598 33506.4760 136605.6076 95414.8240 83408.3707 99918.0833 205142.5817 54092.3820 16295.5455 94440.6445 31353.2550 23488.7921 106398.7690 42375.5120 60059.5327 36172.6279 126417.2600 88142.8250 41795.2033 58546.4329 35768.2053 12751.9213 36284.4940 59106.9678 39058.8685 51744.5837 73544.2392 127166.6623 56386.7532 96479.7268 55802.2453 51416.4880 41423.3461 15848.7604 17996.5496 63246.1127 167943.4851 41369.6239 52999.3480 63161.7935 14081.7722 34358.7466 84132.8641 43061.1908 44039.3442 53199.3063 55079.6316 88771.0269 31403.0615 172017.4934 50784.5074 21834.9791 57664.2081 53423.1035 50908.5209 71272.3082 42593.2910 45624.1197 41062.2879 42635.2269 36563.0135 37717.9336 36016.1229 41383.4337 39656.9027 40570.0895 41830.6735 40659.0484 42432.5959 33821.9211 39139.1289 35603.2649 45630.4051 47940.5645 44252.8015 41769.6014 41495.2248 37413.9565 47441.8819 45895.4090 42353.3220 46235.1268 42150.1173 46766.2331 44386.5521 44982.5603 41617.7453 41357.0117 40502.3843 41447.2760 45371.7508 49782.3543 47725.5579 44714.2604 43130.2903 47790.6632 45585.4208 51407.6356 52202.5533 47891.3480 47346.1803 49513.4291 44449.0429 48488.8245 50290.5173 Allantoin_R2 Allantoin 41123.4713 23692.1476 66729.6043 47272.4173 27560.4947 42156.3880 30069.1003 226024.6431 35473.2132 115761.1240 170343.6061 158738.2349 32606.6082 65562.1651 34904.4760 11642.9213 11018.9285 40919.9185 185263.4208 31009.0130 36737.7041 37010.9242 225975.1362 39795.5456 42798.8391 94917.4989 37421.6467 16324.3801 98809.2964 23356.4499 22947.4576 36732.4990 31356.9414 25914.1978 30743.1475 10486.8850 26960.9230 71711.9180 34148.2161 29884.5037 90988.3680 67598.5071 30605.9920 56699.8814 158186.5990 32327.2628 24499.3862 48097.8806 48492.9796 25300.2124 36484.0080 16312.1775 31305.1617 16798.7741 31254.5653 23257.6373 104924.5708 17457.8854 42173.0102 34507.6629 7847.3413 34929.0791 17035.5045 22090.7202 27390.9286 26757.0313 44370.8771 31878.9483 44683.9169 42767.5231 14688.1673 67517.9562 27777.7651 19882.4935 46357.5119 38708.6017 36526.8562 115412.1768 95713.1775 43618.8943 18510.7579 35009.5519 32349.0256 80343.0477 47584.6343 92865.1139 47768.0708 38693.3774 25918.8353 50643.0360 32566.6417 27854.1344 38481.9232 12215.6618 76350.5196 28894.5696 37043.3622 40571.3374 105069.2000 48327.3927 29741.9577 38844.9873 17399.8441 37938.5982 20967.1182 38868.7845 24919.7429 246315.1231 22491.7195 42294.0477 22368.9660 121044.5849 82910.4829 51411.0355 94594.9518 184569.5877 45613.7025 14152.3001 67961.6384 23839.6622 16896.4756 96688.5322 27661.1069 52823.8603 33481.8831 113581.0736 61909.4482 28754.2323 45892.5325 24253.7461 6348.9084 29845.7896 37348.3944 24837.9902 35391.2874 53664.6720 78876.2085 49758.6754 75370.6268 34298.3901 41117.1978 28552.3207 11537.1308 13130.3976 48713.4951 157032.5020 30426.0995 45784.7513 49639.4302 8407.7915 32902.1171 55928.8801 29316.2815 26542.6032 45062.4005 50916.3866 72803.4332 20989.0896 163345.2273 41793.3592 15908.0802 48574.4693 38195.5143 47973.7437 55546.4671 41422.6969 43564.7366 40069.0567 39126.5303 36341.0487 35739.6617 34782.8227 36779.8049 35222.2283 36825.3355 42469.8268 40991.0661 39267.1677 35303.3607 35982.2858 36629.9916 44185.2385 44821.9554 40622.6065 35142.0155 36050.6336 32873.4556 42062.0214 38908.4058 38739.8251 40137.5005 34602.5670 38844.4552 37103.6510 36813.3202 33404.9510 34900.8158 32819.7065 33610.9389 35810.3012 38198.3064 36824.7272 34648.2973 34620.7634 37729.8693 34554.8203 41607.2533 42111.6273 38228.2165 36738.7053 39221.3679 35200.7230 38516.8680 38269.9790 Aminoadipate Aminoadipic acid 175877.5251 365963.8836 174181.0471 48367.4154 208012.9964 157719.0896 159593.2090 126632.1712 91812.4425 70495.4773 252234.3284 572216.8749 168171.7678 290380.1069 108092.9717 191404.9512 134299.9767 155741.8948 270112.4806 120200.5620 72031.1093 121756.0055 195850.5688 56094.2061 252406.2759 75632.8866 281705.2081 120925.6846 173636.6363 174114.8769 166341.8596 100880.8606 93392.6227 122679.7613 78750.6922 203222.4290 106725.9095 290830.1941 59094.1255 141266.5953 294883.3202 245886.4162 55922.5524 188868.2528 129808.4429 349208.2701 86744.0053 65535.1600 167893.9442 149164.3690 66356.0212 148069.7442 115751.4211 127035.4596 104981.7989 354820.8389 192997.3293 142550.4047 85384.3518 122861.5590 178213.6692 265414.3479 189689.1744 108476.0699 264073.4305 336828.3446 220504.0409 84563.2885 89835.3818 167300.0398 169674.4723 156414.6418 95095.0591 137387.4779 354634.0269 212072.7716 167269.4038 121267.6466 237751.5064 167659.9781 980629.0211 109383.3118 127105.8822 308516.6264 160514.1182 106369.4804 326426.5823 91682.6061 53494.8808 155622.8523 76231.5481 95524.9094 195177.6075 182555.5813 220077.3238 87007.2614 243288.2145 198027.8809 293187.2910 180812.8561 107693.0212 145954.8423 94244.4865 394825.0761 137575.1588 291395.9014 82884.7770 137066.3536 110697.9944 104825.4164 396490.0704 209472.0735 186238.6680 88966.3626 284388.1279 272236.7222 262157.9912 147736.2012 73679.4492 129574.4072 98773.4944 298842.1193 497201.7725 111593.0057 342335.0009 82269.6878 76332.0138 105903.8245 133527.1955 120136.2460 156303.5576 159822.1146 126818.9092 267499.2079 166876.9272 112309.5401 87863.4269 313083.3068 185547.6743 199941.1242 168140.3613 94770.5185 71759.9991 104710.0340 241415.7332 181147.0302 51203.2817 111644.7273 359921.6944 139931.9264 82494.3867 94793.2238 519851.0966 337721.0053 63666.4318 229349.1565 152345.3559 510740.7577 207859.4448 130019.8896 255729.7830 178555.1965 194864.3746 332543.0934 105164.3044 195043.7982 211867.8516 197766.9261 189467.8645 168787.9933 168495.5987 155860.4315 157155.9498 136395.7490 127057.5786 120380.8504 118960.0675 214305.5731 196422.3562 176695.2277 161856.8556 253636.5007 251218.8870 266975.5406 223469.9467 222373.9383 217005.4322 230097.9107 247044.8820 246812.6291 110904.4185 114332.4112 145861.3808 90333.7012 135540.2725 141204.8813 135478.3585 121754.0069 116595.5919 116709.1565 122561.1498 136364.1795 124062.9382 83014.7193 126640.3298 113237.8278 140796.6186 156661.3982 154516.6397 149164.7251 163749.9022 158216.6567 156238.9533 142091.1339 Aminocaproate_R1 Aminocaproic acid 938199.0238 1940991.7480 999744.5556 1272089.2080 615437.5740 698280.7602 676629.8574 449204.6587 507695.5459 491868.5080 1207405.8650 1037786.9030 889372.4250 1231507.4710 698616.7439 964186.5124 787489.9953 1055788.2000 911899.2310 610013.0294 391305.5937 1047131.4050 2364878.7090 696213.0938 922533.7360 1069510.9180 835247.4408 1047710.4110 562598.8740 1163796.7750 683536.3246 769324.7693 311441.8188 699134.1811 745684.0353 797138.8370 761170.1609 1125344.1990 778980.0632 688879.1001 558570.7215 1048582.6990 1690616.6050 420970.5485 1016607.0090 587260.9263 510533.6450 1471131.6710 670919.3386 366964.3661 863977.0798 1128775.8400 554518.1641 457916.3933 894052.6940 819921.7095 656640.2617 889135.9621 619336.0251 639170.2400 741465.9316 1270487.5820 500144.7861 437849.4228 685538.3247 548647.3394 1131764.8650 627872.5258 549115.1150 389014.9110 434370.4841 618658.8042 749148.6740 452009.8967 1171830.0460 648295.0556 1362370.4730 736514.3160 1063253.0240 1040225.4290 838383.6468 596234.7631 1012863.4440 1134947.0720 738238.3857 1045198.4050 742074.8648 781787.8912 196457.5390 1457859.6180 791391.5626 776142.7358 679346.6549 626217.8593 1256838.9200 676073.5579 1691758.0630 610502.3840 851131.2958 659037.0595 814724.7273 861957.2174 555897.7653 961655.9415 521922.8117 1144736.8120 975152.2750 1331703.6740 529269.6553 1785859.1290 2251096.6610 785639.7890 477804.7224 467469.2295 1015006.7440 1152433.5660 917625.2136 584492.2626 1399338.6080 663969.7462 578538.0065 732437.6183 1242347.6500 948516.6704 932326.6792 666218.8643 1271195.5030 509738.2045 316857.6864 1251269.3400 1289346.7830 527688.6650 578254.8613 839263.3918 738475.7486 485222.1512 890548.8070 770183.8401 1377644.6110 1076284.6320 601656.3829 633024.6020 554672.4482 518454.3723 936786.8208 1183247.1990 294685.6344 572400.8854 826802.4160 486036.9128 378680.4251 944304.4958 1329470.1610 493202.0882 456624.8619 281817.4185 568371.7800 1929336.9100 398881.4570 967872.0598 445312.0871 778722.8150 790241.9822 1140137.0020 701434.9479 602031.7337 589987.1672 700374.9714 689094.5817 463524.7310 393758.5017 588505.7767 523379.1742 482398.1328 573560.3138 444310.7477 488716.3563 677513.8570 535970.0753 486184.9465 450119.4120 927488.6644 838951.7445 932045.6853 815379.2803 702703.7427 866207.0440 792638.7350 725140.3214 691936.9696 908351.9418 899167.9428 853082.8169 861021.7232 820449.4276 811549.7340 726762.1268 688979.5416 770839.1631 973262.7757 967787.6040 848795.8263 909089.0445 814220.6371 848060.7208 853505.8499 850467.1260 862686.4517 881365.2199 796658.7754 742095.8608 748472.1116 677412.8584 714572.1534 Aminocaproate_R2 Aminocaproic acid 1034893.9740 1895004.5370 944261.9331 1117792.5490 636000.0204 674624.7946 549096.4780 453141.3371 522175.4891 479435.3351 1223039.6450 1054315.4800 858863.3324 1303782.2410 689362.3905 924156.6881 710263.8657 1050518.7170 900590.5196 577344.5218 543390.5189 1001645.3090 2306995.4580 655004.2013 975266.2154 889183.4416 836050.2277 1028915.9980 568984.2816 1086940.0340 800010.1836 789790.8336 309375.0900 697161.8653 714553.2170 685012.1926 719365.9988 1112122.1080 703982.2797 641206.5689 552711.3169 1037356.0870 1650852.1080 393842.8162 952259.5759 543597.2927 653845.0481 1435957.9780 660708.7343 364649.3612 836815.7434 1095366.4010 546926.1675 427556.2851 890489.1192 858858.0312 617575.2950 905239.8918 606465.2089 633678.1705 716099.3688 1195482.8870 492199.0662 429261.4134 770118.6833 549031.5258 1077823.4690 724456.8036 597446.0623 392417.5914 353807.3913 575581.1131 749608.4504 435178.9670 1048494.5100 608590.0414 1260655.3960 704071.3036 1005066.3570 1011980.0750 924421.5805 601063.3031 977643.7628 1120988.4010 725729.3760 895570.6724 682906.0188 742678.3798 216692.3927 1427354.7070 787164.1945 773849.3814 690948.6138 622566.3314 1223935.0150 640546.0758 1681722.1700 667427.0858 813626.6523 684060.6581 758442.6495 846399.6226 525760.2962 983449.9239 480233.4261 1160046.5080 970458.7915 1284605.2860 500099.5038 1728048.2720 2224159.2620 775872.5812 480788.3833 437010.3101 965081.9058 1150437.7610 1029376.9730 577689.3177 1316442.9780 626048.6302 513782.6231 701391.4110 1220053.2630 942917.2998 883032.0961 628267.9522 1243759.9520 499270.7096 324773.0580 1244203.2760 1272521.5840 579635.0573 570273.9828 782572.5683 734841.6464 471695.5657 854612.3382 697239.6455 1341553.2800 1041950.1890 564947.0103 594635.0164 551311.7852 515954.5924 933738.9326 1168532.8710 241891.7502 554769.6490 796965.8192 481859.9989 417498.1633 1020484.6780 1306467.1490 509683.7332 390250.5423 288925.9136 554821.3067 1879040.3180 411058.9988 977949.1102 459331.8754 750462.1383 781379.4271 1063560.4470 719144.2493 491251.6409 568096.9075 729203.6033 518406.2544 445752.3526 421953.5584 554431.2131 516622.9158 675283.7510 522054.5359 436887.3655 585177.7105 506487.7198 435783.8468 600241.8945 416345.4292 904287.6295 866321.7639 911273.4884 933911.3891 827512.8183 812712.1285 709675.1374 736582.5569 744200.4516 899613.5914 891070.9462 852487.6998 861092.4659 838323.2858 911842.9424 837061.0400 684318.3814 822188.8577 943998.4514 958137.2096 837507.1303 863639.4811 816407.0654 809832.1868 822541.8635 848867.4209 858042.3263 807606.6069 763529.0283 736630.4594 758292.5600 768332.9497 697288.1657 Aniline-2-Sulfonate 2-Aminobenzenesulfonic acid 4257.4332 7316.9271 2259.8662 3533.5383 3068.0797 3916.4373 3098.2764 4066.9519 2260.4938 3030.9522 2565.1173 3009.0994 Anserine_R1 Anserine 39458.4149 67017.6694 21159.3276 18668.4448 589524.9347 109632.4419 424607.5878 19132.2327 23758.9982 12544.1983 41759.7837 181651.7806 51037.4967 84418.1667 21911.2219 179089.1693 28936.6029 46556.7269 1134195.5370 39491.6412 86486.6838 42264.1544 28448.1306 27135.0284 1640505.0600 57031.8388 18730.2480 426964.5562 20344.7865 45154.2078 71674.0496 23905.5878 89503.9041 20710.3756 36260.8481 64138.2368 85091.3334 20855.7571 23900.5829 29312.3951 62236.2514 52378.8222 46105.6735 86166.3290 24480.4360 21974.9862 26659.2614 36259.8473 19633.0775 45872.0103 20867.3944 174420.5504 22096.2212 18802.4077 27205.5837 254215.6098 22550.6626 22431.2237 25062.0770 22668.0778 55161.4743 25439.2287 61678.2468 15922.0763 44363.7566 79534.5260 184864.9200 166381.3521 37812.9671 7477720.5150 26715.5913 21453.4421 98628.1108 31286.2285 55407.8669 33160.1078 109490.0753 117450.0431 29564.1643 53424.8072 15491.6464 69794.4254 450181.6647 13336.1372 45598.6876 15783.2013 23745.7393 49598.6712 60772.2569 75651.2349 157405.0898 82666.6340 53993.2948 20246.5595 2315666.7530 38804.2629 25128.1179 15546.0150 17448.8900 71223.4566 49091.0806 34802.7238 53529.6441 30126.3609 142994.7767 23499.8548 748651.4208 36802.1540 11572.0055 71570.0213 13049.1317 198622.8540 151140.7011 29297.6757 7254622.8730 26100.7104 27979.1450 54180.0127 53971.3302 60736.0657 53292.2623 51270.6792 39155.3682 39750.6144 39729.9332 41066.2100 42674.4188 44017.7452 39033.5674 60227.6854 56622.6709 52133.1693 48723.7615 52908.5040 48298.5644 50869.4697 40749.5498 49838.6296 41994.1107 53184.6817 53511.2617 56749.6413 69024.0600 73344.3957 83262.9741 59273.4810 75630.2339 80743.9285 73920.2521 74730.6353 63397.4846 83938.7643 71577.3101 80875.0226 83791.7865 63041.6887 74411.2247 74254.6669 112168.8763 111725.6821 88647.8977 86332.2451 96026.3648 83766.7666 112728.1547 91032.2520 Anserine_R2 Anserine 30400.8585 55736.6437 3619.3118 564600.9639 88163.5720 400403.6856 6544.8923 32620.0055 158620.3263 40040.7181 66336.6590 1800.4970 162051.5923 8784.5322 10264.4089 16591.7228 34115.5281 1094038.1500 45539.2036 75048.3474 20712.2446 20511.4408 14037.9105 1605007.1660 47280.4548 8593.9769 409181.9143 36585.5090 58592.7380 14191.5603 78007.6632 11997.6696 13785.9812 44855.5058 77314.9679 9511.6593 14488.3299 23028.6368 49807.1489 25922.1603 26032.6300 69614.1288 8925.3862 6192.5929 10123.7207 29300.3174 4810.1049 7638.9099 31082.2382 160980.1678 12074.0130 225888.5683 30491.1532 9436.9694 13536.2071 16899.3017 34365.7610 13211.2636 48688.3182 33875.9316 59645.8054 169571.1802 152153.4169 28253.4130 7419246.0320 18238.7195 13350.8939 83051.2264 23761.2967 44318.6011 20651.0828 101165.8267 100134.6778 7420.9951 45374.2257 4852.4386 58876.8521 426646.8164 32924.9054 9622.7261 11972.2136 35989.7595 53950.2704 65460.6157 153939.9636 67542.6435 45047.9043 11423.9390 2279575.0510 25763.7793 14293.0536 18323.5547 11113.1459 60010.9488 16120.3498 16210.4948 34101.5129 24852.2947 127556.4427 5826.9048 717063.1247 29247.6699 59818.1667 178788.8133 6075.8122 138189.8500 18985.3942 7199357.0710 18137.7934 11562.8187 52167.0073 52588.7008 56460.5894 47207.9424 46644.2227 35449.4344 41483.2831 36443.4020 37893.1473 40694.0960 36839.9767 33848.2740 54358.3321 53333.9591 52360.2356 48827.4739 52206.5337 46738.9875 50837.4701 41787.0286 47889.8407 43214.6809 51050.1136 51717.3603 55458.1448 57990.0148 58737.7493 70500.8643 51036.0498 67053.8975 70348.5517 63730.2766 63207.5275 54789.5143 67802.9662 68515.6304 70831.2085 72596.2835 57898.8244 66346.6460 61598.0371 103258.3372 100528.9552 79712.6524 78291.0017 89862.1719 78562.2679 98493.7653 85699.8581 Asparagine_R1 Asparagine 546095.8089 591606.6874 290326.7504 600623.9739 426177.2582 328247.0098 307214.4855 196843.3784 638265.9665 316417.5609 925671.3456 649810.4589 329015.0211 291272.6744 326528.4948 332788.7876 256997.5718 674061.5248 477759.1147 492010.4529 370847.1696 389655.5686 1074776.8350 451861.8928 450022.3242 342407.9870 405611.4471 592419.6153 244661.2442 313816.5718 412020.3359 179203.0728 329914.7054 461930.2235 540349.6697 262148.3435 412449.8084 281148.9297 601562.5755 282646.9731 455236.3017 615643.1076 683367.4898 361162.5488 813231.3739 309367.0207 306439.1770 857560.0959 384483.4880 319514.8954 444242.7027 627399.7695 285768.1154 252055.0716 435830.4803 705173.4590 369520.7987 240627.9555 365901.9374 385617.3283 458283.2729 808052.5461 300261.1131 465623.1664 505264.9417 488418.3865 611521.7873 371838.5846 364167.9301 228597.8967 190046.3209 345822.8327 284089.6958 475466.9484 725926.6929 210993.5247 429004.7100 425104.6944 335521.3350 486475.7995 405037.0564 281226.6647 1108128.1730 458063.1606 458938.1386 381445.8348 295724.2834 388084.2603 209728.9256 674331.8224 344828.2959 416522.3788 311925.0186 731850.7988 589898.8263 455562.8469 706628.1573 385900.7614 536789.9663 445087.5939 385421.2272 697681.3336 395330.3987 518984.8547 423896.2501 505935.9960 483314.1701 346801.5099 258976.9941 459984.7127 434781.3625 390991.3968 800164.3181 228480.0860 269546.7177 906138.2237 489292.1051 478009.7092 433385.0409 410957.4007 321583.2085 439434.4193 532768.1021 368430.6855 247771.5760 369690.5748 429308.4894 291055.9907 270514.9046 597968.6233 395637.9642 357527.1838 394311.6363 318762.3691 474172.3496 437704.2915 814196.5416 299542.5680 509887.6728 852099.5881 274370.2477 414722.7160 380606.6205 242694.1821 446760.5771 510489.4904 213276.6891 350327.3967 413119.3730 261411.7877 304990.8031 1017974.8100 570054.0262 513894.2031 369685.4793 254944.1337 277666.3440 675290.4924 208822.9122 561696.4075 304428.8362 560463.6314 587020.7954 482477.3521 400350.1695 121795.3986 115414.3051 122621.9006 111682.7514 99397.9462 99360.2692 97907.9577 94082.7528 103579.3712 108144.6407 105315.0247 92647.1742 128799.8803 126444.7652 110851.1171 103969.2555 382565.7682 385626.7263 392686.6366 329161.8392 334243.8444 328245.1727 429984.1630 417298.0274 433367.1190 390809.6662 397274.5341 467419.2740 366354.4254 435050.2822 413787.5923 391706.6549 409693.9765 383640.3889 416784.4588 386186.5087 389486.3521 435703.5480 342106.3707 421215.0984 417880.6898 479498.6372 499661.8861 504170.3050 490332.3864 504491.3069 464076.5877 484019.5689 452688.5614 Asparagine_R2 Asparagine 505793.3301 557231.8916 264883.5458 582092.2359 404525.0976 305497.1660 287111.8295 187342.4222 583711.4660 292030.5620 882549.6810 618160.2882 312141.4873 284429.2234 323777.3368 309693.4878 240658.4502 620857.2699 437331.2965 229298.2389 340022.8000 353142.5351 1016658.9980 411004.5616 414981.2507 331075.8233 363016.8849 556483.1290 232026.7402 296137.2341 378013.6720 162741.1714 317005.2248 421006.3393 497890.4000 247130.1965 372626.0055 258715.1524 555693.4865 277658.4884 424703.1331 566581.4048 626425.0760 341581.3717 770511.8871 277208.8253 277852.0638 786996.7377 363416.2015 306759.4453 397286.3076 585936.5899 256325.5518 241516.1061 396309.8680 658816.8890 347261.8640 214911.1787 339897.1556 356858.0176 417305.3590 770185.1778 273108.0886 432705.3811 459839.6324 439167.4075 577630.2095 349192.2006 329627.7936 222712.3857 177495.4616 320596.3229 262150.2679 428858.7838 687868.4700 191166.9970 403073.5391 381645.0747 315158.0916 446140.6611 375895.4449 247884.0391 1035704.3120 415203.6550 438915.1857 370217.4102 278640.2574 349140.6913 193248.8572 636032.2130 313467.2479 371995.0695 282393.1488 693047.1781 551274.3237 411361.4014 648187.9739 371574.7303 513257.5202 416478.3667 352357.4416 637834.4942 354099.4052 490279.5692 397224.1672 477385.2406 448761.2486 334931.6323 228124.5170 425077.7653 407181.1855 351181.5243 735132.2806 206049.3342 243414.4234 842132.7698 462422.5449 463233.0785 405075.3217 391366.7768 288599.9482 410743.4960 512576.8679 334353.3978 236632.5319 341114.7145 388500.7632 263590.6586 261101.9504 551078.8985 360409.7671 333538.8504 377189.7431 300574.5879 457715.3625 408364.3017 763118.4852 281021.9129 480427.8962 799160.1390 248469.5187 386451.8527 347480.0015 233092.9635 408738.1974 487822.1827 197707.3446 324407.3273 386309.9668 232475.7909 278072.6406 940221.2088 536708.8609 467473.1950 334622.5954 246864.0935 250564.7431 637995.4532 195467.1879 521513.2221 286464.9741 532346.8542 546331.8408 455403.4526 378239.5849 114271.3588 113547.5678 112144.6356 106084.7530 91585.4759 94389.8479 80897.4968 81398.0422 91711.7017 93476.3753 93688.0548 87386.6632 113974.2105 113095.4397 103550.5885 93004.0376 4281.4555 2386.8800 5228.3180 5026.0925 5600.0441 2145.7685 5222.1456 3387.9547 3375.1929 3213.2931 379125.4541 378058.4912 364572.2685 313805.3025 313204.2347 308440.5702 406783.5172 400994.2997 398840.6979 370856.9869 371936.2112 426707.3160 337378.8511 403489.6714 378584.7144 368563.0166 368414.1351 357593.3802 383068.6759 363902.3535 368723.1286 396912.8707 308050.5758 396622.9544 376938.6315 433711.8278 463201.6953 460901.6526 453589.3263 476711.9238 435002.2526 444133.4450 426090.9157 Asymmetrical dimethylarginine_R1 Dimethylarginine 3514695.7060 4298945.4630 3426196.8210 5140965.9420 3531318.6210 3332594.4380 2812515.6010 2879380.1360 3487425.0130 2899122.0390 2832503.9690 2214591.0460 2702308.9290 2888162.0360 4046105.0560 5459690.9010 3078920.4060 3435753.1670 2498127.2660 5502474.7550 4764669.1410 4536399.7920 4747411.4380 3513993.1880 3363011.9560 4412358.7800 4189555.5390 5234341.2040 3334659.5350 4000188.8680 5269185.8720 3244397.4430 3277357.5330 3284365.4680 3206013.9410 4166005.2920 3384952.5810 4074316.1070 3239988.2070 5326290.5920 4063958.3150 2509447.4120 3792439.2630 3847818.7780 2218203.4540 4325941.4980 4369123.5060 3271774.1820 2826890.1960 3156283.9270 4761142.0720 5774313.9880 2971969.3570 3634029.7530 4905262.3840 4673179.2280 3235776.4750 4069163.0950 5364962.9940 3150392.2100 4021201.0070 3170486.7430 3977194.3440 3303952.4580 3227734.9880 3768707.7420 3422218.4170 3359737.0190 3439208.8590 3690224.8380 3404446.7430 4558470.7300 3873215.1800 4034219.4530 4211651.5440 3337026.5840 3321827.2600 2649923.8190 4215785.9540 2989217.2190 2983718.6210 4124556.0630 3907981.0370 3185298.1110 4210478.7960 5615194.3440 3058544.7340 4172822.2380 3794456.1500 4747101.1210 5686566.6340 4512721.3000 3621238.2000 4004014.8520 5241491.4550 3598390.1380 4323120.5520 4090322.7010 2892746.8030 3656177.8760 4823487.3770 4349307.5380 3111698.8720 3141223.2430 3466997.8640 4741015.3740 4890905.0550 2582732.1720 3454284.7870 5587335.6910 3178189.2220 2684240.0680 1201058.1490 3929898.3240 4173096.1830 2596394.2470 3943720.4160 4508182.7910 4303374.4560 3648978.9950 3804061.6020 3146748.2660 2997869.5180 3669459.6460 3993104.4710 3887158.7640 4067817.7880 3880893.8580 2003716.2180 4274810.9080 4694955.5690 2578441.7510 3496416.1950 3644120.7210 4441056.0400 4044316.7250 3135632.7240 2915634.6050 3535428.8040 3201347.2030 3008888.0120 3371540.7540 4739423.2510 3631607.2070 4746485.9780 3141657.3360 4079185.3870 3823464.7500 3485511.4890 3662935.9970 3984603.7320 4681743.0060 3041890.1660 2968414.3710 4558320.2740 3280547.9260 2792243.4280 5072866.4150 2720671.4800 5217391.8900 3209704.4850 3308291.9220 3815222.5870 3566569.7950 4014600.2070 3769454.3930 3590986.7560 3946355.7160 3554655.2500 2805850.1990 2646022.4870 3210344.1750 2997950.8220 3118469.3850 2895302.2330 2565580.3270 2694680.1110 3360422.2990 3302346.4880 2919709.7030 3120704.9460 4041159.1240 3889338.0320 4153060.7590 3633482.9760 3676109.9720 3640993.0240 3506179.9110 3326672.6440 3438337.8730 3840000.3450 3898038.4590 3861639.5580 3372997.3100 3956647.8320 3602225.9300 3306258.3790 3276282.7570 3091974.1820 3727590.3180 3633540.9940 3915391.4830 3536838.7480 3026340.3120 3565885.6480 3369537.4030 3942912.5770 4054442.9140 4105986.8110 3889762.7470 4110126.4840 3618140.7170 3506859.4670 3870380.1960 Asymmetrical dimethylarginine_R2 Dimethylarginine 3275197.5090 3993052.5130 3297056.0850 4993517.9190 3316270.6440 3072265.6770 2567586.4620 2753563.5570 3274165.1150 2771283.7990 2696820.5140 2145783.7740 2491509.6050 2818416.9870 3937629.0270 5086617.7770 2946989.8610 3321697.5980 2338792.2690 5345821.6170 4422350.3470 4195904.5390 4681885.4760 3272027.4530 3250707.1330 4231558.6790 3868046.2120 4806499.7930 3188964.7990 3850226.2080 5074367.9330 3137623.2180 3121178.7710 3171804.5340 3063692.4450 4008374.1670 3106256.2360 3932290.5900 3023351.9930 5154490.5270 3847222.3950 2430236.9650 3495723.4130 3713251.9800 2046343.8050 4177787.4410 4215876.2840 3026360.9870 2706999.2390 2890203.4120 4616550.6990 5320343.0120 2875040.1200 3469254.5060 4598227.4370 4307209.8200 3003898.2090 3955887.7000 5012796.8840 2893692.7540 3882166.2490 3031728.9180 3865161.6530 3152389.7980 2982306.7500 3504167.1380 3202590.8180 3215598.8080 3291139.2410 3388256.6960 3287135.7850 4390397.5010 3758444.8940 3865413.0490 4097256.5040 3238268.7100 3080831.3720 2543989.9990 4065222.9010 2787322.3180 2714054.0370 3847672.1110 3627180.4800 2986855.3660 4070388.3190 5419265.8310 2969891.9400 3965120.2810 3632647.5870 4411060.3200 5259762.4670 4226685.4160 3319553.1900 3866053.8700 4881146.2390 3374104.9280 3985818.9320 3781379.5760 2663371.3150 3414301.6700 4644071.6580 4125506.8030 2989909.1530 3009374.5440 3200105.0640 4399188.2830 4729225.5770 2501048.4850 3325499.4050 5331685.4440 2930512.8290 2580568.4510 1132449.8180 3639228.2640 4018456.5820 2382591.1600 3841346.7880 4258208.6260 4110442.1000 3502343.0010 3710766.4430 3028973.8260 2738250.9940 3411518.6670 3692136.8930 3781474.6360 3867848.0850 3745749.2920 1919143.3060 3930178.6550 4501943.2970 2356535.3530 3330528.3570 3520625.6390 4107308.2200 3899429.0220 2983176.2040 2814660.1530 3405226.0410 3085696.3390 2769087.4130 3139297.0050 4570807.8060 3385301.9200 4414048.7200 3020963.8080 3813094.7210 3672975.5180 3322827.1290 3449173.0740 3828174 4344685.7890 2751476.4700 2719925.2350 4362626.8100 3165846.2130 2529304.0050 4670247.2560 2653617.1820 5058945.3270 2994887.5720 3103022.4820 3687337.9800 3487261.1270 3850581.6970 3548329.0630 3382648.2240 3695165.3920 3371915.9810 2614019.2500 2456579.4590 2988399.0490 2776840.0090 2871024.2630 2679222.9680 2370606.8550 2628813.5210 3266603.3650 3070005.7680 2713530.1220 2875267.8070 69863.2572 36395.1054 24628.2546 80465.1244 35759.8867 29090.5987 94008.5654 34320.7013 27122.6569 77605.3467 20066.3118 28306.6239 87383.2738 37310.0897 31626.6798 86327.4487 30368.1280 29323.0378 3946564.9010 3772122.1850 4103431.0200 3529293.2290 3592640.3070 3592123.7250 3369378.9860 3265928.9360 3205755.1100 3753124.8850 3809850.3300 3646505.6800 3187580.2150 3763694.5930 3546498.5900 3229271.4610 3209407.2350 3017561.8560 3604233.2670 3566855.2050 3658298.5510 3457687.6300 2937773.1570 3315117.8900 3150973.5700 3868233.8010 3962737.6050 3976598.7670 3749564.4850 3972167.4770 3527330.9020 3252638.3590 3747756.3030 Betaine/L-Valine/Norvaline_R1 7609922.6830 11768365.8700 6059239.7300 17029104.7700 15389558.4200 9483071.4900 8997030.9390 5163300.2220 7667755.2080 8673587.9050 7991410.5330 7564426.7510 6439121.8410 8510176.7790 7019638.8560 6207137.7150 11341571.9700 8655760.6680 8630994.7130 10090752.9700 11787940.8300 6462728.8210 15390120.0100 14520308.4400 4216112.3940 11848709.5900 9875556.7410 11844982.5800 9531809.3790 6310464.8490 8824413.3400 6717228.2100 9393127.9680 7468153.6140 11313768.7400 6892338.7720 6338551.6800 10198904.2000 26901750.4500 5400843.6660 8615535.2390 6322347.0480 11431569.2100 9370108.1460 19263650.9200 4720333.0410 13016411.7100 5722871.0270 8386803.5730 3222528.8250 12303322.7100 12495228.1700 4806533.7770 5506774.8360 5193961.2720 6471214.8860 8406246.8340 10570351.7300 7900140.1870 5548975.1270 12625132.2300 16300196.9800 24060228.1200 14460101.4500 11476233.5000 17052082.2100 22387720.6800 6735801.4940 8869935.3270 4854043.0230 5904691.4570 9767243.0840 6418816.5080 4673502.1250 7814092.4660 9434690.3950 9980700.5270 6806698.1650 9177702.2300 7553447.0280 13258130.6600 6586312.0270 10266784.9100 13078568.8500 7057666.9700 12014019.3800 5314350.6590 11080574.2100 9377140.3670 14341540.1800 7862811.9230 4440080.8190 8934621.0120 10124157.6200 15838541.1500 13168256.5600 4948810.0970 5644898.9870 7366082.9170 15541569.7300 4824408.1930 7748107.4430 5231510.3260 7230979.6570 5319391.1900 10095438.5400 18309622.4700 15145981.6300 9185306.1460 8894544.4510 10468434.3800 5971035.9950 7194436.4550 5833533.7350 7460542.6490 7623186.3210 4689264.2090 6171915.8420 8091412.7320 6353640.2380 4688981.3190 9731569.2360 6472276.1560 7206166.6310 7066662.6690 7636571.2050 7825042.1970 9975395.3640 8866705.6580 11743698.1300 11208387.1000 7743780.1900 6787072.7800 10739758.9000 8726903.2410 10318159.8500 6931065.7690 5137095.3900 12656357.2300 8794267.9190 7897393.3330 12446045.9000 9130071.0410 8074864.4940 13162369.2200 12058601.9800 10469820.0100 8195026.7560 6367090.8760 9472455.4880 9304617.8220 7411906.4570 6800606.4410 16224021.2500 11436163.3500 5500263.5750 5448346.2440 8253896.2390 7979574.6070 12216583.9400 5364787.1100 7443609.0260 6731004.8250 5308502.0780 11908353.4000 19637729.9800 19037638.9300 18683259.1900 17913310.5100 14634388.6100 13691863.8600 16624149.4300 15860819.8700 15861661.6600 15982143.2900 13681925.7500 14479290.0900 15775547.9900 14894627.9700 13899361.1200 13157720.8700 8093176.6080 7355820.8120 7844920.5270 6188605.2660 6577019.4210 6284288.9050 5642096.8470 5788902.0710 5435886.9640 11309670.5700 11051641.9100 10458288.2900 10203069.6000 9976866.6860 9547406.0320 8447851.7640 8107922.8670 8559115.9760 10237259.3200 10202811.5000 9279757.7080 9341995.9390 8993419.7450 8609947.9130 8730905.0900 8663087.2100 8992941.6970 9157337.9540 8676207.5350 8398693.9880 8278304.2440 7221695.5410 7201285.7870 Betaine/L-Valine/Norvaline_R2 7881100.7560 11861007.4600 6007938.9190 17177141.1500 15060886.4500 9774017.5530 8759062.2190 5581614.6830 7831652.0680 8806435.5260 8602201.0260 7900376.9970 6839753.9310 8942792.0830 7267440.2640 6432530.1650 11305248.4000 8764188.5600 9209788.1720 10241241.4200 11933646.4400 7003177.2770 15730678.1400 14512304.7700 4532720.6630 9801744.1290 9983192.1850 11378001.8200 9409839.1060 6125150.4380 8917005.0970 7188678.9400 9175261.9750 7258595.3750 11092804.7500 6758015.0490 6615069.9820 10300191.3100 25263585.4500 5829331.7740 8800760.9290 6878643.2860 11154179.1900 9823403.2410 19533309.1500 4552963.4470 13168340.8800 6081720.0520 8941475.3920 3382334.6490 11993794.2700 11916995.5100 5001153.1490 5668471.3120 5539569.5730 6623045.6220 12213765.6200 10531817.7700 8221542.6400 5569076.5810 12673732.0900 16842700.4700 23728273.6100 14593597.2800 12181480.2800 16842923.5700 22688818.9900 6892312.1780 9081411.2990 5482670.7170 5867717.9710 10400106.7400 6307595.4910 4463246.8960 8448045.0100 9767983.9830 10311173.2100 7075936.0190 9699164.3140 7136672.9710 13238669.2800 7413632.8170 9986950.3100 13159576.9600 7417751.7340 9788442.2410 5569489.8380 11278823.5700 8948496.8500 14545684.7300 7387287.4990 4748923.7460 9268926.1980 10069525.6300 16331095.5100 13073226.8500 4690786.7870 5990713.5440 9392596.6220 15349355.0900 4520463.5870 7951018.7410 5025342.3120 7292986.6000 5074285.9510 10812960.4700 18274555.5300 15227373.5600 9194890.5930 8797274.3460 10041414.9100 5878136.2690 7650446.0870 6097875.4190 7215053.1710 8302151.0260 4771874.8390 6343905.5940 7735108.0290 6803656.1450 4500786.2070 10225375.2000 5669918.5410 7238650.1740 7539580.2020 7864979.6710 7437131.9660 10240941.2200 8274427.1240 12005515.2100 11041016.4700 8427053.4200 6721459.3720 10572017.5700 8709603.2940 10331026.9700 7428568.7670 5584868.4820 12772214.2000 8389373.1790 8273194.8650 12318661.1500 9097627.6710 8086912.5840 13362137.4300 12743394 10365063.0100 8557480.0800 6571513.7490 9514082.3750 9934059.6250 7061616.3440 6171151.4220 16024119.0800 11447208.6400 5727951.3030 6065085.5380 8081642.9770 8176152.8950 12742806.7900 5466230.7930 7968825.0130 7104988.5640 5641459.2690 12317690.9900 19643611.4700 19072657.4900 18811799.3800 17886419.0800 14659715.2800 13698820.2000 16617006.7100 15901976.2900 15918583.0300 15977858.7100 13811521.6200 14590797.9600 15962704.5400 15030856.1000 13990118.6800 13149733.1900 8736094.4590 7986157.6490 8406452.9610 6775008 6983699.1950 6769423.0660 6096245.0590 6144948.8420 6168352.8100 11451490.9200 11132172.0800 10966616.5100 10453722.4900 10071232.3100 9754259.2580 8598567.3240 8147399.8630 8681374.6780 10414348.3200 10163274.1900 9487534.0090 9855262.1180 9156984.8230 9380101.3780 8862840.2960 8594384.8390 8932269.6010 9585361.2790 8588551.3540 8185424.5300 8524029.8110 7630456.0710 7192733.8600 Biopterin_R1 Biopterin 128892.7061 132787.6871 156690.1132 108553.1140 43773.7695 168087.2844 141497.5469 278966.7252 103139.8094 122798.0190 218598.8311 161330.6665 91964.6914 131512.7207 181663.8624 143293.4087 63475.5858 128548.8516 160379.5033 145161.8609 178501.3873 119061.5322 189381.9223 128799.7599 127833.6071 203010.1860 238203.5199 115260.1831 208665.5971 237489.0221 109384.5390 171283.8495 53455.0022 83070.3221 73005.7822 105387.3850 54027.0152 104654.2633 60111.3530 123435.5326 180098.4261 187635.8593 94854.2766 232590.1759 155900.1258 105979.5081 168562.5049 72522.3834 298483.8514 81153.4426 53861.6949 111491.7250 131015.9475 83715.3827 67786.5194 103204.7659 185340.4514 97093.9989 66519.8986 108530.4464 108534.3467 140681.4785 118303.1212 92077.2005 37855.5306 83233.4776 105700.2964 134037.6262 147790.7939 244090.4629 114348.4114 18188.7139 164633.3477 42721.4278 190554.7908 219924.7543 180904.5990 155120.6636 218551.1144 88505.6339 136586.6664 150495.0747 65235.8793 128081.0752 127792.1572 213644.4365 337516.2330 147489.8342 66244.1642 206061.1695 68711.9031 76798.5415 149756.9020 75062.7811 266605.6032 21979.4796 115765.1950 140774.4623 119167.2937 95618.2162 75281.0535 169397.4457 114891.8516 93417.6319 37462.8539 253211.0991 132720.9979 270095.3943 59240.5257 153775.0119 137651.9472 164674.2820 146587.2307 80144.6427 231089.9419 182836.7533 127657.6533 172309.0562 82015.5752 99314.3934 38245.7532 120262.3567 154293.5585 178150.8677 197823.3735 146763.5399 92453.8316 80033.7393 83786.5831 203685.4701 150277.3580 127583.8759 88647.5846 85721.5817 86584.6983 134332.0489 64783.0866 309968.1769 152351.5695 48706.4904 141010.3962 33402.5543 46088.3937 134378.5376 143390.7922 166632.8103 47025.2907 307497.0325 169490.5723 108845.1392 97636.6706 96090.9643 159460.1997 59991.7281 193071.1421 108862.1050 194402.7508 128847.2264 130992.2598 208062.5592 89577.7832 129632.9799 120912.0083 206645.5938 116400.7192 364843.1772 304466.5603 382565.5754 382924.8198 329254.6691 312320.7818 359472.8021 326083.2192 359847.1807 332266.2047 273867.5938 334606.3520 313227.7063 321533.9882 318256.2213 299795.7533 141641.0288 155614.9558 130344.2231 193399.9663 209660.4177 189425.1450 150976.4562 145313.2776 122689.2424 107027.7876 90985.9060 130743.4513 157205.8048 161898.7345 153063.3054 149750.9016 149554.1010 169411.9425 163813.1724 160334.0639 147739.6171 152214.9063 161132.3899 149286.3190 158375.3420 141676.9830 170620.7455 127097.6959 121738.5292 115200.5304 136772.0400 111397.3515 115556.6128 Biopterin_R2 Biopterin 99647.1283 130780.9141 126262.4361 86114.7728 43426.8890 126554.3006 98146.1959 236077.4912 78870.2833 92211.4878 161953.2759 131542.9176 67837.1068 118509.2683 146816.8237 104982.6333 49326.5610 98070.8956 133152.0104 115335.3344 141195.9311 92881.1378 163424.9474 90873.4831 100293.9278 168792.0545 188104.8649 93472.7850 191302.2788 193067.6373 92271.1693 132849.4087 41116.1274 67102.5198 53636.2157 83169.8445 46911.0496 79721.7014 53377.3961 109386.6855 145823.0222 158775.6787 72772.8924 213731.0773 128161.9687 79484.5862 133120.0600 62904.0942 221222.2706 71242.6954 43214.4524 94606.5781 111436.8209 61488.0836 61079.7907 87445.1131 151725.1109 84333.7667 52236.9221 79952.9534 98698.2239 121250.7158 80908.3502 74977.1017 45942.3861 70043.6110 74718.3688 104996.7596 110207.4254 199681.0878 94318.8017 157057.3833 138175.0865 34432.2383 141664.4539 169491.2398 139396.7064 111200.5921 186616.0201 68201.8101 111025.9623 115995.8393 48636.0132 97663.5381 100612.0349 160788.0867 262301.0664 117789.5324 50260.0863 172929.5213 49893.4467 62276.0695 115131.2521 63659.4224 216532.6252 21653.9945 91201.2215 117560.7179 93769.6148 86075.6220 61205.2495 120253.8413 88790.1006 83156.2711 29981.2817 204868.2615 97163.9646 226698.3599 50871.1585 129314.0001 105111.3936 132190.1246 104751.8715 61143.0536 176113.8764 159277.8248 97037.8390 141530.4336 72659.0911 81598.4931 45353.6426 110402.5589 132391.8819 160341.9934 173459.2353 121538.8048 70747.9497 60508.6348 63779.5477 161119.7986 116680.2633 110125.7792 72730.5990 71794.0641 78505.1767 107490.1762 53539.9582 252650.8673 122450.9049 37884.2537 117782.2636 27040.7549 32365.5501 108407.4842 110869.9189 110196.3748 43704.7556 267914.6691 133632.7784 81450.7479 83348.4175 80168.0503 125673.7818 55126.3340 156023.3661 80176.2355 148312.6214 103281.1438 102175.2751 152674.8882 75349.9239 103450.3453 103640.0599 185331.8838 101095.2948 298340.6271 272025.6269 308189.5764 324645.9439 268699.7840 263882.6160 286185.3521 283787.0219 285076.8851 270069.3825 235361.9148 268880.2010 273459.2209 256173.9890 261464.5685 246271.8826 109756.6032 120413.2855 108953.3591 153876.9526 163845.8596 154626.7299 124847.8463 108343.4416 113645.1382 90150.1692 85555.6012 106198.4239 114505.0329 122890.2693 110768.4146 112971.7932 118282.7602 130567.5682 132296.6814 127146.8293 121938.2196 120129.5322 116367.9098 114395.8458 119366.2749 127102.8191 136205.3425 101554.8398 99500.7331 97886.8492 104394.0778 89151.8500 90553.3874 Caffeine_R1 Caffeine 116686.1601 9286.5840 19404.9507 1990046.2480 13498.7477 180139.6863 40546.8324 329064.3572 26754.2305 98568.2643 45018.8502 47060.7566 55183.0054 37853.5165 267742.6120 139476.3787 68490.5605 97434.7691 14392.5251 756597.3600 52947.2433 89601.1215 43125.6896 28597.7496 27528.4359 18135.0384 222487.0725 12521.8966 69924.7807 10255.3411 28418.6615 29481.4807 75125.9863 88602.6218 1950235.3760 34658.8941 35031.1072 49732.8998 36152.1206 153545.1437 44151.5416 27438.1334 42048.7140 20788.4887 23613.3362 15494.5477 29321.4181 28380.3962 19622.3942 31488.3189 133529.9538 18390.6911 35015.2874 154950.0201 140867.3466 149572.4252 11069.0083 50948.6033 14612.5254 34269.1277 26566.5842 110448.1200 135059.1078 32885.3141 30026.6976 22320.3155 18596.8403 31305.8883 50966.5503 23970.9143 51592.3547 18315.8443 23500.7518 37981.2568 580826.9898 77554.1265 197260.2283 27677.8516 824159.9206 50386.1556 176673.3728 74651.5856 285217.3840 28857.3100 8793.4970 30573.0088 37384.0055 43962.7510 24626.5241 20399.6444 29639.9479 24388.5820 19616.2547 13409.8920 160368.4724 506735.3382 59863.5296 53527.7957 83179.4951 40799.3323 28280.4007 40092.6190 5020.4177 23920.8056 18051.1851 452597.3487 6313.2174 538513.1686 83988.3594 43441.1962 46104.1214 23006.4541 129595.6936 74449.8787 24748.9447 97403.7502 684064.8568 660935.6338 648589.7220 633582.1066 573694.3624 558181.6954 600220.6144 610201.7908 586197.0274 613113.0064 551844.0757 568200.2208 619923.0846 607587.4637 550078.9691 474714.4107 1948936.9290 1848217.2150 1857582.1130 1901942.7670 1860026.8190 1745417.6380 1741903.5720 1821321.5100 1814864.5770 84304.8956 74674.0047 81965.1759 76844.8214 80801.7165 78053.3637 68824.8110 68933.8811 72166.1911 82095.1933 76839.1929 82427.4912 86166.6417 71936.1061 84144.0450 77710.2663 86439.9097 92851.5132 88303.6434 81961.8805 88903.2667 78905.6080 72613.1860 65270.3657 Caffeine_R2 Caffeine 10380.4794 110578.9302 9901.9706 15998.5283 18810.0459 31635.4901 2018495.8020 10053.1014 8123.0022 25407.3619 177869.5411 29642.9007 323295.9655 17120.0392 90910.5364 7214.8071 31625.6583 32108.3177 8707.4384 257903.5983 136829.9430 63714.0268 84216.6655 10804.2269 7623.3701 771086.2113 5291.7899 39103.6487 7201.7028 83881.6126 32117.9155 8164.7554 15575.3462 10951.5845 213917.3101 61490.7578 9472.0623 12057.2004 24302.6928 69520.3928 78932.9861 1967884.6520 23384.8748 28272.1252 8151.5824 26012.5118 149322.6061 11521.4403 35597.9759 33188.9111 17830.9074 4289.4750 15665.9723 23725.4449 25410.8239 125445.0661 17210.3021 149983.0778 126714.9024 141085.0977 43814.2602 11296.7641 32245.8624 11712.3411 122769.3047 17890.2363 33305.5701 12681.4149 14060.5382 22906.6092 45659.7524 11276.5926 22712.7087 585298.3215 56721.5685 195168.6315 12975.0706 827849.3010 28230.5454 168993.8646 61489.7631 11586.5929 274424.5992 10095.0360 10527.1673 31986.4714 14319.0873 17261.2013 10287.1116 15054.9039 2992.9995 16109.5406 157353.2046 499334.5791 55718.8718 24768.0235 19316.9366 16112.8676 60385.3353 29129.6569 21435.7658 26801.8084 17546.5219 24270.4896 18204.7715 7963.8393 451144.9718 537325.6145 69777.9438 32184.9454 32768.0918 20090.2522 123283.2119 70854.5384 20000.7463 93718.0406 11652.5657 683508.9682 667676.3517 655785.1591 636010.4120 579512.9898 557965.8475 601244.1856 611432.8356 577191.4500 612039.7441 542218.2300 564280.6700 617423.6087 609235.0641 553133.6810 476030.6708 1981739.5920 1856743.8500 1898305.8630 1920369.8010 1869079.4650 1740592.2580 1767547.9820 1830295.9800 1833086.7170 84472.4794 78280.7931 82735.9367 74919.4209 81194.9775 75887.1733 68302.0238 67838.4212 69933.7021 79800.5650 76534.9617 77176.1262 83613.1602 72422.0541 79761.9119 76656.4439 83876.2855 86160.6662 87444.2982 81386.1850 87513.9052 80655.1256 73266.6062 58513.8676 Carnitine_R1 Carnitine 2168482.5920 18105936.8400 9180497.4190 14009746.8800 11618878.2900 21202341.8700 26623093.5300 1031538.2060 2052020.8130 13825920.7800 4207615.0260 1647322.2300 15753691.4500 27193417.4600 12621069.8300 896712.7984 10499807.3500 31035868.0600 8988519.0370 2959153.9460 11168344.0100 2301076.3780 43729432.1900 14763955.0100 6988313.5490 18537943.5500 2279682.7910 15053890.3800 2449095.4600 2401855.9840 3051087.9770 43895482.2300 2804980.2900 16620710.0300 11605011.6400 5520500.0990 2409117.7600 6992026.8890 11387250.5000 7588161.5600 6335134.2040 6171757.4570 8354560.5760 3253868.6190 21227581.1900 3325924.7960 8093631.2650 1086895.2020 17713042.1800 20234415.4500 6057268.6640 16747369.2200 18373900.8000 13085459.8900 2778307.4890 5328360.7630 1773110.4310 25019013.3900 2307643.6900 5965872.5440 6997253.7140 34292610.6700 35051582.9300 10060276.7500 19328676.9200 17320859.0300 13946373.6800 2105397.1840 967564.1437 3810570.4400 8984372.0510 13097100.8000 6992586.2670 5975588.5510 27292927.9100 34177118.7300 13992570.5500 3078786.5950 32306376.1200 6411828.4400 20074660.0800 5039665.2820 9239243.5730 17088236.0700 3175119.7940 19422556.2000 3855433.4230 958485.2043 4112170.2280 3230445.9340 5555803.3730 2409569.6840 20201346.8200 2281006.7470 34373511.4600 15217599.7100 2389726.8850 5853399.0820 13620777.2000 6676410.1590 2388143.8500 4478359.7350 2948847.8290 2492039.9330 6313525.2960 4459015.6380 6291591.3170 2781389.3300 3885368.2880 3716363.6600 13490474.5200 3179031.7760 4735079.5810 2661852.8660 6350178.4080 4339969.0220 7661225.7110 8659236.4670 879081.8842 2602290.2230 1903586.2430 14094611.5200 8700556.4120 37342889.7400 21049681.5200 2025439.3910 789003.5537 23810319.5800 5452581.8290 25988861.6800 8376094.9660 17441065.7300 8701443.1540 26892320.6200 6022403.2230 20047052.4500 1511056.3380 3723321.5810 8462650.4230 19163414.0200 17315447.4400 15588022.1300 3109188.1560 2792263.7820 23638957.9100 12871103.4100 4457524.4570 11752860.8100 32170857.9500 19004281.0800 3393070.8580 3078722.2810 9081621.5010 16323964.1100 10579749.7400 7968605.0480 784282.4613 8604657.8970 6949656.0590 5577876.1070 8119718.1770 25622609.1700 2902846.7590 15442845.3800 19180498.7100 18270602.3400 18924663.5100 17380481.4500 16001164.9700 14098279.2100 13090944.8200 14902621.6000 14327011.6700 13845688.7700 12641071.8000 11224432.7300 11930046.9100 14349371.0500 12927880 12464534.5700 11040631.9300 356866.3550 333122.3092 333318.3231 257985.0015 284882.9561 255091.0579 241096.5474 240562.5858 251881.6370 14374192.2000 14100629.2300 13896234.1300 13188233.6800 12512325.8100 12216095.3200 10975151.3300 10268114.2800 10287339.8900 12072436.6100 12211548.8700 11554778.1500 10578472.8400 10383906.3300 9984012.8230 9779612.4620 9972626.9140 10776566.3900 11781419.5800 10577033.0300 10476179.2200 10349087.4000 9719445.0790 9269605.7450 Carnitine_R2 Carnitine 1918791.7210 16286112.3900 8180580.0840 9769266.6150 10358603.7600 19053324.2900 23742552.0100 935970.7944 1798725.5860 12472946.6000 3797111.5880 1505210.8710 14147708.6100 24397124.4900 11309595.3400 773676.3837 9390313.4400 27900230.8500 8124107.6820 2646813.6830 10030366.2000 2049678.7310 39392960.3100 13215842 6251352.1530 12628957.7800 2020352.6550 13580587.4000 2218863.3910 2142578.8420 2702736.3240 39347877.8900 2508607.1680 14867791.3300 10371441.4900 4937153.8090 2134249.7130 6257210.8870 10183098.6600 6863742.8290 5733816.4230 5482948.4820 7472524.5200 2888636.4010 18965497.6700 2987384.1080 7246516.8580 974629.7467 15909129.2300 18139669.9400 5418084.5720 15098114.3800 16438812.8900 11743255.2200 2464701.7520 4751036.2690 1625325.7930 22587087.4400 2039169.6100 5355609.2800 6249033.4130 30707293.7100 31732167.5600 8989061.6260 17313947.0500 15555251.9000 12550608.4300 1887168.4040 861940.1786 3423811.3390 8006624.7870 11763369.9000 6272284.7300 5344652.8440 24443128.4500 30703257.7500 12537130.8800 2808737.4410 28962411.3000 5726076.5290 18018999.9200 4538322.4640 8238856.2450 15399066 2831307.8450 5131972.1040 3509442.5260 859585.4194 3652444.5470 2909335.1920 4987085.9640 2140810.7760 18112015.6000 1983801.3260 30978803.3200 13681453.5700 2111358.8190 5215761.7240 12132333.8800 5993659.0370 2138538.2410 4019921.5650 2631991.9840 1057873.7110 2739164.9440 3982882.7670 5594887.1070 2530966.0870 3457384.2090 3311295.6210 12149107.5900 2879549.9680 4225533.6710 2370514.2780 5504843.2070 3914458.9280 6823158.4550 7738849.0260 772218.5766 2325875.4790 1672145.9140 12598798.4300 7767602.3050 33255118.7600 18963685.5200 1821081.3610 688682.0666 21337341.5200 4889166.3000 23361074.9500 7538284.9430 15574274.6000 7775555.8380 24135410.5500 5414492.5110 17980844.5000 1332271.7710 3375514.3740 7624331.6050 17150606.5800 15481120.0100 14012930.0600 2779995.6180 2485793.4400 21249609.4000 11582168.2400 3929435.2850 10481313.5200 28703177.6100 17011870.0300 3014212.2880 2735216.8170 8134738.4470 14632710.5800 9464048.3080 7162418.9720 693570.1518 7727485.8860 6246798.0530 5021435.2600 7223880.9640 22944627.1600 2582391.1100 13348537.6000 17136018.9700 16613301.7400 17187872.6500 15806961.4800 14420162.3100 12807606.7200 11861778.7400 13596317.8600 13035663.8600 12580408.1800 11417778.8300 10168868.5700 10745704.5800 12949094.7300 11638075.6700 11352171.9500 10050348.6800 127144.0320 240389.4582 19278805.4600 18689169.5400 18807085.6200 14751406 15174295.6300 13890318.2400 11744834.4000 12620944.2600 12408012.7700 12993906.9200 12760851.8200 12543469.1400 11890492.8100 11266178.0100 11077177.8900 9905154.8000 9272927.2140 9278134.5480 10939045.4100 11061266.8400 10481322.3000 9565348.6830 9332658.1720 9003984.6030 8771937.0550 8939307.6210 9661518.6760 10591853.6800 9459045.4730 9388523.3220 9321173.1950 8749948.8170 8377142.5970 Carnosine_R1 Carnosine 51520.0286 9520.7310 12701.4875 26351.9260 11195.4515 14571.5639 13372.7952 9666.0612 37916.3285 61548.3758 63742.6732 10607.6890 21042.4330 11268.0526 7945.6455 69997.9680 7790.1381 16833.8153 34416.0492 42054.0274 25506.9102 32661.4053 9177.5650 25142.7171 10937.1299 16005.1612 14725.4362 28889.2227 34275.6030 12186.0298 7020.3394 13169.6475 64593.8474 84597.8416 136142.0798 21819.0209 41493.8720 6550.8165 180479.8989 10803.6282 77308.5560 9754.5405 28126.7245 11009.3541 695684.9786 30385.5532 12789.4056 285429.7302 13851.2100 8229.2788 348795.4520 30078.3768 24508.2825 35958.2155 242636.1941 119714.5569 14239.0102 26236.0964 22335.5956 13184.8077 87665.4988 11469.9623 8523.9745 30986.2776 11873.4710 7265.5451 44856.6308 38817.0133 26246.9015 10346.8734 13031.0552 13131.0591 17282.5297 17011.6177 7371.1858 9927.2760 15302.4576 89214.1289 56441.2044 233172.1949 5344.6027 32930.8516 18253.2929 194219.4293 35845.7685 23050.5745 8792.9705 45013.2087 44693.9067 67671.7911 80384.5793 205952.5054 11821.6306 12061.5060 89855.5887 57234.0378 228210.4231 23824.3112 23652.0646 726437.8927 31861.6041 129223.4480 27813.0083 4648.0078 19284.6552 18762.2801 57521.6084 47452.6047 133285.6638 47852.5392 20937.4021 10074.4436 7728.6274 121828.5580 13025.6083 66484.7974 11533.4554 12998.5639 21121.9170 15264.2345 27431.8685 11665.3086 7009.9379 22891.1417 7137.5691 12310.2788 19798.2072 54734.4059 12610.9822 111309.3800 13862.3150 5558.1339 63589.9388 11301.4486 18427.1482 124843.1358 96943.9258 7504.0518 116550.9046 132189.5644 8380.5641 58980.8649 43280.3287 10741.7853 83601.6780 58939.8075 45269.4400 9512.3751 21545.8439 10953.2963 45506.1444 138033.4061 8687.0024 8239.6743 22656.3641 6818.9036 16991.2814 8600.8183 12192.8012 164310.0809 12830.5983 390658.0128 9898.7183 7483.2223 51180.4842 9644.8386 10169.8724 8674.3989 10064.7884 7790.1532 7863.8274 8145.0644 7055.7586 8417.8593 7814.3703 9682.5819 6298.1655 9318.3430 11169.7849 13235.3677 6910.2079 6590.5916 7473.8629 7230.6506 5873.4238 7348.8346 7279.7009 7876.5129 9379.0011 8510.1049 25860.8408 25944.4960 33227.4887 21454.6853 27360.8137 32434.5668 29584.0550 33492.7378 25187.3634 34101.0137 35561.3819 37307.3707 33722.2334 23195.0033 34006.2859 29014.1758 41656.8211 40389.7570 38040.7888 39552.2017 46591.0768 38760.3892 44894.5649 41925.5617 Carnosine_R2 Carnosine 44986.8684 9155.0356 19936.0685 6082.6246 13946.9622 9201.6565 5910.4059 31114.3260 56982.5086 59224.7566 16638.4069 10612.6967 61059.8630 3919.3307 11766.7012 27056.7053 36179.8370 19677.2668 25035.7448 19723.3421 8110.8001 11246.8474 6994.0506 21251.7380 29056.9601 10005.6687 7403.3698 7908.4652 55637.8293 73854.2325 126741.2528 14820.5014 41006.6179 166140.3079 5077.0475 69668.0231 24590.8063 5820.7153 665666.3045 23031.1607 1455.3733 264741.7406 7267.0915 336583.5206 27232.2882 19343.0876 30075.4497 229214.5874 109162.8796 8107.2112 23467.1864 17718.4700 5666.5227 80000.4013 5809.7417 25850.6148 4512.6568 5144.3318 40441.5105 31163.6774 22236.1578 7269.7842 8399.6402 8206.9175 10412.5697 14161.6427 6735.9868 80775.6632 48086.8320 217145.4504 26330.5382 16019.8973 183308.0608 30080.6137 17572.0244 38137.4568 41070.6266 58886.2333 71540.8145 188742.1181 6955.4812 7998.0338 82936.7446 50223.1177 214539.5011 19874.5311 17382.4166 714055.8369 27919.5880 117441.1392 21279.3461 18317.7772 13789.5870 50024.7861 40436.0147 126342.5304 41879.1936 14823.9815 4938.5028 4235.1411 110189.2821 7742.1538 55605.0080 6738.7261 8217.0007 17119.2180 9635.9435 22167.9862 7145.0343 16893.2295 7013.4989 16240.3479 46748.4085 9367.8970 100358.6511 5840.4561 55478.1973 5868.4726 15390.2154 119826.4552 87743.0433 2527.1945 104764.0480 122557.1028 6453.7169 50223.0513 37041.9094 6091.9307 71821.4208 51071.9270 42695.2991 4631.5770 17547.4215 6636.3340 38903.0829 125395.1806 5585.1492 17237.8279 5503.4235 12673.8563 4756.1346 8152.5474 148583.5733 7478.5424 383288.4258 9392.1717 46520.4316 7605.6153 7483.7336 9560.7039 7098.6388 6267.1709 5099.1124 5463.8351 6311.0424 7828.5026 5209.9612 6816.9115 3817.8596 6799.8258 9978.3370 9758.6358 8427.0182 5100.4000 6818.2676 4419.1927 5541.2302 4161.4919 7367.4807 7751.3565 7128.2346 22406.6613 20540.5142 29014.3628 16058.8795 25727.2682 29668.2562 27985.0171 30684.8463 22894.8736 31152.4317 32256.3222 32735.6862 33934.0794 19884.5494 29869.1386 25287.4985 41577.3192 37699.6851 37509.7556 33314.8256 42871.0363 35759.2490 43459.0866 39051.1791 Choline_R1 Choline 4326475.7100 3431922.2810 2716015.9530 5811819.7730 2355650.6400 2886087.7910 2214358.0890 3171586.9150 2450922.2130 1529163.5120 4195031.4000 3006373.1720 1880987.2470 2390635.2940 3914291.5470 5463850.5440 7291929.6970 1781115.5960 3822948.3410 3351691.0920 3456128.4400 3113804.6120 6034564.9810 2237426.4380 1511254.6730 2511264.0340 3744227.4280 1814864.9000 4511456.7300 2719264.4820 2905203.5350 2792548.2480 1955050.0230 2971355.3360 3609994.6980 1968757.7650 2598574.0960 4168526.0160 3237311.6720 3448551.4480 2844276.0290 3363584.3870 2805098.9440 3313973.8740 5083041.6460 3861923.0880 2839074.7740 2904453.2620 2348889.8700 1513187.1420 2380975.7940 1993986.1660 2068734.7040 1484800.0200 2977762.3780 3683546.4490 2045625.5440 1448471.3810 1824263.7290 6457564.4530 2345360.1980 3130712.4820 1378553.2370 2296632.9560 2769258.0270 2051983.9130 5616623.9650 3367562.1680 2919213.6090 2008587.8330 3288688.5760 3247103.7420 2902277.1800 1169316.2220 4179060.3910 3010987.9410 4189227.0520 3020763.8980 2459167.7350 2288500.3200 2140484.2200 2399631.4030 4002962.0170 3778232.2000 2664053.7590 2654737.1720 2256810.8300 2983511.2130 3198756.4130 2988032.6690 2481154.8950 2713641.1510 1674498.7420 2355327.6620 4716887.7820 1954363.3150 3792609.3080 3977932.9580 3752218.1760 2402576.6560 3033209.1540 4183092.8320 1861046.7550 3515233.7760 1255810.3880 3523079.0770 3770547.8720 10784006.0100 2307710.0510 2968518.8100 1991588.0560 5453383.7280 2657480.4820 2280732.5980 4923492.9090 4315586.3830 1673944.4500 2811605.7250 4600638.1700 2412643.4410 3090046.3690 3938011.5120 2076997.0480 2552770.8700 3954334.7440 4341705.0190 4114813.8380 1694817.8240 2553121.4200 2559679.7780 2854384.6620 2433398.6510 1940781.1070 1523220.3450 3868825.8690 2581604.5590 3874527.1110 2215553.8050 4955132.3230 2174644.3170 1526482.1230 1967376.4350 1916839.5270 2444517.4830 3140492.2420 3799585.3980 3642435.3920 3473748.7160 2039949.6110 1119447.1910 2404878.8110 2764186.2990 2192115.7410 2078810.6130 3462607.1890 1795838.1000 4877175.4860 3048001.0430 2955366.0920 3880945.1720 2322153.2680 1752613.8470 3823301.7980 3184477.1340 5761888.0590 3822118.9460 3841534.8070 3564989.2510 3488794.5760 3092539.9500 2955072.7720 2966528.1830 2797770.6000 2708636.9730 2603847.2980 2490506.9670 2650044.7550 3258077.8770 2986670.8340 2805215.9400 2448737.2210 3813278.9390 3780651.0950 3759777.1670 3477444.3600 3406205.8090 3237299.1620 3052557.0030 2867260.3530 2875955.1290 3089138.0200 3062374.7940 2901003.9650 2704746.0740 2714023.5450 2684192.0320 2707591.6350 2809497.1090 3058007.3100 3357391.8220 3135617.0440 3065717.2930 2981453.1680 2776540.7690 2546471.3240 Choline_R2 Choline 4092614.5120 3268948.8040 2572953.9570 5426885.4380 2228633.9020 2699582.0050 2052427.8900 3002710.8480 2313941.2240 1453427.6450 3942016.5330 2840230.0790 1764364.7860 2258529.5970 3714076.6370 5201519.0850 6908435.2110 1687641.2510 3644837.5990 2964610.9030 3266924.6100 2943988.4190 5713517.9230 2111862.6720 1431272.4590 2394956.4470 3562172.8380 1708725.3990 4258274.6840 2536615.5810 2736190.1830 2637852.9310 1846751.6460 2799014.0200 3416890.5310 1861792.4640 2427189.0600 3955049.6880 3042613.4170 3153305.7560 2696733.6050 3192904.3410 2643894.2290 3156872.3520 4899884.9480 3589495.8750 2702001.3260 2733733.2550 2217659.0940 1412846.8960 2245833.2970 1875978.0600 1930409.2570 1423314.8810 2833782.5040 3486901.2560 1809466.9960 1361750.6190 1747622.4450 6121659.5270 2214752.3590 2974937.5470 1292455.1290 2181825.3300 2625017.5980 1929063.6800 5301101.8450 3197388.1870 2746262.4260 1896494.4300 3102500.4990 3106763.8380 2804744.5790 1117738.2020 4016900.2380 2850040.0140 3950455.9300 2850613.0320 2303806.2270 2161811.9790 2018084.3520 2274577.1850 3773382.6950 3596143.3970 2480511.5310 2537775.2980 2154495.9890 2814982.3760 3032180.1080 2847597.1240 2337504.4640 2572276.5120 1570682.9720 2232607.3670 4444366.7170 1844506.3880 3599351.4300 3797976.1100 3523610.3330 2249028.3860 2891142.7260 3938177.7730 1762975.0700 3324283.5450 1179871.3820 3322609.5850 3586468.2470 9662770.5050 2171013.1340 2809480.2190 1884644.5830 2478916.8080 2517952.9770 2151454.5680 4673816.6890 4046395.3520 1589386.3010 2676592.6940 4336553.9320 2299947.7290 2903439.7320 3807356.3420 1966579.2830 2392505.5660 3740041.3180 4072869.5380 3870831.5210 1599253.7560 2397611.8760 2431336.0260 2701156.6260 2329922.5290 1824968.1540 1434429.8100 3677032.3200 2432296.0500 3608000.4050 2104663.1400 4688025.9180 2049117.6580 1441996.9710 1851333.0850 1813691.3600 2298937.1930 2904617.3110 3572044.9910 3442387.2630 3243443.6990 1917714.3090 1057997.2150 2266565.2080 2609284.1550 2066836.0180 1958991.6140 3281176.6180 1684139.4090 4750558.4740 2828592.2740 2792755.7550 3685285.1280 2190917.6390 1636803.7560 3606276.3650 3020041.6090 5421538.0160 3687534.5720 3724872.9190 3437570.1140 3368360.8440 2992323.2880 2835074.8990 2844612.6030 2688946.3840 2595198.0690 2518144.8020 2386502.6600 2552171.7360 3128470.4720 2868752.1040 2689651.1800 2352854.0880 20313.0419 20932.7412 4846205.6970 4542726.0580 4560990.7500 3490355.1430 3529097.2190 3310988.2750 3251610.7730 3508896.4290 3442902.8980 3613313.3350 3580999.0440 3563438.2800 3294206.5770 3218041.2250 3063523.6660 2879680.9140 2716121.5330 2708325.9640 2904301.8860 2892679.2990 2739025.3960 2560985.7860 2573491.6660 2521049.8020 2551434.3770 2636071.5490 2916860.2320 3164885.1370 2952969.1990 2882444.5540 2800421.2590 2614266.1730 2393595 cis-4-hydroxy-D-proline cis-4-Hydroxy-D-proline 9281.2718 47406.4348 238.8815 3634.6591 53494.7605 27600.5612 25746.5746 31491.8933 31632.7237 53998.6313 153768.9282 16210.8759 19039.9437 36347.7789 29053.6281 85418.9545 32752.0081 3472.1085 55356.3996 29457.9829 29724.8213 28800.5872 5641.9858 10868.7589 53757.9176 16858.4126 8456.9720 37356.0886 90106.0695 53469.7976 53854.4560 64273.8480 21176.2343 64676.3963 17774.3404 97026.8823 36195.1572 42190.0612 83991.6403 6246.2751 37745.3152 68635.0916 23090.7934 54187.4127 102437.3766 102761.5889 16442.0167 118562.8738 31237.3298 36641.4497 44505.0870 112607.3188 100840.8060 20183.2745 25912.0814 59660.5995 132933.1035 10118.1673 5802.6486 54197.2560 33764.1815 44024.5847 2162.7678 20551.7636 41979.1613 29770.7520 60036.6574 44250.3170 39754.2349 2741.9933 29175.1984 51908.7737 13673.4224 57122.0819 1943.8970 20541.8474 42458.2111 1920.3860 30426.4621 25712.1962 25411.4713 23001.2091 27453.0581 22506.7336 28341.9399 20385.9792 20700.5427 21071.1460 7992.0333 3952.0426 8706.6371 6996.3560 19822.1092 2746.1109 2469.9407 16673.9249 Citrulline_R1 Citrulline 784952.2112 3089085.2410 996872.2595 1024525.9700 868548.3911 926682.2037 677765.7562 848102.7684 797387.4603 896747.5340 998943.4043 1273599.0900 1096848.8810 1721265.0850 757709.6781 1295347.7630 644247.4536 954470.1000 947920.7668 629902.3265 565583.3049 1036989.4670 608263.5393 677798.5258 1374700.8410 781331.7965 1506362.2660 608894.5058 701082.7030 1244779.4120 704230.2453 1041478.3330 1016117.6230 677103.9369 695866.1123 815781.9926 897792.3668 1596180.0520 542322.6473 1763700.9540 1757733.9310 949439.3335 945180.5523 863807.2014 906106.5944 834585.2499 1003199.9480 507141.5353 719179.3585 1526132.1310 684304.8798 721083.0526 815247.0723 928697.5116 743766.7401 607178.6887 1032052.8630 1435097.7510 1225907.9730 731729.2973 675051.7642 1257574.7160 1055734.4120 497551.2684 1187445.5140 1091883.3010 1067507.6170 558388.4640 751895.1924 1146113.5450 1001767.8170 1624656.6680 1855051.2640 721644.8652 2426816.0450 1201003.7730 988823.7006 767712.9561 636503.4748 522267.9333 1876689.0190 1119730.4700 852185.4645 994759.5820 713278.4596 789891.2279 673000.1525 869455.4656 676327.6208 821987.5767 820640.1746 679566.2185 589032.8339 729351.0642 609197.2042 893773.4804 834471.4971 629491.8633 860650.5644 1127024.7930 729696.6437 737776.0122 734790.4378 929017.6983 583375.1040 1280947.8400 717305.1605 1238088.6180 796539.4793 740859.4556 1201653.5700 719054.3037 897344.5647 1227733.9970 1284139.5520 893154.1151 1395654.0030 1071893.0070 916424.1974 1250986.1920 497929.6483 948186.0027 1643316.7700 796108.4539 1058270.1820 716819.9724 847529.7346 717636.6530 565208.3136 698178.6102 755717.8009 538122.4223 847403.2617 1373707.4880 728351.7765 803056.4867 746642.7621 627589.2344 1033185.0070 826831.1592 520625.4528 847787.5795 615100.8375 751104.5983 1671444.8330 673902.8925 729739.7467 717025.7958 1422476.6800 840372.4862 425938.8432 547290.3013 1770338.5330 1024043.4020 549952.1271 820866.6664 1024986.7130 1656671.0580 948877.6121 1152608.4720 1163684.1890 830775.7129 1193595.1750 2491196.2020 872524.7536 1319665.2040 1340247.2450 1323070.9450 1171996.6570 1155713.3010 1080255.5020 1252431.6250 1135769.5720 1158592.6680 1022058.4660 940306.4537 983176.2392 1251813.1480 1123120.6790 1086371.3640 995946.7036 1099994.2860 1131446.8460 1196885.3260 1096709.0200 1213503.0510 1126207.9080 1015460.5260 1001590.7660 1047486.6100 915794.3514 929285.0435 931900.5981 872065.4505 924975.0522 936921.9615 907335.2810 891101.2870 874478.7826 1044755.2370 1043330.8200 1001522.6650 979638.6694 838861.4007 903561.1734 868415.0551 983631.6498 1049388.3250 1049444.9100 977433.0417 984792.0939 934982.2582 971852.0197 880906.3136 Citrulline_R2 Citrulline 789749.0125 3133134.5200 1011838.3500 653730.8290 628419.8435 887342.2774 631818.7980 581276.2508 541090.4632 886377.1327 997256.0827 1325882.4420 775305.1559 1766606.0280 755979.7537 1193505.0570 675211.6020 968101.4813 1007426.8160 622089.7823 583281.6985 535671.1156 615673.0707 648129.1831 989625.7319 672462.2075 1560843.2150 460984.8577 755067.3843 1266418.9630 662652.4450 1030832.3150 780510.6912 640786.8420 663863.5420 785207.7780 861929.3036 1620960.2230 568727.8462 1823772.6930 1776020.3530 988997.2709 908584.1390 840612.6204 891829.6150 776625.7127 938928.7660 492536.2962 645676.4818 1560744.2520 502679.1926 814176.7030 833490.7010 886668.2363 699532.5171 435618.9870 1077479.2210 1062429.1290 746945.3660 512242.3475 530999.7799 1246332.6650 677037.9902 421489.0073 1192144.2420 1096784.8600 1009811.0430 523805.2283 651899.1568 1132763.1790 727414.1153 1187177.3110 1898806.3330 709510.1857 2454605.5520 1213827.4010 983647.7849 715824.5791 430863.3946 541559.4425 1417412.2190 1109005.7350 868059.5163 1002377.3680 489760.4859 528220.4390 639718.6148 802793.6487 634701.2442 795615.9686 563987.2297 632180.3898 564822.0113 681162.9632 627389.3229 596835.2896 679773.1308 606941.2372 634989.8839 736205.5068 516273.1263 761470.6426 648658.5348 975515.1815 616079.5459 1322756.8390 667296.8759 1281947.8920 545445.9638 655659.5615 1173654.7690 776938.8361 942478.0226 1242800.7150 1266957.6650 929453.7594 1410846.7020 1109763.5280 906570.6140 931267.1439 481423.1002 930843.1469 1156752.5190 832090.6775 1120601.4210 688541.2737 606857.1726 637747.9415 575271.4565 456113.4213 697501.6239 515212.1622 858680.6594 981366.9870 410201.8579 715076.7907 342176.2078 612922.3542 1060911.2670 582548.2549 452657.2425 803511.0040 550153.2380 734525.7400 1668892.7780 656365.3090 621365.1642 735384.8317 1470650.0900 863061.0625 242629.3825 498777.0016 1227711.1370 735165.6859 557198.1539 832713.1655 1017109.0500 1755434.1710 1003761.7100 799504.1272 840271.6277 573722.3862 877906.6695 1942040.7710 712504.1522 1324367.5020 1323036.0470 1311579.8650 1206992.4640 1122113.6540 1035681.5310 1198265.8280 1140673.7610 1103199.8030 1010491.3290 929818.7075 933095.7728 1184637.4680 1060662.5120 771539.1892 980984.8954 1118078.6950 1112301.2190 1177302.5880 1099970.3510 1177390.1530 1121683.0940 1003089.4240 966939.0221 999068.0262 907991.3224 906550.9243 963431.3367 880031.6901 915296.5875 915734.7833 855179.7653 852471.5800 827930.4100 730735.4402 1032960.9200 1014160.0430 967912.3098 591735.6285 908504.6603 595352.4290 966103.9600 716367.9469 1019747.5530 962237.1099 969759.8092 937631.5372 637055.3175 607287.4548 Cortisol Cortisol 10676.6443 29854.0413 14801.7132 23902.6964 17899.4483 10677.4613 13057.9325 17961.9130 19480.4712 23161.6458 12509.1039 8543.9779 17041.1240 15766.1374 13398.1457 22785.4290 8810.0228 13376.9094 9705.2091 23089.2327 25840.7147 18623.0167 30008.1306 15745.3667 20473.8274 11583.7418 22922.2156 32941.7525 17390.6591 17715.8759 30588.4177 6461.1678 14188.6791 17413.4953 8547.5820 11924.8726 7880.2439 17698.1845 6720.4962 24502.3549 21573.5817 13637.3607 11589.0082 21371.6198 10318.3886 15898.4722 13340.3630 8512.9626 20449.8476 11929.2494 18282.2866 33012.5584 10204.5888 8568.3240 16684.6050 19769.4921 14286.7490 16107.2242 24012.4671 9763.6048 15606.1194 24418.9700 7299.2267 14495.2649 20348.3806 27035.5762 11639.0831 17889.6181 13151.2039 18875.0488 14487.6663 16506.6016 22281.4579 12765.0694 22004.6146 21338.0017 16580.8305 16122.2363 20595.7544 9900.0933 14124.0190 30002.8786 21797.9166 15117.7704 14229.3634 18911.0419 25721.6201 13500.8714 9776.0830 19511.1051 20044.7039 9541.5898 17358.1428 22071.1968 26109.3388 18431.3561 29110.5974 13881.4178 17865.4699 10083.2175 12734.3309 17572.8747 18972.2729 16889.3811 11812.8500 19061.1684 17854.3755 21851.8450 7680.0433 16230.6122 11486.7260 5805.6348 10251.1838 18418.9241 24341.5255 12518.3093 15041.1417 25354.7948 11508.0804 21443.8894 27619.3494 14675.3203 11731.3860 25336.1938 16674.8909 19821.0259 12421.0499 21475.1406 10937.6763 18063.2543 22746.7412 8379.5002 21878.8526 15405.7171 29224.7505 16210.8699 15430.9452 18507.2984 13593.0183 20678.5412 14555.4823 18707.5156 25640.0615 6718.5833 18759.2451 8375.2245 9830.3072 13602.9888 13034.9695 9095.3619 21017.2628 18430.8003 20334.1164 16925.8682 19825.1407 9084.4683 24151.3139 24240.4620 7849.9320 27272.0150 13913.2080 19432.1218 21546.9349 32899.8951 13117.4748 12478.6973 14654.8770 19719.1773 10178.3031 13887.6437 6650.1853 12076.3012 11661.2295 22398.9955 7179.2665 8286.2796 23302.2099 21925.2996 20223.9402 20080.0805 15807.1179 23046.0622 14487.8656 21630.8021 16365.2970 12429.0947 15901.6645 14026.0022 17859.4959 16319.3927 10795.3931 18911.2502 21982.7702 15519.3824 19366.9825 19881.1279 21589.6205 9864.2880 15318.4356 10971.1699 17649.5854 17866.0405 14803.3630 14688.6072 17775.5567 19488.9898 13477.0680 15243.3812 18965.5672 24491.0692 13546.8962 13896.3768 17404.9169 9821.3554 Cortisol 21-Acetate Cortisol 21-acetate 26058.3065 3035.9879 16969.6247 5274.5267 1412.1318 11261.6874 11372.3448 6999.4343 7649.4151 6053.3213 3659.7313 12156.5544 9461.9692 5075.3863 2032.3187 2596.8857 8864.3928 7184.2625 7888.9647 2336.1475 15447.5356 4842.7022 1630.1148 7239.2476 3825.4207 2047.5568 7434.4888 6409.3486 3864.1789 10339.6456 11429.2020 3040.7665 5805.5920 8987.8833 6863.4083 22999.3416 23082.4383 21271.4554 18935.0195 8220.5878 3725.6701 1260.0460 12835.6245 9698.8578 16397.8983 11063.9276 3024.2623 1441.1960 4164.9163 3659.5533 1239.9212 5484.4416 6807.0757 11510.5222 3968.3518 2960.9207 8126.5323 1296.0106 4139.2482 3906.4258 6990.1308 7323.3707 8528.7589 7113.4973 11016.9943 11044.6263 4926.8517 3359.2424 3101.0407 15271.2756 4631.9197 17290.9792 6072.6843 2321.8404 6599.0013 4513.4359 18682.2127 4846.5666 19096.3904 6128.2823 1771.4688 7824.7955 16763.7263 3875.2907 12211.5954 1692.8844 7885.0529 3281.4326 2064.2960 10358.8100 11173.8803 3190.4879 2195.0675 8577.5371 3660.7130 2808.3327 9319.4100 4080.2240 6534.3074 28557.1187 1523.7690 911.5682 2366.1307 2092.3659 3782.7220 6248.0058 2252.2935 7839.3012 6283.2168 9952.2024 4556.7548 2438.9713 9883.5764 6383.0575 18126.8838 18169.9515 18992.8964 16315.3361 11560.3653 12531.6987 13271.9972 17043.8719 13481.2105 6170.0718 7886.0155 12656.1174 12854.3938 10221.6085 11363.2606 12937.0942 9567.3380 8621.0322 6036.4065 3940.9320 10836.5719 3857.0287 11044.1970 9731.1181 13647.3300 6739.3176 Cortisone Cortisone 8079.1874 27687.6416 7835.5778 11253.8255 13229.6401 11524.0150 5390.4996 8520.7922 20917.0485 15510.3492 9136.3520 5507.0963 11028.0370 9961.5286 9400.5957 10667.3756 2508.4430 5274.4944 5009.1119 9411.0913 7137.0429 19805.2866 7998.9919 8930.1737 10944.7269 4012.3620 12858.0707 6303.7917 16142.0388 11563.0418 20789.0124 5598.1244 7543.4544 13782.3703 4417.9071 9697.9593 11139.4771 12121.4835 6684.6121 20537.8179 9106.5326 5694.7995 8962.2536 11148.5443 10974.5117 4885.4930 13827.6542 2029.1040 7329.3643 6721.8858 8604.0917 17338.9736 7580.2040 16941.8724 16087.0869 11249.9880 21219.7480 7453.3672 15660.0977 5785.1753 11777.9900 13050.0207 6187.2404 23155.8726 10501.3360 14257.2340 8860.8741 9026.8991 9936.3812 8529.6713 12510.1242 7952.4750 20023.2699 3705.3334 28113.9009 12309.3797 9748.3927 11036.1465 11447.3073 6937.0657 5740.0930 12460.8049 10519.9735 6831.3479 9873.7967 12233.8034 7639.6885 13144.2213 12807.3333 5291.7297 11383.0249 8795.6968 16967.0571 9449.0567 5456.2931 28932.0298 8855.9968 6878.1067 9000.8804 8163.1545 10176.8898 8297.2387 14063.5973 5321.5004 9360.4943 14729.9020 18269.5670 13027.4473 4016.6304 13211.3514 7757.2405 4039.8275 17632.7746 22413.7734 8178.3755 9531.1341 9058.4995 23486.3223 715.4527 9041.1328 16421.7387 7584.3786 12710.0343 11333.3611 7308.7204 20334.1584 12559.8032 23414.9714 10055.4567 10455.4754 9265.4665 6546.7931 7000.0063 9373.1674 12328.0007 11590.8584 16772.2831 9310.3237 7804.2380 15814.5205 14914.1378 15225.9831 15187.7951 8318.3226 17085.8950 12874.9863 12025.8801 6711.0818 6996.4979 7463.1434 16991.8142 18223.2771 4413.1018 10559.8530 16042.4025 8445.3210 15039.7892 13530.3984 12480.1461 14740.0563 19930.8020 13727.4089 6582.2631 28950.4690 16301.0464 24602.2336 24020.8296 21618.1303 24833.9357 17704.8295 21077.3648 14135.9737 11758.9297 7990.7168 13671.3306 13191.6793 18714.4153 17222.7658 12067.1089 18428.3382 16960.4395 13156.3665 13556.1575 12889.6925 8877.3564 14422.9915 13436.1030 14056.1542 1906.0593 6442.5351 13679.6127 14726.6407 10776.6858 9071.6689 11075.1376 9741.1375 6302.6085 12883.5402 6876.4305 12937.1583 10052.0865 11705.4407 8624.3106 10501.7909 4563.6884 26277.1162 16806.4393 11621.1117 11141.2807 13983.3545 9806.4831 25825.9996 22497.5244 Cotinine Cotinine 44626.1879 3994.6088 4623.6160 28866.9917 620011.5467 690181.8355 740433.1384 775796.8445 647082.5343 602326.2403 626465.3675 623347.7669 659521.6169 626599.1327 579267.0941 643184.0094 779818.6505 682637.8086 594041.8947 527278.2147 2462410.8740 2243523.7830 2460807.4070 2061209.5700 2174317.4740 2063672.5670 1984436.3960 2163091.0700 2164570.2010 Cotinine N-oxide Cotinine N-oxide 388512.0034 316022.0151 372356.9096 387549.2994 282341.2808 288326.3479 274782.4429 239269.1935 262615.4716 283130.0125 213622.7729 272192.1450 241103.0445 237470.1607 213131.7016 267552.6020 1153158.4470 904321.0348 1216263.8020 785700.6705 894462.1546 816549.5850 814778.4820 777055.0551 784729.6558 Creatinine Creatinine 109942873.8000 140875986.8000 123778347.5000 150279436.2000 107316226.5000 137580529 93871736.6600 124226403 110164093.1000 91624338.5100 108138888 106017519.1000 104924889.7000 137465233.4000 119246843.6000 116327556.7000 113831715.6000 119746195.2000 107897030.6000 133702929.3000 139176512.5000 121506597.3000 153217626.8000 103284714 121243310.2000 149795776 106946941.6000 166376716 134979342.6000 124647198.3000 128200618.6000 109136810.7000 105654571.1000 90182549.3400 103426421.8000 106381319.5000 98676214.9000 134425174.2000 96735668.5300 166334102 114184135.7000 105811628.6000 144098958.1000 111903787.2000 98013843.4300 116811913.4000 118328528.8000 96327652.6300 130940517.5000 110249369 120237601.9000 178221576.4000 105551624.1000 97831417.7400 116613959.2000 128721068 154505972.3000 126749323.3000 119543590.1000 112862488.4000 117972532.4000 127092517.1000 152818891.8000 107598391 98902668.1800 115909941.8000 114559016.5000 124769712 104597316.5000 136871479.5000 93395042.0500 162394402.6000 133310385 101956262.8000 137621290 135630876.5000 115694991.2000 104905690.8000 155824858.7000 102639988.3000 114774333.4000 138277689.6000 108653304.6000 118847451.6000 119792255.2000 152813861 141338386.1000 114639522.8000 98207399.0100 176511948.1000 131912072.8000 110304983 139707239.9000 105885431.4000 142398156.8000 104668747.7000 125841429.1000 124268463.1000 145296071 107718504.6000 142127108.4000 118441998.1000 110694746.9000 152656390.4000 103071380.1000 134065630.5000 131839430.4000 158657054.7000 98515057.9500 135632221.6000 109699125.2000 92286020.4400 87164284.6100 99475763.6000 149056503.1000 108787274.6000 124737124.4000 146745396.9000 118573517.4000 115170832.1000 112420626 115003032.8000 106398829.4000 118604367.5000 153948212.8000 141779344.8000 112829238.7000 118167488 87886028.7300 143399145.7000 132383604.6000 97233914.4900 130755353.3000 121086911.4000 107135212.7000 120990391.2000 82585160.3800 139979547 116654372 100026411.6000 127634966.9000 104743403.1000 116006912.3000 117692840.7000 115988744.8000 114616275.2000 103412968.9000 146626603.5000 132138448.9000 143210652.2000 112333723.2000 104985427.2000 109308532.9000 110601217.9000 137812371.5000 90154074.7600 123045471.8000 122232179.5000 120192553.2000 146423059 97420268.2200 131237420.8000 127213107.6000 139971710.9000 97517260.4800 154485121.7000 155853957.7000 153791843.3000 151052963.2000 143641449.2000 142177666.1000 154011252.1000 149598587.7000 147536214.2000 143320451.7000 137358509.6000 141044577.4000 147132200.6000 144619428 139432459.3000 140916775.4000 155820040.2000 153319475 156179055.3000 154763552.8000 155639453.7000 152846352.6000 142471545 145589681.8000 145679047.1000 122836205.3000 123109138.3000 127526986.5000 120419431.6000 119425603.5000 117582298.4000 115902384.3000 116412264.9000 118880702.6000 129111366 130354187.3000 127138954.4000 124357797 118532426.8000 121834726 120122278.7000 120581538.7000 125272313 123216123.3000 116879726.7000 118121032.3000 116924894.1000 116729380.2000 117628155.8000 Cyclic AMP 3',5' cyclic AMP 187221.4961 383645.7926 207835.6819 360405.1180 263948.3679 355669.0116 187966.5942 328267.2699 334478.3409 217867.3082 186776.1734 138906.3838 164923.3686 300852.2690 276521.1542 265712.0599 177669.3654 207471.0077 213674.1283 365486.2482 341995.7673 367089.5714 386561.9599 189973.5857 216933.1969 381011.1890 164942.1426 437945.7031 362734.0526 206210.4571 287338.6053 192271.3626 210875.4201 187337.6199 163647.8122 256037.3485 189011.6801 249816.4902 182931.0962 475054.0789 186268.5577 188057.2489 251069.3056 280211.8701 137465.4220 286068.6531 274207.1358 237531.1949 277041.7015 207048.8000 249329.4498 458180.8505 171686.9713 264903.1785 313535.6972 321775.4739 328952.5136 228127.4806 307405.8060 195857.9788 304309.4147 209908.6463 209148.5609 200252.5233 149156.0503 195075.0606 275544.3838 328472.2360 162576.0829 338162.7023 155235.3338 311604.0123 299962.5785 166199.8653 243786.5017 301869.4061 231717.5751 238069.1329 332050.8026 142625.0148 149127.4590 217752.2288 236987.5548 143219.0868 243767.6969 388081.9375 280842.7925 190689.8901 228862.4331 467004.4158 408198.8389 288114.0274 280453.8205 188680.1412 440706.2298 229501.5130 276340.5190 281888.2625 176836.0006 250270.7330 286315.9621 230093.4987 209703.5655 240895.7926 179461.8624 345813.3206 271622.2499 478743.1242 257719.1099 289474.6931 184866.1030 177670.1529 109328.0365 177765.8410 415653.8833 178569.3809 236209.4398 382891.4815 290928.4491 215727.4293 220830.6115 227185.7240 206080.4292 199236.6658 311211.6763 324893.9273 272056.1264 191648.6793 143521.2631 319554.4641 296231.2138 184163.7387 254700.0069 175838.3942 210154.4969 274037.6895 271734.3028 271693.8068 192216.0468 257032.9074 227302.7827 218711.1145 344760.8662 347168.5112 244978.2178 199904.2578 236305.3720 267071.7213 217298.2999 243688.4086 259067.9038 275941.9614 210437.9675 201995.0449 314456.4481 170669.4083 218627.3002 314422.0090 182224.5510 332098.3458 132563.2546 232716.9385 331431.7519 327473.1967 283195.2404 76419.3983 75299.3430 87059.0616 90389.6045 74757.6901 71385.4903 77167.7325 71788.2111 70158.1945 68313.4118 61381.5057 63498.8037 77063.2407 75976.3131 69185.3872 70597.6759 2709.0991 291013.7117 274352.9691 283291.8881 276443.3785 295706.5212 280299.0948 267260.6642 268692.3465 273819.8744 281976.0951 271704.5065 274755.1596 303992.6172 273243.9416 274654.8880 240807.8296 228258.5472 242211.9992 291432.5395 291178.5805 252166.7240 251579.2229 238824.7547 234324.5154 229511.9052 246791.6062 257167.6143 279945.8185 267379.0211 260754.6188 246189.6049 236348.5620 231919.7589 Cyclic AMP (Adenosine 3^_5^-cyclic monophosphate) 3',5' cyclic AMP 189960.1293 396645.9160 215592.4365 371485.8545 269088.7541 364353.8344 191673.5945 337499.2160 347169.9489 223335.1365 195336.7417 144988.8713 167190.1889 313112.2929 284608.4252 266531.9511 180783.0552 210900.4694 221352.3349 372338.2899 345399.6949 375867.2167 399541.7203 190683.6790 215428.8042 394131.4006 165874.9953 450180.0607 374644.2539 209704.7686 293510.8540 196370.9517 219263.9998 190932.1947 166725.9378 262778.7349 191756.3189 260179.1344 190537.3762 481805.5280 190254.9455 196607.8564 261001.7889 282189.1012 139357.0895 295304.4342 288053.3805 243014.0235 282256.2058 210426.7290 258491.9513 467331.6274 177749.1239 273586.6459 318346.9764 329336.0318 339878.0175 235563.6967 313378.0237 197105.4040 317107.9254 213600.6663 210833.4953 204242.0444 153624.4932 201073.4271 283459.3943 333472.5418 167032.3099 343446.9488 160624.4805 321403.4240 306334.8339 169009.4864 251833.1899 306186.4180 240192.1969 239849.4656 342395.9028 143113.8559 156459.2882 221199.9225 242117.0952 146144.8383 248383.0307 399781.5905 286305.9787 196439.0674 229306.9477 476233.0030 426236.9758 296490.8008 292889.0235 196099.2794 453348.2146 230654.2813 288243.9769 286414.3245 180828.4650 256249.6674 293346.8102 230764.6246 211522.5890 246162.1390 186865.2902 357170.4793 277700.4035 497523.1555 263206.0883 297289.5037 186837.8733 184855.8135 112460.9707 182056.1438 427101.9013 184117.9042 239024.4487 310017.8928 296710.7660 219437.8456 222840.0420 235333.1297 210278.2383 201736.5345 320882.2269 338269.5964 278506.9863 194265.4957 148748.0830 328218.5211 306613.4934 187390.5507 256924.9215 180606.3374 214301.8862 279188.8238 279423.6896 280017.5748 195491.7613 263182.1594 233092.9549 226675.3110 352833.7723 361161.9293 249062.1826 203083.0127 238703.1313 272763.4938 226796.7960 247487.4540 262914.0685 280794.1058 217884.4067 209909.4915 319253.0620 170736.0156 224245.5999 321851.8412 185568.4941 337108.6703 133090.0579 241302.4896 338905.2695 335933.8461 293372.1140 76131.7114 74334.5303 87716.1520 80475.8554 66920.7679 66508.9671 78664.5368 72786.9740 70371.4939 69296.8292 62936.3710 64185.2590 80435.5192 77784.1480 70231.8499 65126.5212 296353.4841 282061.3381 285296.4078 281824.2672 302001.5585 287256.5634 276774.3829 274831.3049 283977.7837 283755.3885 273550.4909 279909.0823 306715.7901 279016.6708 285938.3297 246432.3671 238405.9123 243791.3747 302520.4642 292190.5748 263770.3016 254850.0733 248362.7205 239203.5692 240473.4671 246110.3605 262610.4463 288082.0694 271844.3217 265754.3597 251866.9226 243407.2336 243212.4916 Cyclic GMP_R1 3',5' cyclic GMP 48383.5361 61906.1490 44639.1741 123206.8998 78575.1134 76763.9492 62324.5480 131989.4721 65269.3408 66776.1289 78613.3192 41032.1258 58451.0927 82628.7251 71066.6667 62387.3685 62429.7148 46598.7128 70630.9715 100473.4141 98335.9394 82479.9169 103685.3354 53208.0471 38596.7354 78938.1447 59389.9832 71130.2220 82242.9001 50828.5569 133741.5063 61389.5306 38585.9657 50819.3223 56192.7159 51030.8404 57199.5160 59227.6215 71542.9950 64363.4615 80731.9366 56219.8844 65216.6939 149234.1590 58854.3226 57937.0961 54902.2015 43679.2689 71412.6171 45264.4174 129072.6969 89705.9320 83319.3274 45183.7410 94672.3953 51709.8613 55055.0658 84325.5505 94872.3802 54091.4393 69419.8832 46245.0054 50904.2494 54839.9939 54194.3847 68757.4099 59206.7377 111310.4417 63352.9673 49841.7730 51700.0954 85473.9964 64572.0064 73580.4390 85453.4174 60605.1668 63924.9305 64664.4752 60439.2008 64816.6529 37695.2498 70720.9312 53877.6945 51856.7208 76194.7159 78685.4427 90163.8020 71126.0098 55454.2245 64930.8964 85136.6833 95171.5101 67809.1798 62003.3283 83733.9829 59147.4034 52180.6713 83376.4486 80547.6901 103723.9870 64495.2099 110404.2951 76113.2876 64232.2934 76453.3461 100461.9226 60075.5719 82107.0251 63272.5487 82630.5166 63449.0247 55631.8121 46778.8704 56757.0733 53092.1275 75886.8429 44838.2226 173070.6559 80625.2546 55580.3487 90331.5304 55656.9262 55361.7289 82571.9753 82380.1938 94523.2527 77982.4089 60481.2778 51500.3589 69458.9999 93157.7447 39986.8959 78848.5387 60311.4311 59309.3906 57953.2547 54613.1859 88025.3003 75206.7500 78402.8550 57945.2502 55282.6566 119753.4268 77466.7837 83580.2377 61962.3168 57542.9087 123562.0103 51536.9753 53631.7698 85780.6439 62350.3630 52806.2818 70879.2656 95371.9799 50853.7861 58227.5290 65984.8308 49907.3435 87229.5738 40354.4525 47239.6951 64107.7868 49792.1893 79105.6993 52232.1295 51875.3183 53809.1895 50709.5285 46243.2089 40112.2190 49265.9297 44667.7491 43486.6330 40273.4346 40186.2342 38590.9597 43849.1784 43493.3229 38425.3971 35774.7705 65202.0303 65629.9729 66665.9046 64017.1411 66150.8959 61963.3137 56615.6804 59790.9990 61294.5578 75917.6680 75345.4148 74869.6900 73598.1306 77190.5636 69430.5601 65642.3332 63829.9197 64145.2262 80629.0223 81010.2802 73328.9693 71646.5285 64192.7954 72131.6174 65359.7009 67667.3612 71374.3997 79277.1916 69731.5006 73704.4118 68106.8816 66634.8357 61647.2254 Cyclic GMP_R2 3',5' cyclic GMP 42175.8276 51606.2840 36606.3792 112618.9917 63612.3780 68210.2020 52797.3109 121173.3786 57129.2455 59031.6581 63450.6500 34167.8967 52944.8889 73409.6819 64584.6760 54559.4424 55879.6259 41313.2534 57439.7602 91447.4458 88508.0267 72674.9917 95929.5513 47286.1735 31864.7526 72090.1511 51565.5655 65491.3143 75045.9543 43831.1310 123999.9593 54537.9111 30573.4630 44863.6322 48567.9213 45873.0584 50439.1688 50162.4051 58745.7410 56752.9707 70996.8138 46644.8762 58062.4045 138514.2819 45910.9025 51999.3463 48940.6854 38002.2635 63484.2240 38304.0519 116986.4550 81725.3922 75963.8150 39350.2295 82512.7706 46758.5893 49788.1933 77319.0164 85061.2584 43737.9821 62242.1831 41581.1866 45058.5609 46463.9326 44778.2478 56627.8023 51494.3352 99775.3159 55035.5743 43998.0893 45106.1805 75569.4133 56474.1969 66288.0890 78002.4211 54332.3300 54579.4697 55707.2867 54820.0022 53600.0394 33265.4521 63691.7170 43516.5203 42472.1639 66475.0777 71826.7213 83826.9205 63302.0925 47050.1452 58274.4455 76942.3753 84925.0950 58343.2878 55488.4092 77973.0535 50192.3579 44000.3800 72305.1037 73161.4878 92323.4027 57037.4867 97399.1781 67272.8232 58804.1525 69336.9695 90610.0790 52285.8991 73501.6687 53840.5515 75318.9709 55490.5833 47847.5986 38470.5286 49027.8808 48003.7127 63088.6540 36981.4713 160702.0457 66892.7072 47783.7069 77894.7456 49580.3313 46250.2817 73596.9920 75547.0902 81425.8450 64340.2764 53113.0770 43247.5458 60810.7729 84354.9174 33340.7493 71799.5827 49886.7833 52204.3688 52437.2933 46562.8639 81599.0208 65378.0012 70471.5367 51016.2541 46200.8003 109609.6463 71149.9348 74129.7274 50294.8491 50573.1259 115549.2901 42550.5945 47317.1302 78649.4196 51297.1219 44484.9367 58756.9913 86631.6965 43802.4521 47063.2890 60931.5601 43169.5550 77472.4480 32209.0048 41090.0581 57103.1120 44069.3958 69942.8070 45080.5023 43552.9249 47146.2733 43571.2880 40780.1025 35140.0017 41777.5718 37486.5055 37863.9039 34155.3364 32885.3217 31580.8277 38431.2027 36478.3575 33165.0537 31104.8371 57185.6547 57498.6638 57891.5329 55707.7069 57548.5395 53803.8027 49519.5178 52706.3578 54582.1998 65870.9488 65652.3437 65816.0816 64296.2522 68156.7268 60472.6730 56987.1017 56940.8903 55902.0508 71565.8648 71340.8313 64151.4063 63407.4730 54763.7208 64239.3314 57577.8706 59773.4624 62316.8092 69893.8986 61557.2543 65761.5691 60702.4779 59132.6398 54210.0745 Cystathionine Cystathionine 3943.3320 1579.2151 3529.6347 1525.0101 2649.4794 4375.5671 6927.1084 1977.7085 3264.7601 4557.4332 13758.9695 3247.0488 4534.5069 4604.9720 5559.8273 4056.6811 3206.7005 6131.4154 6927.0791 5450.6007 6253.9815 5829.9081 5924.3512 4474.4574 6004.4966 4979.0080 2839.6091 Cytidine 2^_3^-Cyclic Phosphate_R1 2',3' cyclic CMP 3783.2042 4311.1437 34872.3969 3251.1258 36529.5358 38046.3080 36506.7799 37438.1531 34338.2387 33937.5609 32199.3995 31794.2300 36852.4222 34791.0091 32765.5333 31700.3824 39000.6255 35019.3702 33898.6506 33192.6124 2868.0484 2039.1673 2195.4220 2333.9691 2724.8651 2692.7479 2551.8549 2023.7628 2292.6628 Cytidine 2^_3^-Cyclic Phosphate_R2 2',3' cyclic CMP 1140.2948 3847.7402 1408.0507 1893.3330 1755.3613 1778.5426 1274.6598 2546.1407 1135.9348 1148.5643 2156.6069 3299.0451 2959.1638 651.8753 1433.0372 1519.5982 30796.0618 2441.1917 1655.7614 30596.2447 31825.7956 32703.0814 30304.6276 27685.0323 26819.6398 25188.6935 26167.8510 28692.2866 26547.2827 25727.8537 24924.4853 31445.0497 28790.1007 27644.1467 25466.2654 1196.7808 1464.7686 1193.6068 1194.0680 1066.0807 1378.5483 1437.6331 1013.7857 1722.7913 Cytidine_R1 Cytidine 115207.0190 68326.0981 39332.3699 17174.4247 78355.8722 35430.9535 395271.9001 39866.0128 17032.6092 13323.1044 15689.4322 18149.0379 14523.0550 14960.1800 19265.5337 11833.2669 17018.3499 15364.5066 16298.2256 17938.6733 18149.3125 15145.3383 13784.1480 14532.1883 44853.4852 49628.5667 47326.9629 38344.2455 51594.2884 37390.9698 47952.9380 46596.1709 43320.8721 27663.7473 26869.6788 33348.9936 30978.3544 34358.2487 29675.0942 31621.2783 24931.6993 25531.0398 29166.2890 31171.5753 29456.9363 25689.8822 29662.7091 31229.7703 28882.9572 32050.4005 35837.9752 31151.1396 36311.1380 33964.2878 34222.1139 33177.8114 33661.7452 Cytidine_R2 Cytidine 19255.5251 41295.0214 11855.3902 16654.4199 25025.3982 17732.7320 20414.2091 9945.1706 23708.4467 20303.2804 45538.9174 18860.2419 8359.3053 24501.2272 5290.4080 5302.2446 17635.9026 59894.0389 6864.6975 10813.9201 12154.0970 8556.0050 11607.4657 12881.5720 21311.2541 2888.5607 10412.1536 7241.4512 6764.6849 12071.2679 10447.1527 10218.3697 15776.7064 23306.5959 10664.0393 14665.3278 81303.4925 69753.6402 33078.4099 21008.1206 14071.3701 19312.5583 9278.0606 16412.2061 16618.7570 15985.2586 31298.3279 9943.4426 44553.7071 12057.5589 12833.2959 44181.5959 16066.0178 9013.6687 30840.3509 9357.2057 11206.2345 20865.0104 17821.8858 33322.6761 50562.5769 15203.3807 47429.4564 17066.7257 10528.0717 12426.8562 11289.1956 10374.7040 5920.6699 10990.3810 5244.3528 16353.3691 12461.1658 10302.3060 21304.3092 3425.2614 25946.6703 6931.2421 26717.6974 9180.4713 13224.1840 42474.8469 10542.5046 8486.6367 8300.9457 31537.4802 13244.0171 6941.2632 29220.8659 43580.3076 17760.6113 17353.1279 9925.9878 18398.1559 13341.8209 19214.0596 33757.8503 59269.2701 9927.7668 15560.8145 42470.2345 40113.3774 6509.2116 43219.4170 13665.8778 313295.6092 19435.0281 4462.3887 4573.2401 12432.1009 24662.6298 19035.6629 7954.2898 11704.3907 22522.2877 10274.9122 22733.7266 16580.7401 22428.3518 8696.6037 28694.3001 37594.9224 13272.4055 14325.7621 18124.4823 23568.8736 12474.4958 8478.6856 28441.1310 19969.0935 14378.5102 18225.4292 10113.5901 19119.6663 13293.6862 18392.6508 11436.4119 9792.8916 13451.8241 41728.8294 29280.3328 12879.8677 4718.3810 13393.3130 34822.2868 22007.2652 29945.8120 16616.5042 27389.4231 20825.8334 15279.6842 15603.5577 15027.6622 1820.3522 11136.1784 12850.0253 13095.3577 8251.1830 13969.6632 5791.3174 5609.6203 9860.4035 19157.6951 12062.3851 10685.3312 12543.0907 8014.9827 2322.8203 24074.5669 18019.7182 26691.7784 24374.7543 26742.2669 21333.3753 29814.9215 28866.0043 23878.4350 17244.9908 18065.9898 24365.7847 20457.5728 18523.9662 17248.7828 20014.0081 18094.4433 16914.8387 21003.0566 14590.6106 19166.2075 18530.3552 15237.0983 18127.8007 18780.3168 16469.4253 22438.4751 23223.7537 22607.1051 20935.6953 25657.6967 19754.1568 19261.4448 Cytosine Cytosine 644282.8031 172681.7228 144805.5616 247735.5756 453832.1173 244381.2980 136029.6832 133923.1912 168377.3323 230659.9995 275590.0494 201330.9156 248600.2398 126575.8445 156361.7830 114855.8076 130242.1933 156820.1773 1076477.4710 181807.7236 184514.0710 262017.0875 178935.7273 385650.0156 144721.0981 413491.7143 109459.4346 323776.1986 194868.3604 84579.5980 1459817.1470 272121.3357 106100.2088 286732.1974 183223.8224 2954.1749 399376.2023 171338.8651 312667.1545 190791.2067 316017.7746 173308.3703 198611.2708 243021.8509 154649.9091 126336.2670 192925.1641 81220.3256 233284.5448 349929.8463 163249.8942 352014.0504 115711.1843 208346.4797 177571.7622 167452.9664 196934.9486 85208.3858 328760.5025 159668.5495 115100.8672 216926.3991 192668.4428 103493.2462 191360.5840 530453.8260 235028.6506 118439.9650 144954.7367 146805.6011 90727.8455 192845.4429 610539.6660 97194.5211 117483.7564 190626.7608 185067.0321 168112.8323 143294.9528 430961.0842 127311.6070 138122.2948 82936.7588 565334.3652 412620.4172 441470.4468 580129.5229 152145.3830 141075.4307 176940.7783 127691.1135 163455.6435 125403.5166 246897.8169 155007.7594 194569.1117 166271.1025 180970.3148 201226.0510 364542.8491 451713.4545 333226.1567 93824.4992 192782.1274 90363.3090 364070.0019 535671.7398 548385.5498 173991.1512 133310.7779 242663.6827 232327.5193 79595.1228 1223602.6930 140599.6015 241747.2206 146931.5760 208432.9743 234018.9851 102258.7674 120611.2607 246932.9256 432581.2779 291389.6443 95887.5596 165101.7035 230796.4902 78488.8730 181265.6210 1196719.0030 133122.8554 69991.1885 383612.1381 429523.4206 153416.8418 148087.9646 145442.8747 569957.9194 333716.0667 100387.5417 106929.0146 211379.9222 310717.5022 124129.8488 190788.7328 220561.5176 152967.8463 152833.1237 464670.5847 350848.7681 136319.8720 160082.3467 438359.5186 518685.0615 186760.7508 75218.2868 227049.9899 414324.7489 807441.7177 215343.0624 198637.9193 127214.9829 336906.8445 89815.0798 205424.0393 537129.8833 528169.3131 502729.1111 471497.4291 440205.7417 388098.1704 427764.8817 395756.3955 365153.0810 347127.1267 301855.8635 309123.8670 425348.8046 401009.0837 363060.0984 346722.3259 557795.9394 565690.4933 574535.6237 452679.0869 461007.8975 454170.8404 411537.4713 396935.1642 421760.9600 297494.4281 305785.9846 307166.0204 269003.8271 272420.0387 285206.9500 248268.6467 249161.7927 225527.3289 263484.9649 262856.5088 249973.8198 223414.7711 196873.5453 217691.2169 199703.4399 214085.6787 240404.3356 279896.5027 246954.1869 247677.1324 232466.2451 237358.4077 219259.5727 Deoxycarnitine_R1 3-Dehydroxycarnitine 414020.3919 1067431.0560 423863.9970 513714.8614 533428.7110 593438.0619 1149200.8370 253561.1061 234853.8300 1524307.5230 297228.1338 185168.3389 378653.7432 809798.4708 885252.3713 194440.3685 275553.0633 1525161.5930 685892.1032 487034.2947 545114.5710 290634.3101 1788819.2110 1489141.0140 331273.5889 701134.7943 274122.9489 438993.5140 459701.0689 249403.5080 231695.0081 1418518.1050 187946.9355 664203.7978 420574.5923 250478.4804 415406.5718 283501.6654 649513.4044 1015099.9240 817864.5294 361438.9487 356423.0077 245604.7116 829877.6551 184351.3267 268401.6842 466308.3827 627900.6984 928559.2270 423487.7135 495020.3008 1306141.1000 716882.0530 276261.8246 263107.8846 192747.7515 1024233.8200 166079.5361 337343.9576 622038.0333 843390.9670 901310.5970 873401.4372 595759.5641 566523.5856 674941.3574 322504.3247 359971.5689 415200.3262 405466.0315 430228.4566 1083547.4230 146953.9681 2239122.3390 1464467.7600 553350.0841 261138.6486 685174.4432 238430.4464 644551.6076 332119.7727 280948.8200 627981.3979 246047.0916 722649.4341 480482.5525 395034.7311 670316.2534 348185.9787 230730.0152 261795.9952 2019721.1800 769977.0838 626587.1061 423999.2136 286575.3639 270501.8890 678049.9355 377811.1542 317747.1049 1101079.4170 176669.5354 186389.4405 149605.0025 665583.7395 317008.6702 786868.7414 272999.5090 296473.3827 676122.2995 322308.6185 272367.3551 311522.5417 465427.9253 271756.0207 351455.8951 933037.9665 119626.3414 141804.2657 136554.1663 480133.0111 308819.3183 1125220.3380 696275.1887 511578.6087 126351.2063 642632.4992 522148.9079 819273.3824 473461.1462 3332714.4120 220215.4509 685117.9358 201515.7425 604018.9053 231884.7752 475313.1458 483285.1668 400731.1083 1884379.3460 467533.1269 1394777.3190 761483.9666 1171017.2690 592796.2023 649341.8717 520733.7428 986186.0028 1139956.1080 280442.9786 903447.2295 317991.9618 504586.6748 504619.9960 320545.0872 246328.0258 937546.1427 426438.6904 303311.6203 456189.2765 1266631.2940 195871.6177 586117.8342 738099.8088 2429436.4610 2277811.6200 2189917.4530 2245296.4940 1846687.1760 1793550.6780 1769154.8490 1643827.3990 1694908.8150 1710881.2760 1637574.8610 1749515.1250 1863183.5360 1815140.2330 1611733.9960 1438675.2190 622607.0344 619140.6778 616353.7882 571363.4584 582990.9021 575398.2536 525839.9665 484125.8772 493811.2692 502985.8220 535335.5053 457011.3093 492244.3935 504185.4170 495022.0472 490660.3429 537071.5851 569696.9985 470688.6141 452874.3367 455726.7390 471105.0633 418020.1680 413772.7143 Deoxycarnitine_R2 3-Dehydroxycarnitine 271937.8847 921199.3318 334298.1408 436557.2272 509639.4446 966227.4948 162157.0499 141065.6984 512155.7799 182777.4487 142514.5804 305411.1038 700002.5065 760463.3344 144440.5110 211576.5072 1329773.7490 363319.6228 455258.4068 223203.4006 1561401.9590 1318284.3830 245109.0734 562090.0551 141276.1078 344721.4424 343978.2244 148154.3941 187841.2239 1253678.7050 124406.1338 541975.3526 302071.1331 173314.8484 393655.5079 242223.6532 528995.5544 889044.4616 677904.8164 241526.6201 262947.6597 191310.4396 802265.8529 159337.8157 180558.7969 328717.4498 530152.5398 822774.0157 331165.6326 386877.5512 1146982.7540 516792.6730 182888.0806 209357.0242 92718.8220 859291.5404 110628.5358 227878.5182 491730.4769 686304.0571 750793.4362 235275.4614 498610.5015 476554.8898 556845.6790 214693.6855 268704.8347 278141.3706 295118.9166 415254.6657 923552.5091 97036.8545 1989352.3740 1323053.6550 410444.8752 150143.0211 558279.0594 169237.3690 543913.9551 205484.4033 220799.5269 500023.9432 133155.8343 585781.1050 356686.7326 244945.5991 552162.3164 249094.6706 138545.9140 174516.4510 1792682.8340 635501.7261 490750.7984 335286.1436 178701.6719 217485.4781 537701.1220 326859.1076 240573.9109 937872.2791 117711.5352 111459.2337 99270.6949 517093.7679 259303.1554 640621.2123 162275.5350 192697.4078 519051.0058 251425.3197 161331.3460 170537.5307 443324.8571 170185.7827 287628.9048 770201.0308 113917.2084 91377.5987 91379.1235 382082.1500 244289.9015 956668.0935 607013.0797 358920.4982 110346.4125 514492.0399 385997.9720 684231.6473 340592.6076 2937625.5510 178673.0425 521801.5109 134754.7355 556823.5170 169036.9070 340512.9825 336437.6600 367430.2398 1650024.2150 350794.3720 1295195.5790 686192.2445 1034918.4010 554788.5825 525121.3449 395109.2321 901381.9114 958560.7576 183229.4077 758856.0578 236946.6928 440524.2131 440020.0348 262528.5976 169399.5860 836260.9961 350896.2328 251565.0927 380770.5435 1090154.2610 160680.9645 550649.4982 634054.0358 2153646.4250 2014339.0500 1928635.4660 1971763.4280 1603072.9970 1587448.2260 1519344.9850 1472374.5550 1506342.7510 1448208.7650 1403933.6600 1493165.8470 1665297.2020 1612987.3190 1416020.9490 1242233.6260 846772.0007 810532.2739 807774.6506 586692.0562 585606.5644 566793.6650 616553.4244 604648.3825 629287.6218 599738.0442 557250.4182 557275.1319 531629.4326 552005.4579 520103.2690 474309.9066 444106.8806 448290.8182 439668.5317 438503.5263 407911.6806 439581.9111 435568.9931 430978.3410 436636.8257 460501.6138 486316.7036 470568.3489 444678.5434 446559.1669 444828.1734 384372.7333 362365.3410 Deoxycytidine_R1 Deoxycytidine 27859.0391 26073.3435 38480.8347 13128.8630 18812.7007 31130.7906 22879.0806 12490.3914 11531.9733 32835.7005 45179.1706 20197.1233 31571.6556 51177.4733 26360.7117 60759.4787 12648.7944 17262.0445 24165.9431 29944.4810 51239.2994 8794.2633 22336.8897 17704.9930 31835.4127 27601.3735 29305.2323 38983.4550 42213.4794 22777.6209 31554.0743 14988.1219 30508.2035 28725.4434 40290.2158 74395.6932 14765.7661 18991.7956 21721.3858 47071.4374 60728.7728 9548.7045 34724.6982 35810.9118 78620.3358 19892.2801 13885.0795 44953.8039 30410.6794 10177.0260 79370.0320 36768.7470 19013.6508 14528.0352 48692.1269 120496.4990 21988.3122 16166.2181 30863.3030 9460.1636 24593.7534 37233.3994 22735.1082 33770.8139 18107.5994 13835.1365 19892.8757 30789.5056 18698.7876 27342.6639 32352.3018 31443.4567 23123.7635 21268.8361 20529.6140 26692.4827 22006.7859 20497.9041 32184.5843 58148.5139 23269.7237 21239.5443 21461.4915 41564.0319 16213.7280 19790.7217 19370.0690 18638.3330 31576.5163 73613.1220 15089.4502 42130.6906 15819.0994 11855.0274 40786.9619 32785.3545 28677.9712 39799.1576 34772.0520 37416.3495 21781.4480 31160.5940 34166.4939 37428.6008 16111.4916 22116.5766 73455.3733 23573.5940 31130.3675 28758.9346 30071.7775 6943.7410 19297.1760 15027.5974 33544.7248 53416.9590 34846.4262 51896.9568 12312.5610 40770.4877 65555.8998 23963.6302 16893.5434 14431.1080 14530.1469 23030.9019 15980.1240 29680.1502 17998.7876 81203.0721 30101.8240 10012.0429 66532.2236 37334.1176 32925.3249 24150.3119 25066.8329 21873.0572 24507.4336 63651.3077 10910.9928 44391.4101 21865.0563 38613.9547 30575.1073 40484.5241 33402.6228 25038.3856 39845.7803 23256.8406 15339.9824 19750.1071 23422.6924 21001.3783 26025.2120 16898.4387 24152.2199 19394.3265 22357.0473 42646.4243 27673.8894 28433.3293 25012.8647 41085.6058 17024.3488 44188.4972 32457.5849 20165.9961 26075.8480 21599.4126 17771.6482 63672.1667 14843.1326 17242.1516 18882.6062 18736.7002 17307.1299 32800.8474 21656.5241 29602.8250 16149.2250 2534.6462 19768.0270 34983.9745 27662.9295 16580.0323 23295.7128 28418.5376 22288.9571 16802.8981 23382.8197 22552.8297 21706.3984 20470.1930 30022.4053 31279.1611 30098.2474 27645.6518 16439.2937 28183.8389 28904.4384 24884.8316 22325.5700 26915.2116 27411.9360 24095.5821 30777.5885 25789.0756 32354.7449 21859.6442 30448.7815 22182.9289 21784.3997 24487.7032 Deoxycytidine_R2 Deoxycytidine 26607.5415 18408.9884 27400.2014 21411.1944 13790.7188 28864.0295 40593.1686 14225.4682 25407.4636 42650.2446 17759.1448 31069.9255 46011.8725 18522.0830 65758.7851 20966.5311 18754.6968 17580.7091 37875.1007 22703.2424 15667.7713 41794.6000 21642.7367 27718.4554 38715.0185 44170.3086 20334.5291 37213.4457 13519.2101 23327.4855 30820.4531 35587.4172 73648.4417 19185.6664 25259.1999 30730.7179 42096.3964 61901.8886 14629.6307 32776.6847 62173.6988 74278.2196 21174.3702 17091.2379 35469.8745 29405.4123 15680.0383 85412.6468 44848.6906 26889.8807 15370.8147 40963.0897 108994.9008 39833.6587 11787.1137 21530.5727 11269.8068 26940.7084 35318.4908 23506.8787 36352.1275 18184.5881 16514.9096 48091.2322 30787.2779 16643.4124 25692.0529 20613.1715 28498.7711 27202.0864 27881.5100 21670.0156 22167.4004 18417.3354 17656.2073 36564.1301 71686.0570 18918.3336 24842.0569 20917.2775 41004.0739 12176.1046 29546.0891 23613.2052 13068.9576 30055.2891 71004.6716 17111.4278 32488.5502 24976.8772 17260.2578 38742.4118 28732.3323 21140.5317 22650.6563 39965.4681 34951.3418 20132.8893 30894.3111 39728.7924 29844.4867 22850.0089 19592.2328 59893.5458 21102.8528 19889.4136 21325.4339 20733.7628 19373.5421 14325.4773 30757.4514 53240.7175 42788.5164 29978.3609 21385.9912 15786.5210 69527.0592 30417.7265 20299.6834 19155.1135 27957.5556 25622.2073 35759.8522 13768.5717 90558.2496 26214.2828 12408.5088 82061.1442 38737.4434 27715.1700 19587.5346 24714.8300 22883.5111 28397.4835 58639.0801 19450.7535 29932.0100 31205.3618 28591.7133 39985.0597 30340.7308 33191.0673 37144.1129 27087.2767 15677.1528 23665.6308 21691.6511 17119.1333 33797.8331 16715.6227 22294.9331 23005.0677 24353.4268 36911.6479 27994.2702 22513.9096 20300.9897 43198.8503 14594.6457 21279.6362 21052.7442 24823.6883 17657.5716 19273.6266 16331.7435 19757.4583 15307.0559 17282.7108 17054.7929 16615.4986 15830.1010 20100.4641 15150.3588 18109.2381 18112.6864 26198.1960 26784.9491 27989.7806 22761.9920 23465.2561 22601.7486 25581.8403 27292.7741 24951.4650 28646.5608 34974.2552 29422.9384 24521.3489 25807.7566 31776.4800 33576.1555 26322.7105 23092.6884 27131.9714 26022.1270 30638.7856 25933.8432 24846.9662 26080.2141 25841.4260 30385.5550 34439.2166 30538.2506 28367.1472 29218.0779 25180.7664 23627.5615 26579.9672 D-Glucuronolactone Glucuronolactone 13124.9185 12285.9928 8588.9450 9938.2216 25606.6587 14368.6508 17059.3239 13627.6195 11140.1571 9615.5262 7354.6305 6412.5928 10441.0614 8110.3470 11821.7501 13653.4345 18553.3722 8348.4444 10402.5929 9976.2181 15629.6345 19182.4024 11625.1641 23756.3025 8113.5182 8031.1790 8627.4128 16134.0224 8877.3406 13689.8571 9051.8474 8862.7836 16483.2067 15132.4114 15659.6864 23740.3347 13512.5055 14006.6879 6164.6098 21980.6717 14322.1059 12040.1562 11120.2457 11463.7309 10952.3028 24906.8604 8003.7855 18176.1648 19744.2024 9228.1043 17105.4726 13541.6827 10304.2852 12761.9771 24928.2386 21130.7920 13705.9946 12451.7997 22157.6793 7221.0541 31513.2144 18550.4492 10117.6003 14696.0019 19199.0800 17245.8674 22648.9705 14660.2273 15320.9013 8279.0789 18966.8034 17592.6350 11039.8385 13129.9234 12273.7198 19566.7068 12133.9719 11938.0566 7579.3208 13550.5424 14579.5237 15597.5364 17797.0677 7833.6450 15922.8316 7945.0033 13555.3419 12284.5969 18487.6613 10701.1000 15797.1725 26481.9966 8155.2433 13255.5432 16628.0765 15125.4649 12133.1012 15942.6082 12456.5375 6960.4759 20814.5473 12393.3957 16965.5397 14233.4961 13926.2720 13549.7857 31254.5011 4811.2479 11905.4898 15234.7951 11436.9533 11742.4918 14368.3949 13815.9920 16151.3822 10297.3016 8982.4257 17327.5103 7557.4182 11956.2106 11251.6380 11116.6048 10338.8453 14764.0754 19093.8142 7509.2825 9222.8905 16259.4958 11112.5643 9622.1975 24765.2100 26732.0576 10634.1465 15631.4418 12004.3162 14888.7808 19463.0080 13830.8371 9323.6792 11765.0979 11897.7370 16639.3269 20771.8920 15855.7671 16373.2592 25127.3361 17051.2272 13999.6417 10883.6020 10544.9477 10361.5712 18672.2793 16232.4485 15867.5522 12802.6444 11173.7345 10223.0096 11356.4000 12786.6994 15894.1305 13366.6812 13889.9835 20431.8063 12695.9346 12024.3863 7244.6244 6107.5251 1514.1371 3500.5964 3814.7659 5161.9293 5746.3290 5059.2291 4730.1129 5218.9797 4534.6354 5091.2845 6885.6781 3261.2112 14294.5761 16850.4527 14054.2364 10414.2510 Diethanolamine Diethanolamine 25638.7761 17618.4459 23788.8742 30946.6081 18923.1905 27628.8847 23595.7680 17350.9422 17597.7794 43392.9099 23131.1521 17092.1790 17212.6322 19478.7447 22553.4336 27386.8381 21395.3556 38813.5472 22531.0029 47247.1314 25983.8705 38557.8827 31263.6565 21011.8129 16757.6577 26984.4417 44486.8529 20628.0022 64070.9404 26536.2797 27973.8531 23635.9682 21424.2809 25499.9560 24261.2197 12070.2011 26182.8606 28802.5880 26934.0240 26769.9149 45650.7838 41158.3976 36508.2377 17705.6930 22034.5991 24951.9105 26484.0989 17351.5234 19815.9170 57367.3781 28838.6679 26468.8359 41442.1242 18278.6328 20864.7423 19911.6383 24824.0389 21618.5300 27882.7472 32058.5829 33650.6330 24389.6067 259992.4306 12746.7699 16053.7027 22860.6074 18360.2976 10467.6500 17788.5894 21851.1490 18352.3909 22293.2295 25953.6260 24431.5876 16610.8039 19629.1971 29301.7985 19449.8076 25603.1406 17993.4852 22868.6637 32976.7369 24007.1641 16775.9343 19063.0321 23049.2331 15771.6768 32663.1111 23991.8875 23742.3893 31841.7673 21475.8748 30695.0359 24116.6336 28712.8300 19181.2363 24768.4097 22734.0129 23993.6122 18156.4689 78654.2018 29103.5840 18947.8674 25637.9758 20404.7134 140048.4746 23629.3188 33955.2345 29627.6883 35647.1433 23086.0789 20702.7390 21720.3489 27646.7352 35810.6780 16789.6108 18200.2554 22636.5142 33849.8182 23169.1782 16486.0479 18248.9729 20558.0541 17681.3753 17949.2723 45236.4658 41510.1739 23816.9251 20057.0486 36284.9019 21295.5515 23090.4211 39400.6729 23086.3056 25465.1524 36089.1561 25832.5762 15569.3407 26393.7150 21822.0060 25132.8739 18912.3094 38719.0314 17825.8822 19588.1136 30009.6821 23884.9941 32160.0176 24109.4629 23163.8049 17572.3523 17004.7632 20138.4674 23379.3892 28187.7993 15693.2661 26595.1555 80900.3398 17406.9178 23360.7862 21832.0752 20389.3432 30837.0533 19746.0484 23519.6971 17181.9087 23544.2419 12514.6847 13443.3295 13003.7849 11597.4290 12511.3708 14735.3692 10945.0804 12977.9909 15240.8439 15607.8141 14721.7626 17363.5325 14357.2656 12876.4669 23695.3883 16432.2472 25064.2853 24983.8965 19337.8631 26721.0650 17726.5995 19450.2010 23320.7278 21493.4618 21271.2584 19269.3911 22937.8832 19196.0247 17842.8127 20055.9140 21513.1167 16038.9600 24621.9164 24916.6261 21594.8134 27460.4144 22409.2132 22790.5320 26319.5466 21768.1911 30658.9481 24357.8749 20460.7683 20969.7315 18414.1453 25274.3060 24931.2699 Dihydrobiopterin_R1 4a-Carbinolamine tetrahydrobiopterin 830576.8262 1052541.9130 806368.2575 950142.2087 789645.7875 1390939.7850 472895.3890 1553065.9560 615484.5351 338564.3108 1248831.7000 613654.0695 678785.4883 1004590.0280 880380.7048 1352813.0200 451674.4842 860881.7062 1171596.6920 1028743.1750 1412833.2280 1316357.2500 1393790.4560 790152.7581 501649.7649 940364.0902 1392977.5620 1677256.7330 1561947.3890 496424.2992 1293565.2290 852547.9981 712143.0159 593125.8634 483898.5726 790464.2982 962892.5583 285014.7175 880704.8613 1548657.5830 1124362.8200 1034261.6590 1016102.0700 1266288.4380 624608.9392 780654.1461 640709.0692 599675.7628 1103194.0800 549257.9308 931046.5124 1895875.3670 789437.4237 397213.1304 953174.2296 1575620.6030 1114205.7810 720655.2761 892955.1346 352221.4849 1211079.2020 675196.7865 367790.1182 680450.9403 743788.7551 884358.5020 780008.5968 868044.6538 695201.7487 1323703.4850 974976.5839 955562.2461 1188585.6810 379219.4976 854110.3780 693162.1809 1127342.8840 545309.2621 1800767.5170 940784.9048 1149749.3840 991444.2152 835105.0416 788771.4365 1093456.7760 822654.3376 1134270.9350 970590.1393 499615.4049 1708949.3370 1019302.7470 991417.0546 982208.5863 933511.5249 2028789.8410 532697.3614 951041.8750 1052495.6520 364402.2435 1056302.2990 1060679.6800 1256614.8710 686428.9289 606362.4368 457979.9482 2091475.5170 880613.4108 1895991.1630 557065.5130 1045616.1460 1164955.4290 951466.9828 450346.8414 683334.5007 984996.0352 1095140.6280 648372.4884 2176581.9480 1418142.8000 285862.4216 875173.7868 513727.5249 1583908.9030 1017137.7080 912143.4976 605156.0824 1559954.8930 812768.9910 508801.8986 903061.3657 1304948.0320 612897.8715 1281470.3680 659782.3197 666562.1749 1011760.8430 647661.4726 1151175.8970 1239069.7900 804235.4902 671347.3148 472283.1293 783838.2827 669674.3564 1000459.9310 1289841.6800 490977.0171 1354746.0840 1247422.8950 397398.5024 720836.3699 1097787.8020 1495589.5550 700206.6916 1312355.3770 661814.8371 909350.5919 925427.5803 281267.8123 2172046.5720 582112.7250 979124.1324 1165013.1550 1259707.1860 1003708.8980 545512.4886 534576.3208 494939.0295 487453.0291 383068.5479 390244.3416 453859.4154 457408.0655 396464.5393 386246.9746 291004.1886 354186.1709 416431.8923 386953.5213 384398.6757 401654.6706 1507985.7710 1450878.3640 1624337.4200 1310932.3510 1261774.9510 1201783.5910 1196841.3230 1138557.1660 1190289.3030 894435.7466 994718.6069 1041512.8530 855241.2904 1056508.5130 943520.0720 779842.4776 608246.3501 762211.8540 927498.3012 1067191.5550 961687.8886 964949.3684 851693.6899 950088.1348 783193.1890 939746.6639 939058.5883 1009783.4010 908971.4313 985442.7473 994475.8698 860084.2135 892668.4219 Dihydrobiopterin_R2 4a-Carbinolamine tetrahydrobiopterin 711923.0479 863618.9852 711743.1649 813193.8536 661182.7421 1204270.4670 430622.6207 1427076.2660 512227.5697 371930.0997 1079066.0880 548501.8241 628299.2389 891229.1414 873050.7658 1267661.2670 367674.4530 691893.7195 1072503.2300 928223.8121 1249516.1590 1202128.4940 1277012.1800 695818.9285 538114.8112 862434.2436 1137049.1810 1515026.1730 1502450.3590 437836.5431 1147114.8910 735967.4807 569079.1636 507687.1683 394446.7606 740734.1571 805360.4386 237951.3881 758682.2268 1422769.6050 1014072.4220 917702.4648 836576.5499 1147662.5190 593429.8865 684602.6694 594020.4747 521997.0002 979244.7628 494460.3173 748966.8092 1671927.9860 674316.2756 412342.1512 846839.6260 1376560.0500 1025177.4220 581305.7723 792500.6542 403693.5509 1067667.4610 556329.0187 309725.1735 590094.5782 655677.9598 725755.8101 682468.7186 714916.0216 593954.2577 1239536.5310 869196.7699 872554.2360 1048506.3820 330150.9715 783125.8921 614125.7306 1009089.9600 488905.8470 1646990.3550 791052.5589 960329.0793 853748.8911 678558.4065 681846.6032 954448.8163 761869.0738 1022885.2420 824026.4296 445176.9633 1527510.1500 881863.3416 906026.1287 886828.5674 808962.2473 1854765.7400 417054.2737 861980.2107 998505.2662 299880.4865 910888.8893 1016341.4500 1103081.6610 577272.8975 527429.1836 372638.2977 1944153.2350 719582.7476 1756848.7670 459674.2748 953536.7497 990274.0473 855897.8798 319724.9108 573288.8615 998557.4467 1003190.7170 691484.0197 2017773.4470 1279138.2230 263409.0403 773251.0615 461663.9837 1444578.5560 884861.9489 827533.7020 614729.9283 1347482.9540 734225.5589 423235.6847 795717.6902 1161442.8780 533513.0845 1174100.0520 516645.9652 527071.9831 899005.6059 557977.7808 1021568.2340 1057498.8380 604084.4505 649405.4500 398981.8916 694140.1355 602433.1021 840229.5037 1157867.0280 437765.2391 1201240.3270 1093403.1980 327528.7734 672424.5616 960907.3606 1329658.8810 695307.0653 1186136.1500 508595.8114 777362.3916 807589.3630 229399.8436 1994761.6940 502562.3400 842221.5798 991399.5956 1122443.1900 887673.0882 441819.5181 429101.9635 428273.6533 439519.0035 341225.4717 316203.7240 385151.4108 374855.8572 355394.5473 344186.1475 299217.8579 329291.9169 345699.9579 333819.2769 333165.4714 306464.1425 1290540.5580 1281093.8250 1325698.4830 1080673.7040 1125179.7130 1034914.8730 1056832.2070 1046195.3500 1049985.5850 886698.9249 858513.8428 878270.5204 746269.1856 935653.1078 811760.8498 698917.0641 614008.6991 652977.0944 922514.2318 919498.0090 851598.2363 825781.1916 702195.3868 828504.8037 728094.1863 809523.9363 827312.6420 845838.3688 772726.5202 857663.7100 870390.0532 777185.1034 773112.9495 Dihydrouracil_R1 Dihydrouracil 11372.2599 11304.5850 8511.3748 22480.8105 14194.0634 16852.7358 11387.8395 15441.2772 9206.9903 13141.1705 17675.5921 10569.1589 7950.5640 11509.1218 13165.5510 14325.6121 10923.6659 13708.0888 4578.8568 14927.3331 8128.2085 10245.6572 17981.3314 8243.9607 9652.7538 15284.2460 12847.2889 19507.6664 6630.8696 13124.2009 11735.8820 8274.6920 10847.2176 9438.9685 16989.1686 6218.6691 10075.3253 19086.9732 5302.9113 13732.8119 13458.9925 12736.9807 15102.8204 11378.7317 5285.0290 11201.7540 17308.8060 8049.2308 7601.1224 11006.9412 11131.0448 20979.7642 8344.9378 8009.7427 11029.3268 17659.9951 16643.2378 15339.8116 12092.4747 10826.7273 17714.6928 20690.0935 13411.8306 8744.8171 7115.0876 9949.2086 6866.4828 4403.8155 7966.6886 8973.0265 7167.3992 11243.2912 20228.9869 9246.6747 13701.2128 5475.6611 11036.0739 9463.3954 13275.5632 7497.1074 10355.8450 19617.5049 12540.8816 10705.8113 11419.6392 17759.9017 15038.3357 13156.7602 8620.8887 13769.6393 17455.3063 6922.3365 12530.7601 11304.6173 18733.6840 8444.3404 16052.8452 3968.8426 20308.0199 12879.6025 16427.5932 13054.2861 11115.0392 14245.2856 6063.2503 9404.8249 9449.9519 28861.0013 8440.6724 15276.9524 17738.6036 7490.1684 5072.3393 8660.1557 14074.0820 18896.8651 10335.4956 6945.3422 8764.2045 11943.8481 6530.1951 12232.9944 8637.3200 15552.7566 13622.6133 14988.1351 11501.4817 11785.9786 8062.1186 14417.0426 14981.5377 9278.7938 12778.1395 11338.5503 19290.1941 17229.6291 11160.8093 16119.7993 11833.3246 11905.4342 9363.2507 9659.4888 11377.4793 9149.4908 7857.5346 9280.2215 6944.3376 16535.4398 12999.1382 10590.1660 16355.9705 6987.8647 9842.6007 10419.2190 10242.3055 14031.4224 6488.0544 15457.2472 5632.9337 8575.0610 6960.0300 12489.0357 14789.8755 15904.7004 8657.9458 16896.7980 16390.7139 13216.9986 6591.0361 7446.4733 7977.9464 16155.9258 9596.3426 17582.2310 14365.0274 13833.8645 15312.2220 15638.3949 17804.9561 12584.2927 10593.6311 8419.9957 9687.7531 11398.2785 12489.7206 13627.9094 12425.2747 10516.0028 10329.5965 10564.7870 10137.4108 8269.2942 10958.8774 5874.3715 6694.4915 6265.9310 10254.6051 10440.6649 10172.6657 14073.5799 15368.6407 12215.4627 14866.7780 12020.0059 13346.7746 12249.7528 15464.3033 14786.2981 8385.1669 12861.6969 9868.0987 13532.2229 11968.9630 13042.1460 Dihydrouracil_R2 Dihydrouracil 11707.6594 5722.9828 17521.7754 13887.8844 15877.2694 9419.3205 9986.7621 6890.7770 10698.6575 14988.1101 9882.8347 10492.0391 13261.5602 10288.0442 12495.3244 7587.7645 14618.7657 8720.2323 13388.3625 12503.9880 18762.5559 11466.4273 9245.4533 7249.4399 8369.4428 14941.8750 8433.9697 6882.2915 19424.4208 6878.1206 8000.4988 9784.3592 13440.0979 6819.8455 11330.9800 15298.2326 7369.3196 9193.8284 8655.6741 9776.1731 18306.1811 6672.4302 10199.1138 14912.5578 12594.2552 14205.5878 11599.4134 9035.2328 14692.5067 19375.9438 9623.2837 5890.9057 10935.3867 5559.1487 7472.0988 6443.8772 10149.0148 8697.3714 10930.4066 19490.6069 8185.9933 9931.3326 9510.5248 7940.1247 12608.8502 5284.7408 7158.4570 17631.6759 12358.5064 11383.2770 14018.8420 14412.6170 10734.8949 5836.0124 13483.7011 17958.2980 7715.1051 9598.2365 11035.1742 17367.4490 6265.9363 12770.2886 19606.1986 10958.5115 13707.1950 10291.1832 7080.1389 16428.3819 26622.7488 6847.5681 13593.9476 17105.2599 4038.9641 8552.0346 11331.8792 17983.8077 9537.6900 7626.2507 6410.9712 12881.5137 9813.4453 11696.5589 12264.8322 9194.8705 5506.7974 11598.7958 14555.2449 7768.5878 10428.9837 11358.1028 13664.3266 8184.7588 8410.4843 15337.4427 11439.6305 8947.1802 11302.3985 10582.8005 7322.6264 14650.1501 10775.7911 10643.1584 8335.1727 7362.4930 11003.0529 15616.8186 7795.6572 9355.8995 5665.5283 7287.0148 13807.3711 5965.2780 12105.4012 10910.8687 9997.2048 9818.4404 11752.1473 9410.2667 13136.6396 16111.9684 12340.5331 13572.8888 12315.8454 12096.6671 11929.0852 14810.3035 13129.6185 12862.4464 6252.1880 7046.2588 7697.7738 10656.4015 10472.8155 8664.6987 7969.7291 8324.1638 6270.6251 9228.7977 9372.8240 8925.3322 13781.2615 11346.1391 11510.9518 12583.1856 11009.6438 10861.3422 11194.0491 12797.5951 10224.0978 12138.0547 11902.3327 9332.5831 9218.8766 9920.1723 Dimethylglycine_R1 Dimethylglycine 739518.9354 736179.8496 590013.8751 1120350.9340 1170999.8710 577277.1161 422534.1750 277534.4911 867947.5462 522162.0677 1033961.1600 1644612.8470 654481.0843 366671.5228 1045025.7600 664032.1824 672142.5677 636631.4830 1301695.1430 898670.1441 632822.1019 382238.5830 1456040.2010 757005.3210 397701.1659 284660.7038 1545810.0380 686690.3071 829476.0771 369372.7589 1231962.0270 537545.1016 855850.5628 892007.6052 899701.4774 488333.9975 600975.5165 1343409.4310 1201684.8170 2438455.8500 1214813.8910 1537418.2400 1626647.0570 1030525.8910 1318883.4810 881941.1398 756560.5762 600948.1842 468254.5502 322539.9829 1629844.1100 693669.2058 355814.4842 551861.6764 357444.4588 782537.5087 904043.9070 772341.6619 1523285.4950 636752.4195 1268645.8050 1764166.8370 1789692.9030 1059854.2690 952134.2278 1592472.5290 3380926.9540 634081.3839 378219.8917 377250.5606 450942.9757 350273.3667 643975.1749 218809.8567 624605.1491 500970.7155 1017758.1930 268787.4459 1053153.4410 857800.5220 1252880.3480 1186995.5580 1077535.4920 1851465.0830 652774.9572 355004.5047 44501.2674 959219.4223 634238.8638 1148327.9180 1053298.3290 273933.3613 987824.1555 1273909.8980 1228693.9210 953628.3232 616028.3583 269937.9349 324388.1107 1710503.8900 525818.8516 859936.8659 1083696.8130 1089040.7210 220614.2604 621971.3924 1228018.9070 536385.3893 1028083.3010 672888.4638 1243419.7860 722787.0204 1150712.0400 699037.7415 695562.4236 1073713.1250 456209.3525 379699.5155 1159307.2660 346157.6609 284634.6262 1160397.3190 797271.7268 396591.3538 298085.3414 851853.4974 1123295.3560 793363.0520 725229.9397 679839.7987 718344.6751 637126.7078 744976.1700 1038509.4210 681273.6568 708490.6022 1129477.2650 42165.6755 1428416.2570 1325399.6690 865905.8638 843955.8102 850395.2312 535981.3677 1183162.9650 1941974.0080 686973.7331 673737.2576 1095819.5910 427328.4020 924396.8704 1181613.9920 866056.7705 1670007.1030 637416.8009 348017.7486 856218.8426 964962.4440 764879.5124 982111.6120 549774.0767 271302.4296 881844.0307 795615.6455 771789.0738 1073145.6150 1119966.5940 1011684.5020 946389.5495 794350.2715 787095.1766 888740.9194 880917.5608 861267.6122 800184.3481 798459.0655 773263.4338 865177.7612 802323.8749 762621.4862 706685.0458 1008590.0580 957540.7155 964163.7684 716516.9828 806213.9515 787473.7782 742307.0068 741083.3962 752874.2829 1000905.6330 982449.7774 979881.8094 933752.4173 886314.1898 813028.4753 741643.4823 702863.1007 695177.6107 913328.8539 922441.5695 897116.7469 873487.2552 787350.1361 824273.3255 789366.3005 877576.4888 878375.1508 907446.3543 895418.7218 874328.6127 772389.8463 757003.3903 741974.9457 Dimethylglycine_R2 Dimethylglycine 761572.5715 737226.6468 598391.5985 1216344.4200 517642.8013 547441.9761 475013.7924 279485.3425 869806.7791 514738.7845 1054488.8990 1554311.3030 662108.3459 421256.3651 1046525.0560 737911.2216 681754.2822 662839.0195 1223509.4980 911928.9741 650648.4657 389150.1950 1361522.0440 1037797.5180 406764.1128 444030.2375 1554768.1480 686302.5890 793604.3455 372626.2259 1222220.0780 504353.4592 847673.5369 889434.1879 895545.0457 504715.0876 605083.3753 1310902.2330 1160729.2990 2360775.6910 1148938.9760 1474148.1630 1559375.4820 970230.3837 1258277.3990 849286.3831 781794.3387 595101.8080 487643.8870 334796.6316 1607093.6600 324187.4690 359018.8132 608903.1007 339027.8387 780708.1386 844291.1411 777995.7435 1571334.0380 646759.2801 1299431.7650 1822091.3770 1684608.1320 527987.1618 455003.4459 1600336.4770 3166250.5510 656137.1767 373423.4708 333032.6100 450570.9258 376797.8843 652135.7783 249062.4590 761658.0302 501967.4817 1027880.4400 286575.2394 1100942.7590 869816.1961 1262261.7660 1131127.6510 1032519.3900 1759641.2910 674151.3181 462858.4691 46867.7183 888478.0230 594642.8039 1198659.9120 1042563.3720 149749.0396 1000599.3640 1283675.8310 1121162.8370 948352.1256 712690.9854 289566.1463 337467.6738 1631963.0300 590399.6546 793180.2977 1088293.6250 1021986.0010 257534.6745 637092.8138 1179566.7930 2087721.3440 1031240.3960 697222.8245 559155.7712 671124.6962 1086738.8130 697925.5604 692480.8250 970398.8029 466232.7278 420739.9556 1147074.2970 358227.0640 287835.6180 1109941.6880 787098.5097 416828.7513 289379.8483 798442.3323 1097968.4230 814474.2174 706050.3711 719334.1748 792616.3576 710767.4718 746271.9964 1058025.0760 703441.7868 748260.3167 1223095.4290 43960.3861 1326937.3260 1300560.2240 889747.0584 839301.5712 845924.2607 530112.5116 1133650.4820 1890988.8860 692071.5430 645359.2490 1112280.8030 453103.9827 885620.2213 1167374.3750 861577.5524 1650424.1600 650417.8266 342974.9840 871995.3842 438412.3611 708661.2529 970619.5860 559825.6950 285007.2551 893146.5836 814102.4656 772134.9969 1119937.1880 1056069.2620 1023011.7110 924394.7576 751661.6542 745444.4644 848648.7436 882966.4896 832915.1780 823081.8710 775067.6706 808363.6082 904094.1437 853170.9967 750129.9002 686091.3504 952074.8727 911144.3922 934682.4841 743839.0414 762054.9718 742935.0178 762993.2173 770061.8096 781953.6322 1022755.6640 999832.5953 1057910.3860 897764.6538 905910.8010 828097.2763 756306.3049 722069.9709 706000.6817 926568.1987 931956.8309 901501.0881 884118.8258 860700.9908 824415.0809 809620.7765 888069.3713 887359.3800 918411.1386 961292.0032 880747.2757 788101.9896 782865.2708 744720.3795 D_L Glucosamine (A) / D_L Galactosamine (A) / D-Mannosamine 60666.0085 98647.9706 36482.0078 65617.7417 82759.6330 140181.5761 49565.3648 37268.2890 49797.1369 48436.6575 31084.5338 22575.1364 77732.9266 40373.8934 53738.0742 109199.9902 43283.2519 84678.1755 30058.6859 77014.5828 53998.1691 67067.4632 39608.5098 128142.7307 53304.3225 25803.1243 82848.7012 78079.9210 41137.6952 61257.5258 134382.2594 31557.9781 41922.0596 71155.9150 129557.7199 55301.6723 242690.3973 61176.1461 103004.4002 38787.8221 39970.1453 27893.8952 69598.9815 45064.0799 26601.2570 64891.9910 53494.7612 48092.0757 51420.4711 48668.9236 96673.9835 67402.2502 39863.6851 46989.8579 94553.3313 59079.3119 60869.0070 119198.7430 89654.3890 22957.3591 73297.7154 73937.3695 57555.7292 41000.9899 58800.7857 88474.5731 50955.6168 37052.2141 75993.3996 23557.3449 79827.9287 63879.5546 55329.8500 75560.6965 96516.0304 41538.8370 69119.4644 88660.9722 61349.3956 69661.3359 57737.9382 86112.5657 81292.9495 68544.1032 83705.4881 32487.6184 53529.3849 84015.7891 120386.6480 66989.4482 237707.1093 80783.6604 35968.0362 56706.1438 144731.0714 73051.2288 88846.7074 58701.2578 29772.7511 223150.2107 70568.6550 176307.6567 36108.2175 34916.0302 72549.7527 75755.9438 190971.9701 9567.5011 115560.2320 124151.3232 34334.8702 42596.9842 21448.3004 119151.0689 56823.8253 31843.6780 59627.6455 56447.4253 151618.8442 34336.6575 56773.8997 44044.4061 52588.7278 60230.2777 39263.4610 45230.7285 136897.4373 64630.7548 50044.5843 104748.8949 44822.9308 32498.5733 150096.7732 64646.9735 58514.3705 155217.8693 87622.4944 37276.8011 48300.8640 36186.1093 23421.3452 100801.5955 87254.0573 44057.7676 75558.3075 37314.8947 114697.7712 28932.5772 151012.7850 54039.6829 77642.6972 180030.1291 53338.0482 92633.7025 52078.6465 102256.4858 136500.5006 57610.2614 123302.2834 48945.8524 46348.7407 79247.3012 59960.0365 25921.2612 72041.5452 70128.7003 64996.9459 59498.5276 61270.3593 52402.2830 47339.1407 42107.8873 44567.6044 41469.4728 40046.3601 35655.6966 36999.9298 57005.6160 58067.8410 49691.4135 44667.8208 103910.7449 98014.5619 73480.9237 60472.4877 59214.3463 58245.7936 66182.2943 65885.3118 64174.4927 51749.0569 70133.0823 53362.5686 40415.0471 49397.0399 48895.6508 48553.5563 47579.7816 42401.1237 74041.8209 48117.1156 66587.5587 43520.9157 29671.6471 64633.8689 53107.1000 67893.7175 71939.8019 56159.2508 72809.1050 82691.7252 73996.4336 73615.9848 60776.2728 D_L Glucosamine (B) / D_L Galactosamine (B) 25004.0276 16269.0836 16728.3676 27663.0376 9743.9451 23914.4677 7409.7286 12556.9057 25312.2870 10725.7767 15312.6127 25879.5394 8649.8778 15860.9083 38237.3093 28480.2536 15144.8130 13962.5913 32877.4648 10922.3763 13350.2791 19383.8106 9399.0571 43492.6276 19802.2862 21842.6142 49939.1655 18287.7250 44272.4814 14749.6074 11111.1606 12731.2190 19436.2052 22381.8378 10955.4523 6923.1515 18120.0832 11541.0454 20361.3176 11580.9762 39769.7030 35904.5502 43590.1982 29158.9828 48640.2606 12897.0985 55621.9966 28850.0270 47858.0669 9956.4637 11400.5711 22171.4451 57167.9271 10703.6832 5737.5859 30484.3811 15536.2262 16690.9694 10838.0637 10392.4749 10653.8126 17225.3537 11835.1753 27657.6613 11718.2198 13962.7485 7397.5577 40350.0406 37972.1818 16363.3693 38557.2152 9589.8374 43886.3414 54361.4553 15651.4142 21007.0425 12760.0071 25871.0059 43567.8439 13776.8981 8891.1036 10176.9494 15695.3630 12072.4225 14088.9398 12882.6364 13783.4821 13373.0992 11915.8635 13222.2722 13754.1614 13355.9299 14948.9982 11513.9297 13631.4828 12958.6496 9025.9574 16177.9679 D/L Glucosamine / D/L Galactosamine 38064.5336 59821.7744 21144.0037 46418.8363 40041.9461 37064.9254 28625.7552 28280.7694 24813.4680 67663.6813 12607.7004 11354.9579 29198.7338 23109.0509 33621.0334 55779.3103 24865.5997 35779.6184 17019.8429 43507.2606 32341.2374 50659.4939 26304.5087 93145.1586 26970.7503 20988.8459 37753.2297 45573.3819 19797.6890 44546.6698 57446.2459 21728.7244 45473.9356 39609.4690 95597.9049 27121.3109 87589.8399 24995.5892 71450.6692 30979.9034 34056.5441 14093.4948 87321.7199 19839.8619 28486.4764 82245.5908 37011.5831 49679.1028 26028.6809 26287.7271 104541.6142 50422.3515 22055.4320 51401.4995 116929.2175 41350.9834 37276.5730 116309.3921 44177.6754 13039.6214 101562.1318 29719.1301 33336.0249 28204.3320 31342.3579 42621.2857 56617.5853 32397.8968 55559.4107 22836.2354 35528.9787 43883.6969 32495.6464 34840.8344 33768.0356 28575.9311 36786.0974 78370.4464 52407.9495 41045.6136 29878.3940 73588.9325 51679.9599 58895.7256 99946.2230 29336.1685 31486.8380 65271.9476 87702.6708 38841.4183 132889.1063 101138.3431 20570.7024 29712.0319 119992.0546 72702.8323 121787.7775 31359.2804 16457.7029 136416.0940 70513.2384 111974.3618 26118.7710 27613.8531 32455.6675 27840.3076 97767.9854 12498.4996 54719.7580 139353.4194 30460.8377 19414.3460 17975.6267 74916.3331 35040.0222 13949.6054 26523.8184 39934.0655 31740.8269 22039.4937 33702.4800 15931.2262 24566.0254 31056.8712 24524.6422 25129.9119 28366.2498 44046.2020 27026.0193 29230.1266 24273.9337 20117.6361 29756.3032 31730.2656 27718.9839 107731.1707 65404.5171 32485.8892 57093.4659 35350.0409 14994.3638 68596.0374 96879.9529 20727.8293 90920.8421 38202.8382 86771.8717 28803.8054 32911.6221 32268.4209 111984.6667 127971.4975 22725.0973 41660.8326 28358.2108 29811.3579 23232.6668 33116.0054 25858.2255 52925.5523 34473.1666 65618.3995 42815.3991 18265.6958 103774.9305 30485.0619 31377.4700 27295.4102 26781.3153 25585.0362 22556.3816 23107.2011 21868.6097 22017.6705 21595.5496 20712.3597 20686.0177 30627.9623 26001.6535 23166.4163 25803.2789 31937.0005 37416.4368 35090.9702 30305.0288 20993.1987 29153.3381 27004.0684 25737.7949 24774.3803 33380.5200 33686.7551 33650.7478 30400.2315 35851.8266 29773.0761 32788.0696 32237.9132 30387.9557 35672.2974 32884.6954 36202.6918 34841.2676 24721.7297 34932.2435 28816.9859 34979.3960 41942.3099 39092.6895 37667.6646 38659.6676 38181.4101 34920.4370 35098.9847 D/L Glucosamine / D/L Galactosamine / D-Mannosamine 89483.0167 117406.0410 41401.5213 104041.0052 116059.5832 236777.3637 58537.7515 43386.9040 78538.6639 70928.8339 57737.0307 37976.2951 129180.2187 55103.5028 83142.9925 121981.0554 49226.4339 64718.1495 29333.0165 81695.0820 92592.9068 86556.1221 49738.0451 127489.1295 67512.0111 36116.5553 120410.6330 88125.7555 61925.8782 65560.6905 166623.5379 35536.4637 71018.5601 123584.1406 128627.2606 58389.8317 397756.2429 75552.1561 141285.0468 57754.5209 61132.2042 36246.9222 86354.1267 68448.0360 33106.8950 78441.4895 86788.4971 65597.1570 54497.8393 40871.4829 139446.4263 92680.1246 48848.8909 71297.6163 105048.5951 71796.3362 65285.7331 95363.4117 92625.8153 34624.7788 91739.4934 135326.2749 87471.0498 46780.6499 99214.8591 141160.0724 62752.7380 48282.6277 57492.7339 24841.3657 132671.8468 93170.9865 87873.1557 124060.7210 109695.2796 63732.7513 78198.8596 77783.9122 51344.3395 114253.9020 66984.7786 116274.7013 87928.8768 56541.1326 108053.8128 41967.1218 54875.0510 85994.0457 167783.2982 69733.8447 251054.3801 95949.5314 38762.9799 81758.4469 131600.0920 111365.3225 120911.6048 96820.8813 31461.0512 108855.4442 91447.4383 122101.7346 55961.4707 48068.7878 93833.6158 125614.5026 192890.1674 22380.2993 199486.9954 175314.9818 48173.5979 55423.9447 28488.8273 134862.0011 65487.6900 44794.3050 85617.9077 90149.1907 116240.7096 45858.5171 85676.9714 73607.7106 78897.3181 80888.6244 53399.9072 63740.0619 181241.2567 93219.0414 60953.1565 189613.4989 52255.7549 38710.6536 278763.3566 76754.7766 81345.2507 115249.8458 79089.9825 54520.6450 70841.7550 52037.0908 38629.3855 94566.8947 120050.2656 49630.7049 115111.2425 54248.6906 155497.4922 39559.4915 225487.0907 50994.5285 104288.5976 174691.3186 64164.8754 112338.8221 69653.4280 166739.9453 207773.7989 69295.8155 151434.9890 72368.9519 69990.2311 74219.2625 79734.8035 30816.1214 112704.1080 93563.7400 96241.1923 88770.2755 83104.1982 76725.1026 69966.6285 64355.5354 65836.0929 61572.6658 56941.7383 54568.6212 49581.8431 80216.7182 86563.1932 76816.7161 63084.6308 97805.9636 109916.6049 110048.1875 93231.6805 73327.7982 90214.3200 74870.0466 85532.4493 72018.7811 83763.3796 76985.4811 79399.9713 64525.5491 73303.9812 78706.6033 72187.1119 69673.6001 70672.5068 82390.6443 78145.6092 78741.9917 69551.8630 48972.1524 69148.6666 70623.3301 74106.6008 87687.3400 82257.8623 79708.4232 90216.9335 74236.9643 80219.1825 71106.6929 D/L N-Acetylglucosamine (A)_R1 332334.5644 670281.2005 275689.1958 356956.6900 303086.3589 322464.2941 221061.1003 209797.9639 238346.9541 211296.8410 309059.6561 259063.2602 345772.7684 360123.8967 375275.9793 423597.5425 365263.4757 313339.8199 413136.5040 393145.1477 322284.8237 376044.6453 271366.9780 503920.4158 400012.7300 312207.2309 306512.9909 581057.2209 310709.9173 310875.4703 380040.0435 279645.5456 275729.9822 288955.3153 451977.6052 313576.5718 365023.4126 303448.2748 405450.6667 323080.2456 255024.7428 351991.4094 457817.6720 204330.7604 319276.8796 318164.9976 393409.8353 284387.1338 207807.8756 470282.2096 330919.8063 297135.9123 240466.0321 401917.2488 326756.9084 362458.0605 401821.1477 338650.4464 228963.9379 330893.8603 375611.1329 274801.0360 305876.5228 225974.1428 319681.3148 307859.3997 380377.2127 311985.1532 236623.1294 266935.6263 424850.4538 392316.0869 210088.7039 335472.3933 379506.3002 294414.5648 240507.2842 637181.6500 374661.1981 329302.2698 377295.4269 280445.2257 542078.9452 417977.7208 388333.3535 389559.2037 318132.6047 273510.9507 413074.9569 348633.6026 300463.0923 370214.2997 254194.7583 356049.0195 324355.1298 332420.2475 303049.8567 289258.0471 362547.2481 367534.3703 284633.2100 312795.2874 207514.2495 432886.4601 515488.8124 531863.2214 294228.3616 358178.0853 275698.7853 316950.5217 191997.2516 268103.1225 597119.9529 219705.3561 498080.8890 246443.4720 396970.0444 216427.8527 344080.3003 299011.5009 340808.9148 383496.4380 399693.6212 367647.9703 350318.3469 232698.5461 370292.8466 291464.1482 208990.6964 296290.3860 262071.3619 360442.0498 288662.0896 385137.1873 387970.9999 344814.8935 301114.9452 330671.8947 404404.4368 334186.1943 361794.3213 523043.4301 367552.9273 249274.8758 437175.4220 382686.2910 299120.4540 372821.2063 371991.3027 300565.9215 368757.5979 377622.0390 576620.3879 364803.9577 575759.4357 389574.7068 410521.0090 268523.8056 312472.2556 463196.8190 208864.2750 311399.4075 100352.4075 111451.9574 111405.5342 95950.7855 91751.5138 91151.2992 87367.0725 99728.2184 101900.2519 95359.1133 270363.5797 267483.1041 251471.0512 259058.6671 247690.3135 249931.2910 252437.6941 255935.6598 363500.8320 361737.5365 408878.3524 396935.5458 381013.3561 394832.8552 344631.5870 336139.0792 349222.9214 357785.7409 355448.3985 330943.5724 323861.0104 309981.6897 320956.3403 299520.2436 317327.8939 341707.0475 341227.0168 331414.9854 342203.2035 344940.3734 344785.6865 324447.7207 D/L N-Acetylglucosamine (A)_R2 98400.5723 38293.7814 54466.2303 38672.7220 47420.4295 51109.7468 40883.4917 70665.8451 76806.9345 75557.8941 77736.8165 84103.4131 67602.0605 61803.4563 63652.1370 69941.0874 52052.5445 96634.4677 68865.2247 62955.4935 105699.7726 68527.4540 67514.9184 67318.7404 51994.7982 60844.6911 88627.2812 59194.9444 68398.6977 64989.2856 68406.0431 50382.5357 88087.2033 75622.6316 42875.5798 58782.2766 62911.7442 53501.4090 62220.7067 42743.1941 64303.4900 42840.9907 65588.6726 69337.2158 66899.1432 63468.0684 68997.1112 61135.7827 69701.7168 44214.6301 66858.2318 40583.1606 59682.6250 63474.3313 74101.3460 57551.9437 43703.8482 71702.7539 64614.7304 35454.9971 74512.4341 49659.0745 133584.7267 68667.3831 62851.6649 59421.2617 41387.0437 74769.6473 80228.0532 69720.8023 95561.0846 58213.8565 47811.4580 55558.1789 58485.4790 55922.2068 58885.3385 78279.8303 52927.8891 50063.0021 52096.1824 51515.2241 73197.8174 87334.2556 53901.1958 93784.3003 31414.0639 96268.1098 92687.7381 93700.1252 41435.0390 48319.3326 58314.4641 35959.1545 46112.1427 113908.5097 37426.4086 110444.7305 42567.7461 81161.9097 37629.5244 58327.5589 48336.3573 70554.2693 52806.6551 75273.9807 51961.2503 49512.5186 65406.8516 40746.9393 37426.6232 45043.6360 72182.0315 45670.4617 55443.9570 67599.4282 49098.4294 64582.8409 56886.9000 64279.7137 104823.2900 64889.4621 88435.2559 66933.4262 54682.4632 77040.4134 67578.9928 49733.6982 61123.7620 67639.8425 129912.7611 64346.7395 96079.2990 78820.9651 51869.4351 69900.1258 57515.1258 67686.1471 10688.6864 60387.9687 70739.3243 78726.9630 74787.8556 63345.6995 57995.2190 53806.7047 67571.8662 65214.4489 60865.2528 71110.5357 57022.9803 60583.2550 59574.3648 58683.6008 62892.7411 64347.8460 66242.4838 107151.7268 67049.1741 74596.6364 D/L N-Acetylglucosamine / D/L N-Acetylgalactosamine / D/L N-Acetylmannosamine 426874.0299 745019.6227 269046.2101 384559.6684 475577.8319 327877.1009 259171.1777 279992.4122 342631.6085 290342.1651 319577.2966 393052.4485 250612.5361 438406.5116 424762.9862 409858.4574 659946.3070 419644.1135 472922.8111 549130.6534 448355.4643 383477.9083 343994.5525 437142.2869 556348.2874 575784.0813 340798.8429 323428.9192 781573.7767 461247.0560 356727.9035 510469.8840 432943.2541 314056.7065 459972.1714 748777.4027 466100.6058 349092.6827 447782.1035 575392.9629 461182.7527 363371.7650 427920.1613 491377.7185 278041.6180 425570.9776 411722.1304 482492.0004 332373.4890 178669.2786 620733.1949 322361.9666 285813.5443 323711.7862 464701.1025 464135.4141 493503.3297 466537.4446 522842.4114 187502.3777 526996.1096 505204.2337 346500.6778 445360.7758 337056.3517 401259.4044 432515.7982 573580.9426 419884.6013 251918.9779 337567.5509 474445.1562 445776.1725 211405.6286 384278.8727 484804.1379 325416.8602 397695.9012 813818.1713 626679.7996 431224.8957 543543.9156 327536.3914 486658.1123 623070.0832 506734.8405 465900.2300 459445.3526 349087.3029 488417.4130 395739.0869 419160.0400 420234.1895 329002.2755 352302.7926 447460.1188 417226.7194 348106.6496 290698.3909 420268.2259 429457.8420 531081.2576 489941.5935 389966.9625 257742.6035 545328.2883 633219.4771 556497.4511 376522.7977 368117.3260 407243.3839 530705.4891 366306.6926 384317.1779 718791.6466 306320.7245 605116.9062 357357.2689 511350.3760 314546.7610 288451.2217 453613.6666 319169.9910 414457.4841 463225.4767 405345.2645 481821.4551 413972.4797 285313.7559 499870.6130 437667.6231 353435.3821 275849.9168 332905.8638 451999.5440 340324.9452 427885.7215 405432.2784 407919.6507 360233.8060 353051.2571 492906.2340 406169.6387 506497.6811 693780.1055 545581.2668 333750.7896 507313.5575 359884.5374 412255.1288 524662.8196 502737.2556 316658.1055 492432.7102 419812.2734 837553.8108 518543.0139 579706.6630 453992.6462 450149.0157 362338.4887 481988.4111 364447.8646 249434.4398 382313.0006 102708.7769 88483.7821 97825.7998 112724.3384 87277.5354 95734.6629 124457.2209 71306.5550 95617.3529 69741.4142 85687.3657 83763.2805 63919.7911 69990.9573 72722.8750 89985.2189 195798.9832 202202.4517 116143.1244 180178.6983 172695.4381 231947.3394 225139.8570 200639.5438 181210.0846 504311.4854 449762.7254 519693.3408 575578.2269 520648.6686 499063.9723 433240.5010 450057.8989 436478.7026 472522.7289 490742.2211 425753.7244 410580.5040 373470.9442 460139.5563 404095.0802 420170.2472 403354.5835 411105.1162 402068.3901 418509.3303 422451.1635 397780.7536 361527.4796 D-Mannosamine_R1 2-Amino-2-deoxy-D-mannose 103251.1803 157959.2301 71572.2554 119837.7495 146407.6849 210691.0423 70287.6073 51815.7760 80659.7343 96903.6821 64553.1022 47113.9225 140809.4237 66516.5899 89448.1150 114468.7634 69555.1038 108441.0691 51704.2412 98183.6657 98210.4941 119405.6756 69321.5505 132928.9001 84194.5442 44991.6346 131816.7007 105095.2939 69539.1845 86717.2053 205329.7501 45774.2671 102710.4115 118897.8910 143659.1610 84071.2594 385872.8399 100435.1599 167032.1436 66750.2606 79043.0729 55555.4140 117104.9408 75856.5721 48048.1719 95199.5689 88394.3174 81288.7600 87273.6081 65467.7031 159583.6507 115345.2077 69093.7242 85628.3961 121555.7299 98829.3316 84231.8783 109220.2192 100393.7714 44881.8526 104906.8093 126818.3085 92419.5103 72008.9284 104347.9226 148210.8366 83382.9048 60856.8367 84516.9149 52936.8891 135668.9393 97813.5051 100833.1214 134388.8561 108696.4559 74752.5449 90729.4835 99975.3903 73606.8180 112254.5799 73317.8086 144619.8184 100574.2257 74421.8921 139782.6278 53550.7948 65932.8171 94940.8346 185004.3923 80049.5284 252958.8008 110462.5039 56285.4426 94659.4647 147752.3978 112654.0299 138389.8213 103543.7542 40053.6918 237643.7931 117136.7800 274168.0078 66023.1971 59996.7735 133077.0038 122603.6623 206354.7584 35480.4766 188136.0469 207684.8544 65249.8018 75924.4457 39402.2326 220619.7676 75853.2038 49850.6899 106018.2761 98930.6754 236653.4846 62109.5145 90165.5389 80527.4500 86522.3290 96546.8087 71612.0266 78274.5902 227113.1773 111052.7380 86434.8361 171532.9441 62586.5067 51941.1763 243614.3832 93899.4504 96977.3593 158861.2612 92164.8381 68942.3539 86787.8058 59564.6584 46609.8256 117069.4087 136777.4911 59442.0231 129694.6871 67067.0939 183777.3377 63224.0121 223931.1408 69710.6213 128042.3417 190921.1613 84825.1116 148460.8929 98897.6442 163399.8341 211312.5704 94300.9078 182759.8538 83578.0945 80104.3856 138763.5191 103045.6769 46768.7136 134874.7970 92122.2249 93401.5389 81905.5254 82161.8231 74785.4347 68339.2897 53933.4932 64215.5300 57052.7164 55767.6434 53705.3133 47204.7674 78032.9032 78412.9395 71150.1148 61237.1548 101111.2161 99508.0108 93169.7937 81715.9425 79461.6212 81153.1476 86220.6521 82353.1790 91598.5229 81928.4164 74853.0667 78653.2478 63872.3459 72118.8759 72050.1694 75478.7698 68566.7234 66635.5565 81097.8357 76010.0583 73730.3882 68609.3488 48420.2747 68672.4138 68582.5804 72365.4711 86258.8378 81359.6181 78585.2170 88483.3212 73330.7475 79075.1667 69102.6765 D-Mannosamine_R2 2-Amino-2-deoxy-D-mannose 18028.3842 33045.4425 7362.0409 17959.3796 25319.2831 13113.6376 13158.1764 8576.2916 9229.8015 29245.0818 4167.6433 12289.5457 11437.7065 13253.6585 24647.6411 7967.3927 16874.9755 8162.5753 18259.8886 9546.8283 20679.6916 15863.9956 45169.0262 10317.7325 9393.3649 15411.4652 32024.4522 6880.3436 19305.6002 26397.7684 6605.7891 18859.9651 16493.9397 46095.4895 12624.8542 43079.7613 9763.3535 34493.2067 11859.7933 12324.7907 46842.1631 7512.9383 13286.1385 33821.7460 22110.4885 19370.0690 9989.3856 10168.9150 47447.7733 18453.6484 8618.6263 23096.8749 51449.7665 17358.9365 15723.5997 53137.5325 23897.3451 3902.0745 45574.3823 13211.2073 14429.5049 13133.1191 15172.0507 24520.1913 24174.3115 14330.0755 25389.8222 6816.5653 15354.8134 25914.8370 12608.7721 11789.8394 17066.6303 14984.4322 19106.8015 48761.7591 26821.1620 17490.8194 11557.4188 31434.1090 21402.1455 23721.2180 47458.1192 11831.9737 11442.3686 28533.4181 41499.9972 24042.4289 67295.5154 55384.1620 11679.1822 19222.4456 67144.2155 30796.8731 58948.4824 11511.3439 7069.0697 67388.3043 28984.7591 46480.4319 13134.4003 16388.7800 19451.5220 15483.6004 43240.3954 28589.8815 62455.0843 13577.8938 7054.9144 46550.9432 14228.2750 4431.5076 18684.8491 15341.5710 11203.9091 8355.6373 12438.6388 5929.8015 10075.1826 16060.2478 11144.7808 13846.2908 11754.3497 24171.0943 8414.2567 14576.7409 14085.1208 14989.1971 47485.7135 27432.2079 14232.0690 31923.9166 13700.4430 5561.4544 35403.3518 41033.0180 12615.3837 37859.0565 15251.4835 37178.5804 15643.9854 14858.8975 12048.1102 55632.1654 57459.1814 8518.0674 22923.3759 10128.5085 11830.3638 12350.7551 22861.0248 13071.0598 31078.6622 17094.5895 10481.4963 45423.1222 11813.4958 14117.3452 11936.8961 11698.1790 8264.4440 10999.7218 8924.4690 7402.8056 7967.3406 8162.4714 6823.1769 10078.3632 18190.5193 10234.4856 9059.5378 9400.5301 14654.4389 16272.6951 19969.1954 11572.9674 10383.5297 10737.8734 15001.7410 14643.6791 18519.3679 15256.5600 14711.8103 19554.9204 11299.8627 14558.6390 11768.9389 12053.2765 11720.8270 11193.0599 20988.4580 13544.6802 20571.6809 13224.8532 9104.0639 15505.8669 12144.3958 18904.7872 16266.9531 14279.4833 15525.1255 17665.3168 19183.2974 15893.1056 14308.6088 D-Ornithine D-Ornithine 3691.2456 3593.7929 446.3076 511.6667 1884.0814 455.1580 989.2121 371.2720 1274.1522 5087.0786 2353.8074 820.5177 613.0407 777.0260 1596.9397 6032.0576 3476.5400 1124.7807 1000.5108 3086.3873 2984.6712 1757.1624 758.6705 2156.2638 1264.1054 1251.8235 8091.2877 371.6685 2081.0894 1727.0519 1236.0880 5130.3294 713.0772 1106.9462 4038.6777 4023.7020 7607.3029 6374.0971 3356.4132 3300.0139 9676.7622 2480.9300 1481.7675 1757.5302 833.8045 1866.1581 7233.7706 1916.6495 468.8813 1367.0870 1867.7358 624.6578 1036.7614 7093.4117 10848.6706 3862.2255 2264.7662 503.0506 4356.8328 2532.5895 1527.8617 548.6191 1371.8811 2142.9583 1884.7685 1359.2324 537.8191 2372.3397 3845.0270 1982.5401 890.2738 488.2323 1301.9985 996.9869 508.6508 4340.0833 971.7899 3852.6157 1034.2984 1589.8857 1206.6222 355.6327 1452.4988 1388.3703 465.3019 468.5165 1021.1306 Ectoine_R1 Ectoine 577030.5965 403166.5667 362366.2524 1771776.0310 50527.3906 69160.9896 36900.1441 125723.5917 392431.0485 146950.4068 532645.2887 264058.1452 72765.6192 47540.9684 723120.5814 504237.4980 327969.7199 220374.9256 118887.4023 131765.7927 137570.5553 255403.7028 88444.2394 576559.9780 533210.0193 40302.1499 214619.6205 238264.9018 219052.4880 374532.8216 417407.0554 2178752.2010 663932.3071 309725.8100 186314.0325 1901939.1160 1372179.1020 127557.0417 292017.3221 749822.6246 23559.5238 121998.2409 96698.8792 73658.2273 276754.9640 994550.2407 408362.3981 3769851.1820 84572.2417 369875.9173 422153.9265 243376.4925 98645.2333 342752.9028 129387.5600 155048.8553 323065.0306 256625.2038 189999.4295 106306.3804 470945.8391 1891655.4070 131250.6283 492705.3292 322671.9592 215222.7749 117308.9026 136845.5342 125668.7188 279239.1057 806026.6111 76721.5696 221272.2716 511568.0164 898018.9324 216978.9085 1110765.4010 58924.1424 165538.4826 391971.0571 87231.5335 182401.5804 81491.7037 1074941.8160 166447.8565 537834.6270 1648942.0120 2858877.9530 1278316.6830 215576.3383 152281.3452 461780.8405 183431.5404 259899.4128 319281.8371 178599.0613 183696.4398 69869.0243 194842.1468 333135.5426 645015.5926 672836.9892 2277903.7380 147040.3818 80572.4632 1141545.0970 90640.2027 207976.4201 89724.2427 699440.2850 320311.4984 281841.2105 827877.9628 95948.5218 135406.7911 629340.2037 1380236.5990 883012.2333 61355.4909 47183.5038 909931.7152 643168.8379 261756.5095 72926.5780 1070691.6880 90215.8893 127747.8958 159016.2032 199587.7710 156138.5256 1135175.8000 150536.4199 157718.0544 107163.2485 714412.7869 73163.2697 127844.8826 1211600.5940 4193545.6850 75348.9766 746874.0002 122189.3959 698670.5273 628938.0104 743064.4132 536626.4858 544757.4132 506112.1844 495986.8603 456386.5032 495115.3533 568788.1669 422013.5174 499799.1232 490035.7303 521102.9230 465047.8654 432655.6284 518453.8655 632019.5781 474337.3603 344566.4890 387748.9600 347864.7214 433806.7811 332592.5304 337057.1928 617145.4734 511358.0930 460572.1186 482240.5334 496942.4513 499423.1103 369895.9074 368887.3346 359019.5368 405449.4102 548767.5007 421002.7945 460901.3472 465108.9937 379119.4982 346494.6756 375921.2281 396925.7024 367084.6064 384423.7510 385395.1673 332707.7045 328196.6623 371469.3693 Ectoine_R2 Ectoine 598071.2733 414181.7554 393254.1400 1894126.6240 35824.2812 109277.4724 55655.7580 120514.1826 384948.6570 12389.2142 569738.7958 289623.5252 44293.7563 75435.8365 774719.6775 542811.7997 896380.4213 72980.1051 230727.0042 153530.2371 154574.3907 143988.6724 312384.3663 14360.0336 589620.3968 761114.6050 56330.0091 115949.4599 282280.8653 266485.4425 196058.3678 56251.5373 334236.8381 377069.4798 59383.8625 2153236.4290 632093.3401 355251.7874 213104.4936 1924515.7720 1454535.9700 164694.6740 273299.7928 62325.2554 147673.4056 90485.8117 85608.7431 292496.7789 988398.8635 101323.3011 116607.3480 50332.3649 56423.0410 381226.9476 111726.9737 3687579.4030 65505.0228 328545.4319 457196.1570 302747.3055 141012.1573 410151.8531 54503.1240 159900.5601 167644.9551 181431.0229 194363.1472 208778.8356 93437.3735 596684.2943 451538.5474 1844003.5310 122385.0454 566230.9238 348500.6288 254578.1123 101080.6175 170045.8518 122123.8525 303207.3666 649378.7316 377405.1211 118485.2529 226194.5903 593982.3272 963884.4824 250327.5869 997003.3008 67308.2661 140374.4186 340527.8721 90026.5413 150769.9720 105620.6781 1072303.8270 157830.1366 582462.2829 1622774.2160 2757726.4870 57486.7335 66221.5658 1289633.2500 251741.5199 119188.9842 426485.1838 229372.3463 279771.5814 57857.8638 221440.4127 199269.7783 208902.2428 67257.7671 173544.3551 364033.5964 554459.3019 669288.6523 2194025.2030 50283.8553 149051.9013 67242.4421 66935.9373 1144510.4060 134799.9160 249117.4876 74845.5967 45449.5476 679401.0076 342035.9324 282763.0335 800424.3321 186397.0297 95414.9948 99606.4172 635696.3923 1398559.7070 57402.0246 911387.4953 94515.0912 48362.1947 100967.3456 1001860.1410 85541.7519 662589.5953 279174.1779 118367.4692 1122470.8410 114306.2256 132210.8704 192246.8119 231810.8927 224409.4612 1143369.2020 201871.9803 148833.4514 95936.6972 785190.8688 112653.5654 105433.4523 190390.5912 1268794.0650 4023833.8440 63939.6727 1309811.2390 123999.9268 654296.6446 650094.8345 626620.6313 602704.7965 465275.7553 451195.5876 522051.5154 512940.1629 512887.9150 501156.7588 453808.8615 475774.7253 538091.0919 496651.9474 441626.9039 436620.1149 524072.8447 486420.2854 506359.4342 375237.3275 388528.4259 381804.6642 370693.8999 377987.2259 363059.3314 534168.1721 526784.6656 486280.0700 477597.7662 468057.4703 442667.7778 400711.9033 354871.8307 359856.2559 436046.5188 438295.1504 402483.8240 407455.3486 397003.9958 384412.6148 392378.7085 382431.1891 406658.3734 410793.6467 388457.9234 386013.4577 355762.3388 333018.6862 331575.2500 Galactitol_R1 Galactitol 414094.3870 273899.8556 1770023.5470 667865.0373 322211.9335 307624.5393 349774.5327 283572.0891 335960.1861 197753.1246 288764.9460 277541.1734 183110.7429 271430.6621 1809299.0430 719195.6170 357770.9948 1716322.7890 323907.2332 420138.4561 711791.2906 629888.2579 509021.9565 278689.5538 261608.3801 261289.2936 453094.3762 264797.2572 390593.6045 251559.8040 248995.1029 1360354.3870 201673.2073 541989.2895 268000.0112 212935.7727 289126.2696 292130.9050 1153839.6380 381600.4990 245870.6468 949466.6796 468748.0099 600291.8032 174501.8283 189067.0424 319482.4121 324027.0566 346927.2409 324343.3133 301369.6471 290534.1274 1117115.3480 799936.6428 1210506.8760 237945.6927 371485.2228 2030082.7950 270050.2994 1453390.4890 293729.8297 224740.7035 287712.6599 1154887.9370 283448.8954 269651.6345 382601.5813 131054.7836 324829.7744 315176.5519 227502.5264 381875.5215 334493.1639 316190.1858 394226.2273 220219.9905 242608.5345 405737.1314 385784.1389 468604.1233 309086.2471 249219.4067 228752.8723 391668.8300 323140.0932 265576.1294 281140.1935 363471.1963 296609.1635 470700.9566 299456.2718 1089039.0490 351005.6347 241427.9765 321661.9615 246126.8777 275098.1327 1755751.5810 489917.6546 302285.3861 239812.0419 286550.6665 289065.8665 218582.5024 305728.8089 467333.8227 527721.2930 521935.9675 322045.4861 340087.0508 243036.6281 211355.7747 526817.4195 226505.6565 315823.1015 242594.0461 322704.2577 1402392.0690 396330.6135 480444.4550 250300.9139 339470.3394 607048.7586 314902.8629 212577.2804 591933.4851 360556.5642 260297.6996 458955.4312 269974.3384 358165.0059 173491.8401 1354786.7290 186808.3307 286328.5220 640702.7492 197021.4667 262898.7928 1404537.6450 258229.0547 301197.1812 234130.3442 257884.9766 323442.7182 363795.5760 760182.2063 312274.5545 472093.8408 534727.0791 993551.7674 320800.3093 528231.6673 650557.1967 278356.5204 670758.1104 330348.8636 320554.4784 192034.1783 636873.0801 426128.2871 625580.3991 179388.9460 393253.4854 230674.7312 320744.0765 657879.1942 618395.2719 655449.7373 607406.3724 505813.1686 509649.7928 537112.7362 532195.1321 542263.4878 513011.7989 511742.9437 558939.4723 545078.0077 529434.3966 535359.5649 526158.6877 953084.4794 875514.0492 921399.9965 773354.0085 773380.7806 743076.3245 756936.7191 727762.8124 742800.1585 497812.6362 487764.6954 468241.2437 494273.0468 485611.0911 472649.4148 416012.9001 401162.6583 399993.2256 470131.6015 479411.3057 469752.2904 471154.8704 428149.5144 462943.3632 453335.6016 450512.7560 451869.8110 467080.4201 458362.5492 460656.3843 455719.6831 452856.3683 481305.6758 Galactitol_R2 Galactitol 145513.8114 102503.6496 667586.4537 299319.9480 94108.8913 112232.7363 134214.7939 130000.7601 109935.2626 88040.1607 99008.9614 94289.4124 92442.6653 69424.8300 578141.1989 230637.3522 116185.4983 624623.9646 101256.0282 151849.7052 262820.6414 206246.5203 177023.0399 96303.8653 102465.1286 113811.9599 179764.8970 127556.0297 149205.8904 94365.7923 426731.7308 79416.7499 167492.4061 91680.0301 66836.5070 99507.1329 119116.3453 425229.8803 134457.3677 85178.1178 301423.7587 196750.8030 221596.3007 65479.5715 66747.9954 130245.1692 131117.3939 109831.8152 113540.3126 124777.7680 142259.7872 374535.6085 255233.9248 321616.5143 99849.5102 135464.8733 722828.0801 68467.3661 495348.1979 83455.2721 93212.2161 107148.6114 378895.1651 73260.0043 104720.4420 114363.8045 49603.8612 99870.6515 125560.7334 71644.3794 162749.4238 139669.7730 119474.7259 120985.0278 73637.8173 93443.3088 150601.7947 169654.6752 145174.6759 99055.3809 92746.9039 123062.3027 116416.9655 120422.8014 111124.8901 131489.7316 86356.7696 188300.3140 107152.0462 326410.3072 83325.0111 120348.0121 78999.0669 84309.9312 575499.8999 191653.8385 124760.9288 94249.7030 104497.2390 87177.6396 104521.3342 125844.8590 179577.1754 191884.9618 243391.6225 109787.8303 112544.4591 51472.9832 89191.9470 172506.5794 74756.4040 144521.9073 95140.0696 134238.9611 412788.6299 159414.3393 203515.9662 82149.4896 117840.8034 237815.6346 109778.0965 77982.9222 221621.4502 155251.9280 90504.0012 164294.8062 115363.1388 128449.3168 52280.7444 436200.3812 67291.6356 107498.3013 209574.2189 56637.3348 123338.5252 542496.7070 87367.9325 127151.6781 73618.4954 68576.0215 122538.4345 115234.4242 224047.2635 93552.0892 183961.1784 183843.5056 375551.3031 126126.8867 196351.6475 248259.2866 91696.0051 282403.4483 126565.4436 113945.5228 83518.0622 229607.8587 96543.4077 155446.5284 72753.7613 187420.3530 83400.9438 100889.2288 219906.2033 216750.8348 226099.9521 221264.3792 190346.3351 195373.8567 195363.0222 208835.3524 205301.4876 210326.8460 204806.1144 209577.2480 201310.0648 205364.1005 221724.4547 223359.7482 260472.9396 253367.8719 246029.2194 250838.4521 252241.8413 243509.9638 257967.2292 330694.7230 255948.5359 146134.0367 144881.4173 164057.8732 140320.5438 157358.3810 152616.5185 140494.8572 151947.0733 137088.7060 163360.4941 183445.3994 170472.8219 167353.9863 144467.5930 158303.0497 153057.9462 176761.5883 172966.6153 166573.0124 163689.3967 174706.4595 174730.3242 180656.7441 204497.0946 Galacturonate Galacturonic acid 34082.5405 62287.5912 45940.7634 73275.4208 43001.9611 47003.2687 32107.9539 56125.0194 31486.4877 46691.6659 28309.4772 26915.4787 46868.8555 67125.3906 42084.7216 40014.2606 33998.5407 32972.6908 33930.8953 49752.9667 45967.6663 52731.5060 67712.2383 25706.9419 38807.6322 58345.2002 43010.9680 46012.4763 64728.2920 52531.1510 57610.7064 56178.2896 31889.9789 33788.7001 24914.5566 36233.2351 39924.5088 56950.4960 22615.7603 82171.8730 51743.1820 30924.5435 34343.4734 51158.3315 29595.7100 58893.1427 44188.4652 22509.7955 45936.4469 34838.1515 39547.1917 59501.9039 29040.1102 26181.7571 38687.0336 49403.0119 51921.6241 69439.1735 43994.9168 32322.9098 38992.7917 52679.3118 57838.3862 40659.4673 31078.7424 39191.4639 47803.9840 31993.1182 28528.4684 65549.0215 33485.3347 61026.9063 44054.0436 45563.5717 59149.0239 49614.1212 48406.5675 27791.3835 49180.4139 33135.6278 39254.1459 45219.6208 34919.9551 32430.9851 34762.0255 52650.0553 49304.6243 36533.2111 31274.5321 64623.1962 47938.4997 32850.4813 33089.7798 33666.2571 64694.4231 31748.8575 41394.9428 38438.0492 35446.9082 25471.9606 49215.7502 43215.5068 31242.6226 50670.3011 47271.9469 70292.4752 44464.7037 41866.2093 33384.4937 51875.8301 25975.4977 27327.2792 28477.4280 28834.0636 72351.9492 29826.2589 38581.6732 61684.9436 33522.7458 63030.3329 44920.5834 32060.2208 44373.1715 49002.3303 66678.4915 65104.3265 32480.4953 41395.6987 31835.5370 50723.7043 43123.2257 24801.6753 39220.3442 37220.1927 33629.8040 41140.0333 23914.7621 44315.9503 27815.9905 37883.7971 27707.6018 29911.7459 39928.0906 36565.2463 51218.6635 38503.6364 31147.2045 43758.3567 43032.7419 66513.0414 40166.7991 31856.7263 46138.9642 43860.4241 47761.9291 37101.8334 37032.7764 50024.6640 58936.9283 72771.6958 42502.0619 35518.4610 65269.5103 43607.7880 33991.6201 68708.5513 73162.2474 67113.3738 61010.2645 55201.9806 46769.3495 55504.2499 51198.0537 46241.3017 52761.9775 45151.7833 47408.9719 64433.2130 59449.0964 61831.2213 52713.3389 77761.7674 77017.6365 79820.9479 63759.0662 65223.2339 63468.7543 63023.4900 66116.2863 61435.1427 45851.2969 39994.9191 43153.9403 44350.1419 44376.0237 45277.3488 39861.5161 38799.4752 40344.6062 48565.9091 49011.0891 46280.1461 44892.6206 38505.0764 41491.3098 43296.4962 41670.6373 45206.2487 50655.8685 43846.4181 48993.9389 44897.2618 46652.0489 40851.0335 Gamma-aminobutyrate / Aminoisobutanoate / 2-Aminoisobutyrate 263997.7437 204079.3972 168294.0519 5529715.1840 155032.9569 300630.4335 876851.4970 51396.2141 89187.7489 113946.7615 144860.8126 313056.4595 115720.8851 323150.8988 206468.3189 395378.9576 373877.5304 99047.3818 126958.4021 315168.7755 67485.5841 276660.6695 794487.9115 124521.5016 85897.8113 3107294.8200 70306.5423 80923.1744 133971.5345 229610.7545 1067521.4830 1284479.5500 177943.5557 255379.2860 546572.0425 1477504.6140 239871.1169 209992.0480 145610.6780 384440.2998 169984.0688 608027.6970 437273.4368 98996.9894 395897.6780 1814429.5600 296076.6080 292019.7766 136725.7001 217295.1890 385647.4506 77905.8686 177751.0297 4829841.1610 236580.1434 69350.9278 157181.1002 1277079.5340 7282407.9040 346057.8006 649462.2471 200981.4529 286124.3317 213284.4061 169355.3291 245492.7049 169875.4448 236652.3700 480119.1498 104267.5691 436359.5758 1088057.9100 98644.6157 501988.7654 4946416.2480 165006.4858 59742.3052 232813.2240 1132601.6600 145346.9584 321610.2321 171572.6490 369744.3548 252256.8346 264725.3652 3185850.8460 140787.3841 580732.1097 218084.1607 242330.3261 374088.0195 218805.2611 376430.8155 210985.4766 979031.2928 247695.0838 221159.5839 206050.4477 196334.3575 635802.8054 7566416.8540 72400.3345 1888155.7870 79210.7555 471899.8874 185201.2039 260171.5982 4064628.5730 480493.9965 208061.9443 84464.5561 200591.9283 259965.4847 270747.4365 288974.0690 111841.2922 94718.2515 3665348.9030 113392.4015 127536.6398 115261.6262 284785.0202 219559.1283 225347.9218 151805.8044 326480.3874 107942.0778 736288.8267 497743.4519 186044.8340 2209154.5140 3910281.7890 64387.5787 632535.2216 275724.5243 192399.5339 2278099.8040 142702.1974 240427.4432 83539.6811 378990.4402 212696.0169 140327.4438 500854.5816 235434.8615 234814.8920 237826.0940 182801.8895 117288.1958 343445.1560 618573.4467 295035.0214 234749.3013 255612.9302 71345.5484 385182.9184 246611.8240 356100.0187 281569.8147 590860.0239 113163.7561 132604.3647 349689.7399 650652.2373 750347.6851 765156.2169 745030.5837 747187.2642 751594.0671 724107.9704 739399.0572 734915.8738 761549.4467 740654.2068 773266.2622 797215.2000 772546.4323 838216.7348 850073.7613 770990.0398 734277.0212 280418.5313 280131.4673 269538.2297 274679.4370 266945.1566 286004.1226 307675.8492 296263.5224 299364.3212 686905.4481 677663.1886 714495.5593 650276.0821 688923.3614 660163.1883 619734.1141 658664.8255 655570.6778 739574.9711 730362.4091 758547.3637 754908.6850 686999.1231 746206.6913 710250.4340 804407.3143 792804.3582 802957.0837 810720.5067 828719.0439 742345.7375 764576.8843 733432.0607 Gluconate Gluconic acid 6443.8793 7611.6224 12646.3214 4063.5232 25844.7900 1209.2467 7474.9305 5068.7573 3973.8799 6921.5394 1456.0749 3529.3116 1567.3300 1982.7375 3162.2300 6953.7116 3133.2930 10965.2569 5651.8478 4105.2887 4144.5945 2844.5429 5604.4222 3269.0945 5116.9318 11429.9266 6071.9074 6309.3697 1342.7293 4364.3085 5484.6122 1527.4553 27521.8964 4266.6759 4125.3226 2209.1180 13999.7873 4743.0947 1600.7073 4216.9619 2059.6857 20154.5929 12539.7103 14318.7633 8171.3065 9327.4141 7455.3225 3348.7872 4005.3846 8411.1898 6515.6546 6069.2492 7308.1669 5705.8981 5817.0828 3769.0506 6009.4180 4922.1133 5212.9496 6441.9674 4927.8844 4884.8309 974.3650 3951.0539 3863.8220 3069.1923 Glucose Glucose 107003.4849 110831.5315 111344.1705 93646.5003 65544.2946 59633.7895 78410.9255 74201.1046 79341.8219 81730.5382 75704.1898 80196.5663 73661.5455 70372.5092 74389.0051 71340.4465 72108.0884 61564.6954 67419.2050 34891.5363 34578.2359 32683.0730 30810.3939 28913.2352 34505.4089 Glutarylcarnitine_R1 CAR DC5:0 813996.0450 2018841.6290 1835701.3700 705422.1422 916719.2480 733436.8936 1469130.0660 874787.6497 1359674.2470 506622.0534 1331669.3890 1751918.4120 461029.2337 1245239.8770 835849.0858 1479554.4250 1012538.1100 616315.8968 1015761.2770 1065108.5550 679213.8985 859160.0888 1763796.7200 542770.0469 1141890.6040 1003168.2610 1371638.1790 1428105.4750 1690025.6640 1434610.1460 943514.7790 854188.4939 427305.7524 770848.9044 760892.9862 1135459.3360 433807.4667 1168795.0910 372996.0063 1609194.7920 1221306.9870 726421.2086 372111.8170 1401633.7700 507041.4959 804800.0167 683762.9234 382678.4205 1105107.6610 802620.4056 483692.2750 1692950.8990 782642.6671 594853.1850 1053390.4540 1270704.2780 1192444.6960 659547.3160 800912.7707 1393419.2270 883369.4374 1433951.8740 953256.9102 719932.7260 933259.3822 859434.0526 1001841.8840 804772.6906 798260.8230 941413.4676 1090591.1860 1431131.2280 1131939.5430 634649.8515 1790102.2000 1222045.2260 788326.0459 873570.5860 776692.4250 539716.9559 1266393.2070 740808.7188 606570.9662 1001960.3970 916442.7827 1086794.8180 1200331.6630 887247.5887 688191.9100 1174634.0070 671750.0283 967816.0893 977047.0928 778653.3321 875563.3476 453295.2187 781692.4953 2263162.8580 1008295.6320 442969.5007 654980.2581 1148763.8790 965739.8582 1334591.1710 635717.3698 1272266.9190 1068405.3440 1687145.5290 607845.7788 919472.0664 790064.9993 1056211.5060 706342.9288 460247.5088 1550763.0370 1351995.7590 1102143.8050 1971988.8320 802662.4261 892359.2091 764756.0669 1968106.9600 1542057.7610 992262.4692 2077781.5940 2050157.4110 813143.6735 812270.6165 539084.6749 1012976.1660 1458235.1730 1302317.4940 743457.8193 581811.8263 801641.3100 624128.6866 541293.0634 1138806.1940 720390.7896 453906.3307 887878.9738 500861.1773 1151473.5170 1413758.3930 1298174.2930 1257756.7310 670473.6641 1198280.1720 1019384.6730 1163552.7170 775533.2335 716288.2273 1559208.9680 948656.0277 614721.7412 886719.7182 914526.5738 875022.5878 2147625.1610 1148457.5780 1575277.5920 658458.4396 1416104.8020 960791.8560 1051379.4930 1581030.1930 1501306.7570 1678581.2980 1622517.7030 1388778.1970 1402255.2080 1297292.2950 1270134.0090 1132789.8150 1162962.4640 1026273.0640 1157785.5150 1355503.5600 1290835.0500 1112038.0910 999123.1165 157165.4873 148685.1782 126025.7763 87427.8139 96481.6694 86040.3783 87609.4419 97476.5453 89826.6200 1014184.2720 975196.2005 1140861.2010 1079268.6300 1058277.1420 1102482.6980 897973.6901 849252.5362 902259.2351 882035.8198 871698.0594 862741.5867 823662.5106 800180.6886 868914.1335 865078.0536 947784.1706 1043935.0190 956974.6485 930904.3804 895658.7030 847536.8104 840889.2153 758722.3780 Glutarylcarnitine_R2 CAR DC5:0 833347.3863 2138344.0670 1841544.7200 674766.2577 916193.7803 717686.5447 1427341.2690 868147.4317 1364113.9230 646531.2597 1308073.8060 1746047.3770 473645.0939 1249344.6500 914975.9171 1431938.6540 983813.3130 691645.5079 1098177.3690 1070256.5350 746960.9115 837180.9802 1744418.1310 700386.2356 1130953.9220 994961.6009 1512977.1750 1461922.5480 1607131.4630 1382200.6170 902448.6411 789471.2003 499235.9261 355890.7085 854347.8671 1102959.5510 556393.9747 1160029.8350 307994.8625 1574597.7590 1151304.3520 687759.1940 353270.0015 1423814.3440 546865.9299 853325.4451 818153.1301 423387.3340 1089828.0400 758724.4204 419400.3834 1605804.4570 739441.6885 647986.9952 1122228.7640 1375509.6230 1222406.3820 723375.4951 773892.0010 1343013.8780 892449.6833 1465697.4260 1001941.1040 789734.1504 903869.0561 857251.9784 1014828.0700 799666.4016 813651.3930 892442.2723 1047454.7010 1466395.7460 1088908.1850 645865.2271 1820678.2810 1209275.8880 755182.7443 867307.4593 854206.6330 528364.6146 1252744.2030 825097.9842 695240.5501 991766.6580 908636.0911 1077980.2760 1184719.8830 888987.8111 683991.2795 1222044.8490 664197.6811 1024121.2240 964059.6501 768779.6855 855855.0691 446261.2830 767951.4846 2259519.7890 962016.2560 505544.0843 650940.9955 1216692.3520 940025.3927 1326563.8980 646599.3750 1255826.0910 1051230.0630 1669521.9690 590364.6027 891456.7308 768716.0829 1019608.3050 725952.1815 458872.0736 1572793.0390 1325319.8810 1200757.8280 1961773.8380 818648.1753 974807.9815 773110.3512 2019211.8590 1512148.6860 960830.5200 2164859 1966463.6360 781911.8849 783112.2531 554629.9139 975224.3630 1433312.0750 1270338.5630 790274.7637 533772.9852 797921.1070 586945.2714 561115.7238 1131765.8550 686951.0537 486911.7488 937563.2774 489628.1327 1131133.1580 1398769.7470 1277741.8990 1250167.8120 647480.3416 1165633.6930 978811.5020 1168470.0510 747792.3676 722867.0057 1540317.1670 935087.9560 583107.5388 870992.0743 887999.9630 841488.6977 2371006.7120 1149450.5420 1528245.4970 704400.2071 1334066.2660 970858.5211 1056777.3540 1659554.2210 1583228.3460 1728240.9190 1705356.1160 1415721.9660 1410808.4480 1333479.5180 1326494.6550 1201235.5460 1206161.1360 1063330.9070 1195047.9260 1408715.5550 1336753.6450 1164584.6240 1035012.5760 2083918.4150 2104398.8250 2425620.8650 1970681.7830 2087654.0520 1749117.6440 1476318.2010 1616990.3900 1584733.0860 1050480.4300 1133322.4520 1166871.1640 1157140.1200 1076997.6470 1230592.5920 907183.1079 855738.5788 900935.2001 879716.5612 854856.9035 865575.6886 826794.3113 811489.8229 973238.4968 860909.8176 945021.8104 1052941.1720 969502.1916 928293.1206 904286.8445 955746.1224 835191.2384 772739.5221 Glycine_R1 Glycine 123701.0339 113526.0394 96294.7280 343474.3629 119521.6951 194548.7655 46878.0710 296820.2352 142117.3181 133440.3084 113902.1121 59299.8167 135710.8395 78744.9430 120870.1197 114676.1793 99864.9108 181116.0107 128782.3781 253080.4977 93481.7161 209057.7886 296762.3111 172440.8564 90957.0525 148749.1349 78100.7015 126688.8109 137223.1495 176835.2298 161408.0663 77335.4176 124746.8759 80125.4986 99351.5192 100777.9995 95115.6300 149736.6842 121244.6314 61960.0980 104661.0028 139344.7993 113059.3773 134118.0447 117109.6394 134386.9186 186123.8503 111226.5504 141350.9024 105145.0589 160492.0868 141865.6139 108565.1958 59255.7367 156741.6678 113706.7329 168699.0006 162752.3560 117226.7522 148354.2430 116993.4713 113397.5974 168485.6237 126231.8882 57734.3462 113530.8863 147926.9089 104555.0311 82344.4070 91922.6683 84820.7661 167385.8577 136490.2557 114256.2415 175198.4502 78883.0930 135059.7456 120178.0531 258924.5482 112213.9956 94753.7192 142080.6184 123655.7942 121274.7929 180064.6510 164663.8413 76606.3817 112606.0456 55142.7250 194384.1691 248036.8186 140941.4194 141648.1554 143669.5481 162289.0009 105522.7324 148933.3598 99120.7321 209301.4443 163152.0465 298391.0308 99917.0839 65288.8300 87801.8257 101849.0462 140702.9176 55886.0149 261771.1507 106132.1770 155115.6137 118642.8596 82030.5401 74436.6222 105564.8896 130121.3876 107520.8773 93297.9701 137003.8631 96760.4617 155842.5833 53274.3594 96609.4293 167626.0255 219262.8164 238356.7954 110901.6076 96183.0655 145437.5364 91817.2123 215732.5952 159734.4209 85708.2006 99106.3546 176502.2460 150834.4597 72400.8757 119339.4586 73316.4422 150066.2554 95047.5584 106783.5858 106187.6091 125112.3587 63853.6106 103324.5060 99160.8923 58533.8735 111603.5237 134913.5892 96071.4771 250469.7851 129100.4427 182407.2152 112138.5052 97751.9862 124195.8935 111281.3462 136749.2423 99105.8456 168220.8762 64388.5755 184794.5917 138537.8611 207909.0510 122787.6515 131908.1190 129475.2368 127218.3680 132991.8382 114303.1498 112356.3096 132777.5191 128982.6678 132940.3942 131920.4805 123028.3678 122872.1595 162619.1083 150943.7171 129774.8758 118582.9147 96911.5672 89186.3197 96898.3945 96138.4417 100119.2362 95264.1316 116919.8074 112408.2208 111820.8612 114858.5379 116327.7034 118957.4568 115045.4610 115083.6340 115514.4877 109638.6115 108476.1223 102553.6533 151295.9763 141979.7257 140659.3873 146942.2103 131972.8803 145059.7795 133624.0615 149260.8276 163614.7957 163813.2247 156059.3254 154149.1066 141383.0053 139422.9942 122433.3874 Glycine_R2 Glycine 116928.7513 108054.1821 91785.4436 328613.5105 114442.3982 187142.8485 43744.9252 140371.4415 134633.8935 127141.6582 103444.7455 55479.3527 131505.7174 74268.8442 114486.9526 111036.7661 96017.3258 170975.8735 124155.6850 242139.3328 89725.4973 201673.8815 283263.6505 167060.3798 86480.1569 141742.7329 71842.1120 119538.0421 132982.6325 169344.6374 155388.1373 74114.8058 119782.6135 74886.4891 94813.4565 97413.6095 91786.4458 144521.7077 112816.1164 59573.5883 98924.1879 131746.3481 104663.9021 128634.9817 108853.4492 129976.5446 179002.2155 103601.3194 135449.9969 100504.6196 152241.7781 133537.3072 103905.2679 54142.4028 151415.9613 106644.6560 161346.2350 155607.5251 113627.5918 142658.2927 111376.4475 104622.0011 161289.4881 119465.8598 54539.5699 108822.4782 138745.0365 99454.3088 77769.6830 88189.5258 80649.9390 162239.0853 129337.4269 108583.4995 166409.6109 74689.0521 127687.9011 115007.7255 249409.5787 106492.3218 88958.3499 134867.7520 114374.3530 115363.0441 171360.1612 155972.7084 71799.2788 106099.0643 53573.0316 182947.0717 237915.6259 134887.7503 135269.3788 133886.0262 153075.9185 100917.1254 141175.2099 94866.6956 200386.5189 155888.8234 287654.2042 93513.8591 61037.2158 83865.5443 97788.4032 134454.1207 51933.8745 252584.7322 101840.1340 147166.2026 111790.1663 78157.1018 66735.5954 100521.4214 125140.2882 98315.7506 89691.4898 130946.0130 91203.4788 147994.4583 49803.0929 90814.0240 159042.9979 211263.7298 231698.1519 106199.4736 91256.8162 139187.2644 87611.0450 204751.5615 152100.5748 81239.2067 95765.5323 169190.1026 144130.6928 67967.5562 110908.5686 70258.7150 142429.9884 88169.5171 103192.9752 100945.0668 119098.9624 61431.8124 98651.9211 93344.6704 54656.9288 105861.7853 128533.6305 93054.3334 241629.4363 120958.0792 173168.5159 106859.4908 92709.6619 120815.1440 105577.3204 129815.3207 93975.0524 160981.4826 61824.2908 176702.7692 131452.7935 199000.7695 118553.0657 127908.1196 125633.1929 123456.3239 128810.1769 110659.4746 108387.9725 128144.0599 124333.2706 128658.1582 128523.2656 119035.7313 120669.6069 158001.5394 146481.1963 124230.3280 114513.2398 91334.4522 83526.9494 90834.2752 92149.5755 93646.1639 89827.8993 111164.2796 109495.2718 106304.4176 109592.0054 110528.8317 113263.5359 110480.4697 109345.8270 109008.5053 103828.6018 103207.8704 98771.9026 142850.0061 136136.5472 134562.1984 140628.2750 126278.9972 138546.6168 127545.8816 142183.4496 155715.9735 157175.4524 148988.3482 148435.5295 134807.2792 133772.6417 118135.5751 Glycochenodeoxycholate_R1 Glycochenodeoxycholic acid 61179.9075 9372.4096 228206.0223 5550.1944 11507.2183 5586.5683 27003.9017 46371.9124 52136.8974 72011.4728 7860.8909 188715.2723 33159.0970 21378.5316 87459.6398 56476.5418 86343.3095 53392.2672 135679.0239 94730.2517 17886.6110 23225.3704 50101.7834 155883.8723 48129.4386 57402.4517 54482.9760 324993.4899 87503.6169 46304.9927 85916.5273 17810.7555 48522.8477 30996.5132 155211.7533 87522.7984 38369.5847 153116.3358 55854.1934 128063.7577 23386.2655 18017.7512 40529.3340 78569.0137 11582.4974 107826.7499 16022.8713 38235.1622 5210.3967 9420.9879 19472.4230 269547.0164 53645.5796 18571.9864 27676.6959 167281.0030 89527.3082 35630.5958 15022.7937 205280.5107 17438.9312 126484.3218 80010.9012 70170.9078 33736.6660 19040.8356 24356.5505 32116.6308 5416.2157 57438.5278 73641.6603 132382.0667 147013.2161 32734.4411 41429.5469 142010.5484 14592.0038 23543.5266 255240.0116 31439.5581 42661.5201 16262.7028 25946.7209 18817.1172 99245.0341 63212.4033 125564.6012 4779.1856 4010.2041 115777.4213 47474.5953 30449.6699 28733.9265 44635.3464 27725.5466 5421.3470 34451.2873 182721.8688 200295.3463 39837.5786 6224.5719 86556.8510 17859.6276 23113.9515 32682.0561 135762.8672 40675.0073 142036.2757 22949.7033 19998.5264 135731.3962 27405.6864 58626.6109 40986.8621 150257.2993 4758.5443 48014.1735 32325.3074 115295.6313 14379.2645 64166.1773 34546.6918 173282.0459 9169.9229 173041.6894 43995.3402 114290.9239 16234.0593 76450.6195 212492.3183 18440.2283 110145.2252 38168.9558 36621.4008 57702.4181 79030.4005 67544.1298 119776.2699 10683.8294 23126.7312 27350.2507 3821.3999 90260.4159 25036.2477 309098.8287 8825.6343 4653.5949 33873.5518 10874.2885 17676.2261 104527.3138 37823.3603 160622.7306 20192.2369 18580.9309 20522.4824 38175.2196 56543.9471 74002.4274 99067.9406 16450.5265 114451.9383 78804.1003 4451.0092 322408.6263 99943.9907 101437.4044 96338.6777 101027.0042 82430.2542 77003.7029 78734.4139 83059.7366 74299.6763 77029.1736 71739.2145 80071.6048 93286.6466 86974.9858 83070.5991 78170.6147 62159.9057 62826.5299 62581.3978 54463.1091 53147.7051 43840.7963 55823.7012 53850.9930 58469.3555 73103.2310 74762.7264 80850.2218 74171.1192 75830.3420 73800.2956 71665.0275 67097.6456 63419.4556 67264.2239 65941.4714 71885.5900 66886.4280 63377.5128 68451.7683 64095.2887 63319.4631 68891.0761 61687.8341 67425.4551 62619.7447 58490.8534 65367.2276 58721.9475 Glycochenodeoxycholate_R2 Glycochenodeoxycholic acid 32430.7234 10400.8675 168502.9331 10370.3418 4260.6908 21855.9804 33771.7447 33424.8370 48757.4674 135292.6860 26291.8190 14502.1711 64580.4206 38497.3929 93144.8660 39706.8939 97246.7784 67255.8420 13951.3100 15050.7262 29532.2489 110279.7407 32779.7720 47162.6963 35824.6912 229311.4314 62730.4391 29066.9830 58543.1722 12540.1901 37134.4324 22268.4018 118639.0920 67046.8986 26937.5162 101666.6499 11001.4557 99325.1103 17335.1437 10606.4292 27285.9491 59609.1423 9904.6529 77815.2568 9437.9597 29768.3501 2785.3102 4054.5152 11388.5600 189216.2836 38017.4896 7487.9971 23264.6738 123111.7934 71466.9561 28791.4404 9238.2008 150063.8710 14425.1339 94364.2237 57704.9231 56153.2280 22565.3968 13785.7476 13890.0868 22614.7617 2468.0534 45776.3925 54780.5380 101785.6903 103632.1358 21064.3302 32853.3094 108920.5973 9822.2391 17232.4880 196059.1223 20156.4848 28174.2677 10179.1066 19618.6705 25570.5482 73879.6319 52921.0119 93386.7915 82782.5527 27647.9254 23134.4971 22891.3059 28707.1275 22002.6158 23344.1714 132432.0372 151379.8394 29233.7676 3792.7853 57937.8287 12443.7620 14484.2525 23836.8342 103743.1284 7961.7301 113950.3269 16762.2110 13905.6972 102389.5892 14180.3109 43608.5343 30711.4157 120442.5839 3787.0552 32530.2758 22149.4092 78598.8752 9117.1915 41424.9663 24558.2533 125272.4825 6369.6117 126073.1498 31514.6614 78052.1887 55162.3034 155327.7389 12937.2009 79475.3295 31864.7632 27522.7608 45528.2905 52929.6693 48442.4936 90179.5907 10438.4625 17480.1371 24864.1182 63626.8473 16331.9430 242219.4198 8076.2929 25684.6993 28694.3920 14579.2465 82931.5553 27659.7664 119491.7844 12773.2725 10783.8316 17643.1120 26342.9092 40449.4845 52284.5371 71296.2538 12658.0318 80395.9394 57130.0155 231615.7502 78108.7742 73562.8023 74652.1505 76382.5937 60879.4269 62523.8694 58263.7547 57638.8916 57302.3264 58729.3084 54236.2960 61516.3638 63548.3286 64082.6259 60206.8012 61068.6644 40634.8971 38567.5568 38801.7408 29216.5619 30477.0033 28448.2897 33086.0913 32329.8798 34680.3227 57103.4515 53429.5603 58500.6257 56297.3911 59549.5381 55652.1232 49370.1246 47666.6640 46704.7595 49205.9022 51324.1746 51955.0903 49174.8855 47860.1350 49218.3745 47150.7253 50199.2636 52676.5111 45145.3439 44046.3637 47232.6223 43658.8942 48641.3254 46853.5496 Glycocholate Glycocholic acid 28044.5494 28477.4884 30605.4590 79721.2989 40473.7268 29997.3534 32977.2618 21295.8691 88632.2148 15354.8169 15983.4132 48160.3778 16582.3133 31814.7797 22589.9696 25879.9519 191669.8170 42619.7868 46350.3555 45094.6077 33047.0070 47377.6786 131871.8597 89551.0286 43922.1003 20960.5400 23004.4577 147032.5274 83790.3911 81674.7292 61689.6076 38153.3123 15786.5912 20696.7190 39571.2151 61024.3398 22851.7526 48002.4292 38167.9353 22368.1139 30188.1713 37488.7435 54489.3433 92925.3375 15572.6823 28997.7389 29980.8441 24675.1925 29356.8973 41557.3521 54982.8170 145301.4573 30960.7984 26872.5130 21333.7003 65164.2247 38511.4036 15869.8727 19137.8522 35455.3647 20826.0235 14431.9034 26829.7537 63258.3267 41004.1796 24286.3011 28130.7530 69599.8673 15781.0714 61731.2666 14304.3034 143380.9897 37452.2145 19667.6931 45294.3702 37710.2689 47055.5030 66442.4322 62489.0970 14144.5553 48651.1743 36819.7638 24573.5365 55197.8420 77845.8823 34311.4525 87387.4700 15876.3618 16804.5050 79746.0213 28058.6292 18608.0793 45016.3612 18735.1532 25598.7560 20830.9009 47112.5243 48799.3012 65154.5621 25972.4231 20331.5509 37585.2095 32431.8756 86491.3434 20857.4637 61429.8020 82295.3453 56756.4365 17613.3284 13698.2038 23893.8204 17714.9530 51721.5876 24814.5373 81645.0969 16375.7932 53517.4615 25062.2178 42790.8095 56137.1372 49579.9471 34788.8470 42227.4622 24261.8875 28909.0669 38994.2847 44818.0457 31797.1261 20620.3742 42543.0631 32781.2461 33050.2635 29898.5500 17116.3819 40630.3160 30160.5779 26320.3726 77361.1506 32553.1782 74804.9356 44865.7573 14211.5752 58823.2658 12011.8954 71095.1689 25152.5313 14294.8816 35689.7305 64097.3719 19546.8944 93774.5128 92889.9726 45209.4111 24439.6969 25881.4390 145422.2632 28887.5791 25722.2276 37915.8911 39986.2080 66269.1426 20132.1877 31124.3450 13312.6922 52234.6029 42057.7316 40228.7628 39171.1429 49704.0866 37877.1314 39721.0475 37053.8668 38280.1739 39939.7449 27389.1225 33667.8475 39791.4429 44830.7590 37134.2162 41627.6117 34513.1247 53653.5415 12506.4919 53978.4240 48642.2324 26558.5552 42973.1468 49546.5634 55536.4927 46432.1248 34055.4818 37800.4557 57355.2073 41744.5803 34807.2017 46314.3767 39084.7821 33077.1421 34378.3547 45464.2723 36766.1074 36682.5310 38288.4922 32350.0398 33747.1944 42093.4430 34179.6662 43740.9536 35789.5940 43399.0062 41520.0304 30284.9844 38543.2861 43678.9061 Guanidinoacetate_R1 Guanidoacetic acid 10017406.7800 12730981.3700 9045886.7080 32602688.6100 10945883.0300 19107884.5800 4060908.0740 32102106.2700 15838778.4900 11961453.4200 9411166.9660 5767778.0890 13480854.4900 6943516.2420 11814657.7200 13512305.0400 10420070.0100 15937368.6800 13253626.8900 24170089.8700 9323406.4150 25034236.5900 33259546.2000 18211214.6600 8953500.1220 14069882.9200 5658729.7420 9368482.3990 15811876.8200 15515736.5000 14449586.6500 8210134.3200 11716834.4200 7874280.5960 8065491.5560 10833674.1500 8461194.2290 15217189.9400 9039294.7170 6529083.9830 11190865.3600 11385116.3500 7412963.1500 14944084.7300 10582433.9700 12853329.8700 18145562.6200 9684471.9520 16032792.4500 10529274.7900 14117200.1400 10136383.0500 9978611.3560 6184240.0260 17162207.9300 8752656.1970 16180574.6800 15412289.3800 11952896.3500 14636657.1300 11090371.4900 7661342.6070 15348317.6700 10189305.9900 5285099.0710 9005163.6540 15662499.8400 9873545.6050 8179994.8490 8564570.8730 9969069.9220 21266614.1100 11366000.0600 10127197.5000 21604682.4900 8606698.2280 12645935.9900 11166577.5000 26210352.7500 11389590.1600 7927925.9530 12212908.7400 10125862.4400 13758382.3400 17735522.4500 15191530.0200 6091745.0730 9494416.9420 6157025.9700 13307491.6600 23597464.0900 15550713.4300 12824714.1800 12270133.0200 13135673.0600 9700458.7090 12948549.4600 9523112.6700 17789673.6600 16268273.0300 30465141.9700 9368678.3450 6436858.6070 7929598.7760 8911945.9640 15973329.4700 3458559.5140 26210687.8600 9408161.7710 13653531.2700 8660066.1620 8926521.7080 6048451.2310 8630421.5720 14338176.0300 8985205.2060 9346135.7700 15489953.2300 8497280.5750 14902177.3600 4684095.4320 9539605.8520 17049877.3800 21108233.8200 30876584.8900 8764962.6000 8098636.3400 13309400.0500 8696273.7790 19357278.9500 14662212.2600 7050674.3570 7815985.4250 14839944.7600 14045058.4400 5491684.0340 9164270.8720 6050338.2180 14235354.4900 6696885.6580 10621396.5200 9499094.9170 13168742.5400 6806300.2570 11136599.7300 9646235.8980 6381797.7440 9374178.6980 11732403.3300 8842384.3150 25792013 11700527.6000 18429203.6100 8920059.6870 9419620.0490 12656082.9300 12285116.9600 12733780.1100 10829173.9600 18142038.8100 6844284.3150 18156799.8600 11689850.3900 20471809.6800 13998850.8200 14352151.6300 14230638.4500 13874412.1100 13534926.7400 12281054.7300 11569131.8800 11760942.8100 11176825.7100 11842574.4400 11697935.9800 11182193.3000 11400505.3800 14752095.8600 13758710.2000 12266059.1400 10885600.6600 9902557.5760 9546549.1000 9876555.8350 8392091.7830 8762161.8880 8485636.8110 9972070.4380 9763219.9240 9841633.2140 12579913.3600 12717994.5100 13290184.0700 11994332.7400 12560559.2200 12439078.3400 11542879.1900 11363738.0300 10905448.4700 12393032.2000 12422878.5200 12577354.7700 12772663.7300 11514884.1400 12351589.3900 12043616.0700 13472540.6100 14436532.7000 15136101.6300 14338070.4800 14201948.7400 13369795.8600 12803660.8700 11524390.4300 Guanidinoacetate_R2 Guanidoacetic acid 9515037.7380 12184679.6500 8582791.0780 31189105.9300 10505744.8800 18251873.3100 3812483.5560 30786686.2400 15241153.6400 11381505.1300 8981223.6850 5490701.4200 12934449.5600 6464900.8800 11278203.8100 12988747.8900 9954922.3950 15254827.7100 12745039.8200 23209274.7100 8897371.1990 24130528.9700 32041089.8100 17535348.8400 8501882.8660 13215330.4200 5340867.5800 8884365.2840 15082356.9800 14839107.2600 13804496.6200 7797255.4510 11200905.0700 7539058.0520 7663441.8060 10392693.5000 8042073.4570 14420432.8600 8609648.7450 6012442.8630 10711167.0600 10879657.2100 6971169.2130 14358606.5000 10120623.6000 12235259.0400 17408455.6900 4462681.5950 15382621.7400 10003803.5200 13516478.7900 9603940.6920 9520235.9290 5901876.1790 16553045.7900 8271946.0990 15342714.9100 14690312.1800 11483505.1000 14009517.6100 10615669.2500 7230603.0110 14584850.4500 9784357.5010 5029084.1050 8537414.4300 15028622.1600 9443512.8370 7814279.3420 7982818.1800 9546119.3850 20468714.7300 10758445.6500 9669533.6670 20809073.4200 8126132.1840 12069063.5700 10682671.0500 25028944.9900 10942186.7200 7517257.8630 11613415.4500 9629091.0130 13250234.9900 17006256.5900 14325661.5300 5559718.9450 4058588.4630 5844560.3330 12613653.8100 22627505.2900 14986176.0900 12200759.0700 11748258.5700 12487951.3200 9301210.6350 12308591.0500 9119958.5390 16849072.2400 7538771.7790 29250730.8300 8903181.8260 6122550.3690 7392502.7680 8497097.9350 15261090.2700 3208792.1280 25049129.3900 8991279.4330 12925341.9300 8257335.7070 8501109.7610 5732658.3080 8239787.7910 13628673.8500 8570732.5190 8871635.2580 14857819.2800 8080524.9110 14269615.4600 4424770.2830 9122347.8840 16280026.0800 20218760.4800 29797504.6300 8260521.9680 7698332.2380 12699275.3900 8312449.5720 18535214.4900 14018825.2100 6718346.2660 7399557.5930 14187331.2000 13434320.5100 5086031.3340 8739747.1700 5516279.0870 13600051.2400 6310492.9670 10110223 9105963.0610 12658276.4700 6470765.2550 10699454.0500 9206272.8370 6065734.4200 8827807.3330 11135854.5600 8289949.5360 24737585.6400 11236665.7500 17597697.7200 8467069.3740 8965590.8450 12112230.1200 11718477.7400 12080571.8600 10329683.1800 17457396.0100 6534705.7430 17298873.4700 11111408.6500 19555862.1900 13430606.6000 13617416.0300 13513596.6800 13158589.6600 12825179.9100 11618106.8900 10932196.4800 11092504.3400 10536843.4100 11155401.2400 11020269.2100 10511640.4000 10724873.8100 13917468.2100 12980940.0700 11572471.0700 10279203.7100 23603.5542 10936.6968 6265.6266 28002.7067 4891.7818 24090.4286 10166.0088 7824.7362 22437.9308 8437.5536 7934.2193 22516.8550 8172.7508 7140.3340 17518.3187 6505.0638 3761.6924 9238797.1980 8904886.9650 9246015.7300 7815351.9940 8160436.4610 7885003.2730 9277804.0060 9067952.6870 9157538.9840 12057190.2800 12177980.6900 12748388.3300 11482715.2200 12029240.6100 11893262.3300 11033120.4100 10893118.0400 10410340.0400 11799933.1600 11811827.7100 12001446.5300 12176323.1100 10958076.3700 11775560.7400 11467080.8700 12825465.8000 13763482.9200 14424089.6400 13665263.5400 13541240.8500 12753053.6900 12219015.4800 11001635.5100 Guanidinosuccinate_R1 Guanidinosuccinic acid 378068.6956 587842.5653 451702.0151 471961.8532 451969.5704 572512.3167 1461913.6880 719970.2779 260325.5948 738406.0950 878473.0950 636465.0536 614552.8090 474718.5686 697647.7050 697375.8522 367504.4018 615208.9397 431100.0998 725710.4478 527621.9465 260276.3339 502119.9615 336588.8732 542727.6661 1692203.9310 660704.9109 977437.9197 519250.4401 1173499.4320 577637.2110 585555.1370 771772.9464 794754.4795 591696.5329 1282964.0970 421533.4005 705909.1658 377478.1878 621438.9461 1609889.6880 391330.7430 347263.2267 729692.7469 584433.6833 685361.2996 564322.6848 321123.6111 880129.1423 817484.1334 623349.0609 1126622.0350 839573.7766 522306.3031 407240.0917 787565.8493 1488814.6540 296252.9949 544960.4265 406996.4725 1032951.8880 1130086.4080 760512.5870 447280.7917 897416.8104 591891.7528 419722.5587 380569.4508 962487.1752 1403308.7090 573070.7311 722003.9382 367142.3115 938986.5762 1414513.2690 1145028.3370 493902.8113 791579.3186 809170.8840 407847.4648 731598.4355 566451.0481 540279.2297 525591.8859 579569.6833 2184114.9750 868570.5279 1303142.8290 1330240.4450 369631.8943 556538.0198 351208.2814 1117894.6190 659977.5439 905580.3415 273791.3107 570407.2535 759528.7248 532695.2795 523195.6264 509693.9503 874137.2159 378380.3842 1784595.6780 783291.4934 343913.9067 383659.3530 415545.6366 472102.8073 646761.8115 249844.5003 794988.6789 758421.6920 318974.3103 795502.6361 909582.8482 554196.9716 1104252.7160 276891.8824 575754.2739 456248.6271 1764227.8660 505530.3599 386781.6100 601969.1546 847957.9961 273249.6197 518984.0592 650182.1340 554887.1393 1020070.6750 1376202.9740 563982.4039 1166657.3220 400138.0596 900394.5929 932619.6771 827183.5866 629778.9942 623049.9543 882444.5110 280414.5161 529191.4138 827274.5072 843458.9957 816344.3162 1209107.6690 1300133.7440 786665.7866 660433.4666 700246.3255 299328.7425 525081.4587 594672.2344 484377.5647 1282654.6630 315377.9420 1500847.0630 1092482.4340 510972.9206 557225.6673 566466.1732 907434.2463 387990.8407 1033035.4640 678417.5640 676241.3206 659381.1196 686720.1403 631313.8640 570504.5642 612303.9082 579763.1357 601679.1678 568391.0348 526925.7933 527438.4844 701974.3797 660445.0271 654098.4911 615570.2831 491557.3163 466359.7585 500165.5093 473569.1181 510514.1709 496182.7214 492528.0407 489486.0896 500008.9367 433620.0906 430090.2609 545925.0149 355963.2807 528482.3939 576064.1261 510895.5565 505687.3456 492462.1644 618891.4777 607481.6314 641444.9935 664854.8240 389172.0607 647956.5970 547065.2997 754609.8508 801209.2489 625642.8529 580600.7931 695422.0639 669924.2525 677587.2563 640539.4311 Guanidinosuccinate_R2 Guanidinosuccinic acid 372454.1097 554049.3601 422306.3078 446812.6673 427595.6672 541699.6861 1376175.6680 693605.2271 247122.3532 700850.0283 848236.8738 602307.3432 585017.2329 457967.7353 679391.6741 653575.0645 345747.8766 580344.1013 411398.1450 703935.7215 496386.4724 260223.1183 501792.8612 313761.9212 511690.2519 1580310.1200 637524.0807 918021.3071 501824.8113 1126867.4410 559916.1488 555630.8321 716394.8161 754469.4469 558596.7184 1238338.3970 410866.6577 660310.8305 357776.7710 594420.6572 1558648.3380 371615.0997 327042.8593 705177.7712 550949.6626 645885.8544 535006.6475 299212.6194 809127.4425 778563.1173 586609.7457 1077453.6090 796627.4452 502595.3686 391704.3462 754203.8451 1431535.4530 282895.4783 520038.6740 383343.0217 964057.6256 1064794.3520 734480.1078 432457.8194 860889.0984 565452.3997 399659.4947 358348.6514 914830.8536 1323506.1390 552717.4834 699745.3256 349393.2193 884246.9716 1357752.7480 1080841.7270 483309.9326 751256.8044 766463.8301 383506.2191 699207.6822 529760.1774 530308.0147 497210.7076 553685.9533 2044199.4100 814614.8355 1256196.6620 1266158.5810 360753.5968 525251.6400 335733.6977 1067220.9390 631260.0635 859703.0879 264553.7097 552055.1142 726278.3750 505929.5313 509703.6375 482180.5709 847346.5766 362408.2236 1712137.1650 752711.2708 337039.7747 354995.2222 389713.7106 462960.9010 614288.7067 238911.6798 764320.5608 713418.7299 315470.8197 753390.3911 860646.7332 541231.4504 1079388.9330 266526.9425 547072.2504 425890.5403 1698130.6420 483180.6662 367881.5827 572074.3056 808154.1746 259278.7280 486830.2144 611368.5961 528131.4636 964927.4976 1325338.8630 534989.4783 1125924.2850 388073.1849 856682.6721 853871.6100 790762.6826 601981.7263 584663.9649 843923.0009 272766.2094 497720.0784 771985.2906 818714.0775 769200.3591 1163366.2070 1239113.2170 747532.5292 631165.7758 645750.3280 282166.1413 498999.7136 559671.0667 463594.4811 1201980.7640 297846.6088 1444341.5810 1047069.6220 491984.4685 532708.6506 546567.9181 864913.4442 373068.9814 955611.7383 650902.2778 666421.5248 630744.1512 646674.6853 587113.4152 526682.5765 587636.4490 559043.8174 567586.1814 539092.0084 501344.0472 507425.7443 673294.0857 636378.3921 625095.7201 597572.1498 6113.6074 2730.7657 7690.1417 5850.6394 3063.9883 4150.5343 4956.6976 5074.7516 2208.9124 464032.6551 457825.7394 475313.3145 449559.2850 486985.3947 474195.1530 481115.6809 471706.0773 474403.3658 409163.1455 408260.8898 523251.7550 343633.5862 507943.3671 539946.8131 497536.4742 485610.6420 474948.2752 588803.6981 579569.9445 612141.3891 646183.1486 371122.4727 621494.0494 510337.5475 710129.9903 752544.8645 602196.6735 555288.4537 654811.2928 656441.4109 634790.0004 606857.6013 Guanine_R1 Guanine 146836.8475 84609.6580 113831.8714 100913.0581 427503.5152 114770.8073 145000.7230 354060.3546 213415.8349 186614.2774 80089.4433 22363.0969 202693.9365 84499.2271 165532.6751 582346.9529 110138.5241 299592.6884 193781.8888 128806.4353 386742.7546 521729.4915 86020.0985 162755.9689 87159.8183 77022.0686 334491.1635 176121.7514 108108.6600 186341.4343 316900.4444 340365.9033 225589.6579 315002.1692 281213.4710 120165.4296 214329.3921 62109.3833 99003.5615 532948.3729 413764.2059 133127.5349 231050.5131 153067.9419 116874.8917 404870.5322 362451.6431 202579.3149 193032.8674 169231.1252 379096.7429 154955.0649 222652.2887 276567.1378 503068.8442 536067.2925 148062.3189 378826.7776 463429.9012 47737.2750 681094.8586 123166.4045 29816.3917 245949.9537 187674.3889 173628.3475 409309.4468 291290.4837 211180.9859 362940.7319 391063.8401 193733.4418 133939.1764 108067.2834 81844.7020 159938.1416 296829.0484 213334.1568 286474.9757 152011.3676 200699.8027 472045.3091 358750.0593 217259.9920 302555.8779 71961.8533 129403.0728 262043.9463 303132.7324 545341.3994 416144.1038 451068.4481 88368.4893 305630.0547 247774.5149 172116.9249 151556.6673 164310.1097 57618.0558 77075.8488 302771.9255 463576.6631 396419.5055 50255.8176 125229.6216 349087.6128 539319.3473 264714.0655 248893.6717 188783.3233 415759.9544 107732.8040 83524.8634 217041.1199 64735.8101 81279.2933 92718.7632 276306.1731 349114.9908 84309.1683 252765.0357 105552.3497 192137.7111 247182.7181 102798.1514 66872.0666 348558.0866 277569.4193 135865.9112 136493.8227 553581.6429 260676.8181 216350.4931 107078.1021 54288.0799 267129.9574 9756.0117 151560.0766 155164.6434 219473.6493 70369.8318 163208.7559 725575.2993 193390.0796 407887.7322 220102.8123 334457.5166 329240.3403 88676.8696 88334.9082 229485.9203 250583.3977 170212.4252 174923.7528 332494.7396 31246.6108 192567.0447 164631.0009 64807.4085 447488.8899 41182.3888 141819.6027 542063.6308 152673.7540 178518.3977 51272.3352 58397.2055 57647.2989 60158.2825 41987.8201 37289.0247 33206.1991 37085.7757 48565.6499 44103.2109 42115.5744 44021.8921 41215.7095 37585.9352 37687.4971 37024.5749 232748.9773 223890.0485 239748.6920 178478.6328 188501.4347 187711.3251 167629.8031 176278.0969 174914.5842 292361.0543 298476.2763 276191.6384 272695.6051 258677.0428 259107.4055 212299.8445 211350.1853 213438.1753 242027.5281 240862.2238 207956.3598 210825.9305 223310.4071 220085.9648 211239.7385 214286.8147 211798.7262 221806.1375 215846.0423 195359.5754 197677.2671 171937.3771 165540.8654 Guanine_R2 Guanine 50426.1948 82933.6780 42720.4402 109113.6542 97533.5313 68995.1902 34087.7983 58008.2036 68079.6846 76203.0688 94971.1071 99732.9942 45312.1004 94964.1583 86096.9018 66021.5051 92918.1770 59284.8466 71644.3090 87287.1102 53244.8072 78446.5671 49280.6312 198196.9329 64800.4575 53531.8777 77739.7897 93402.2466 297305.0846 62581.7412 91213.9293 111695.2801 97381.7777 62935.7654 158741.2621 47468.5558 105275.2100 91355.4653 74009.1203 44086.0807 63412.5573 114397.4677 107244.7363 50280.8383 77234.8812 47973.6301 99798.2043 50157.3010 43265.5454 54750.1094 80542.4254 61255.1315 111622.3437 85216.2890 56690.2825 112876.2851 66639.5422 68304.7581 39787.9063 81575.9499 105943.7447 53387.4661 36319.2977 110574.3645 83682.6578 18858.9189 87811.8054 69558.3280 46699.5281 106541.1110 106094.8805 111308.4421 42517.4038 78056.4798 94185.8820 88705.1647 96516.9683 45356.2354 40268.3636 89607.1000 86785.7382 83762.4833 78602.7398 78219.1901 56594.0692 69758.0276 71165.1148 70024.6786 75291.9555 59174.4606 54728.3402 Guanosine_R1 Guanosine 24497.4944 28026.7648 18311.5537 61094.4076 24030.5863 46978.2488 19389.9485 29298.7195 16383.7114 33398.8344 31895.7772 24881.7051 25025.2673 30092.4933 64345.4152 49262.5736 5941.6970 48372.5750 21283.1550 26991.0891 20618.8336 71649.6251 16197.0672 16961.7833 22284.0234 62314.0776 23654.8282 32799.3265 14938.3365 49817.6920 42128.3361 56893.0491 11549.1842 30733.8387 11919.0065 10497.3015 26812.7024 30526.6443 5984.6258 28638.9122 63666.4181 9892.1592 14123.6756 7476.3519 18842.8024 38118.8298 39068.6669 21449.9001 16641.2864 18521.5457 14590.5892 30914.4989 24685.9693 12733.7600 31785.7750 61374.8486 64799.9219 35493.1154 16421.3851 19310.1783 27652.0929 48735.5162 41071.2312 37338.5379 23041.9539 36397.8012 31594.7135 46045.7899 11230.1732 36207.7481 30213.7385 57262.1118 58420.9093 15362.8986 25365.8010 16060.6492 14192.4591 14149.2903 24391.6524 31239.1974 22819.9677 41448.8765 21958.7540 27617.0124 7453.8160 63353.2653 33069.9206 15508.0809 26332.4139 38661.6086 10620.6958 32155.8524 31366.4630 9716.2943 24646.5656 25514.5960 28631.9076 17151.0329 13182.6438 32127.5357 57001.5271 15674.2235 18543.1840 59774.8894 16134.3344 50465.3789 257674.4548 80910.5755 40628.0214 30117.1327 46764.5390 31105.1869 32090.6507 5713.1658 37203.1102 30923.8209 27134.4500 34857.1313 22021.0696 23750.7101 10985.1685 24553.3725 49869.5103 25941.4126 36005.2308 45743.6552 19495.4887 21311.2346 26249.2710 13356.5974 37455.0703 7714.3003 27745.9668 34062.8783 36520.8179 33007.8279 15511.7245 36102.7042 32381.7107 18611.1183 31793.8247 23171.1225 43006.6862 21533.1111 11733.2900 20442.7825 25670.8157 37482.3331 17148.6632 29803.6394 12910.6181 53020.3607 44735.2881 36528.1408 14334.4363 13313.0319 9580.9663 65043.9460 22311.7448 66178.2138 18763.4685 21771.4096 17633.8466 7962.0507 53765.4019 25078.1829 26935.9721 28291.3801 26489.4615 20766.1356 20425.1419 21331.6569 23584.7506 22639.0945 20515.7630 21016.8057 22955.5796 20603.1431 21758.3477 23898.6747 19504.7043 38490.6667 40722.5439 38226.5252 33610.8846 38392.5236 33773.4945 30164.3133 29443.3197 32378.1496 35975.6505 34308.8457 37334.6589 38772.5753 37062.3577 36264.1255 32051.3610 30934.2637 30028.0174 35001.3822 31833.6652 31929.5806 31136.4946 32104.5428 30579.1483 29883.0591 30036.1735 31536.0294 28409.6092 29526.4572 30142.5482 29933.1646 27019.4752 29832.8416 Guanosine_R2 Guanosine 21384.5978 24407.0238 15525.9296 51874.6121 20924.8698 41526.7507 14033.8754 25263.1756 15030.2585 29162.9649 26181.7378 24127.8033 21661.3326 22353.1313 54969.5525 41997.3525 5409.4709 41577.1375 18208.1263 25343.5461 16135.3166 62682.6084 14915.5334 13002.4955 21613.3128 54228.9176 18852.9917 27511.6675 10618.9067 42651.4388 36480.0207 47070.3682 10013.0475 26009.7276 8396.5487 7335.7268 21172.6159 25762.6876 6998.1377 23765.3680 54606.8333 9264.9169 11461.8037 7575.2776 15918.9632 30704.5294 33573.1092 17556.7728 16145.5317 13376.9650 14259.7210 28289.8538 18951.9375 12970.7121 25295.6325 50564.4875 56094.9198 31137.4092 14470.6353 15130.8502 25112.2455 42161.6488 34339.1661 32220.8756 19382.8733 32346.4986 27776.1174 37782.9416 10368.4660 17112.2918 26688.6390 50741.5056 50109.9095 15880.7579 23510.0960 13520.9182 10841.6713 12011.6651 20842.9532 28002.1182 19493.7063 34997.4556 17636.5337 23083.3654 5234.5811 55498.4528 27474.3126 11885.0809 21499.3247 35165.5875 8519.8071 25408.2145 25653.0209 9398.9963 22074.8603 20829.1050 26159.6665 13465.7509 11449.2971 26986.7910 50327.7700 14690.1343 15024.5342 49529.4389 14151.3795 43844.8892 233805.1450 73742.1032 33305.4414 26424.2847 39289.6816 25166.1273 27629.4557 34695.4120 24852.4430 21759.7445 31231.0102 19378.7262 19039.0439 11207.1951 19375.1389 43394.1706 22147.5406 35665.4840 40683.7329 16529.2788 16543.1797 22764.1512 14245.4460 32633.0454 5898.8227 24782.0650 27146.0988 29548.8401 30368.6982 13268.7770 31444.6174 28380.7990 14841.3595 27185.9788 21311.1241 34435.6966 19620.8105 10789.0599 18863.7630 21280.2168 31414.5023 14470.7259 24255.0910 10950.0978 46282.7388 38104.4451 31778.9764 17171.6899 12615.1018 9660.8349 58558.9103 16274.3214 55887.0900 16850.0416 17946.0471 17577.8428 9331.9367 42857.3647 23239.0893 24160.7552 23758.6249 24792.6764 20251.5569 18477.8791 18583.0350 18405.7422 17870.7316 18020.5389 18652.9709 18189.2109 20361.3956 19010.1867 19616.0048 17448.0618 36600.1544 41058.9766 35538.4511 29402.9103 30003.4645 29961.3109 26178.5850 27833.4226 28125.4267 30502.8285 30878.2641 33545.5731 32027.4935 31660.0959 32091.0460 27479.7679 25255.4816 26133.8589 29543.0749 26564.5663 26291.0259 26896.2978 27495.2570 26314.8017 26992.8928 26055.5466 25496.2669 26257.8924 25544.6789 25220.1045 26816.5001 22808.1821 25174.9358 Hippurate_R1 Hippuric acid 2608358.6410 1356997.2580 4664619.8720 4762888.1870 3029621.4290 2606674.4650 4884105.3250 13332768.1600 3996944.4800 6753103.9450 2307572.6900 1538633.1270 2115940.7850 2265048.0310 2187140.4320 6003435.1910 669233.5454 4949685.9420 4570517.7070 6359695.3460 5586385.0770 1226329.5980 2796877.1230 5914330.8830 3467029.5560 3965266.7770 3087321.1600 3558022.0890 11188241.9100 2634563.2010 3366655.9670 4965822.1310 4521117.4340 2421585.2360 4097271.9780 2252636.7820 3248315.8560 5910473.4100 1231553.4740 4249055.8830 2964205.2360 3917141.2070 1577995.7620 9991050.1240 6894381.2480 1716792.3550 2710953.7800 3906973.1040 6697636.3740 7806629.8160 1854246.1200 3476551.9180 3403639.9530 15620035.9800 1975082.9790 6303415.8110 1285183.3360 1909425.4340 3891585.6390 4614637.7690 2204771.3970 2443192.5470 4699245.9380 3649462.3520 3622692.9420 2838744.1590 1733674.4700 1631709.4310 3467603.6460 3706882.5050 4027871.9590 7031550.0260 5617723.7320 5026364.6480 3758727.9870 2368674.2740 1578897.0940 3482401.3590 3768369.3970 1608901.8690 1493740.9770 2574168.9510 2751054.0950 2356717.3070 7086434.1800 4200321.0210 3034903.7380 3865337.0590 1742887.7560 8019565.2920 6582058.8920 1831488.8240 4291131.4540 6125629.2540 4155666.4800 7878044.5010 9879609.7530 6769091.4510 3254044.3430 2547881.0540 2534839.5600 4416619.1710 1257432.1720 4264951.1060 4973262.7380 3827425.0070 522619.3517 7952817.7440 1258377.6350 4893589.4320 1475215.4250 1704819.2280 1900311.6720 5340045.7040 7894546.1160 2180562.1850 3903520.0990 3826335.0090 2135680.5110 4686809.4450 12398852.7300 6017200.7310 3364243.2650 8056062.3780 1702821.6000 2195578.8850 2016846.5710 3919517.9220 3973777.5130 6531455.9720 1490253.3150 1023784.0290 4592958.9890 1909354.6230 7304591.3010 6532558.5090 1804282.1470 3108830.6920 1907905.4080 3366596.3050 4127645.8310 7811928.2350 7057705.0680 1156177.3740 2494332.2490 3798068.9220 1778737.4530 3623717.0860 1058868.1020 1001166.1720 2558130.0960 3329324.0210 3523048.1350 2930567.9410 5326620.8340 1700943.7440 3143857.5040 8827749.6840 3906165.6280 8461201.1890 626924.8483 2181107.0700 6407381.8150 1943860.2130 9240144.6390 5707789.1990 5807860.3310 5981520.6240 5929687.8670 5228177.4570 5255934.7590 5338676.7490 5397941.3180 4946393.4550 4782879.4050 4573972.6630 4922153.9810 5804284.9740 5612333.8210 5382775.0270 5139954.6120 6515761.5240 6387028.9700 6420891.4790 5923311.1610 6084367.4480 5727419.8010 6190039.8410 6098916.3720 6269276.2940 4534994.8400 4450564.1620 4877677.0810 4644153.2460 4881700.0380 4693173.2830 4297397.7350 4348385.3420 4223770.5620 4611020.3020 4658085.6580 4543960.9240 4297244.5550 3829316.3490 4056572.3160 3857135.6940 4096912.5720 4293715.1530 4885746.7450 4663674.5560 4942281.3520 4585277.8530 4747292.5120 4673054.6350 Hippurate_R2 Hippuric acid 2454752.0940 1289928.0200 4446782.9070 4485326.4960 2863873.4280 2474214.8260 4611536.4070 12477763.6000 3812285.8690 6387987.0480 2201550.1600 1458616.0850 2008458.9490 2138845.1110 2074567.1600 5705681.2990 632421.6907 4655940.1410 4436511.8240 5950980.8580 5334330.0060 1162380.6190 2665942.8800 5605694.4880 3287379.3630 3752131.8420 2924084.3170 3368290.5340 10628669.0900 2464500.9250 3179706.8300 4692565.4310 4281980.3400 2298671.4830 3867654.9600 2133115.3880 3064460.2200 5486494.4650 1169917.7410 4071814.9050 2827248.2790 3683559.1490 1515774.6180 9458553.0100 6513936.4590 1621506.7690 2548935.1610 3693237.9480 6333834.2840 7329975.4230 1752312.2190 3269088.9000 3223938.8870 14789781.5600 1883942.2800 5955866.1380 1216009.5990 1784998.0900 3699005.8620 4393140.7350 2089235.7440 2303140.5960 4445919.8810 3463429.9190 3422690.3200 2693349.8520 1639278.3240 1368284.8060 3274126.6760 3508220.5500 3797407.8990 6666754.0380 5349995.4300 4731836.9380 3604941.6270 2262659.2800 1481541.6670 3310138.6840 3545324.9960 1526666.2110 1407841.0990 2428315.0220 2602857.5590 2229051.3140 6657800.1130 3949305.3800 2846508.0280 3656791.7320 1639398.3760 7464369.9960 6212712.9870 1738444.3830 4076349.3140 5765333.6630 3923380.0030 7490274.9910 9302633.4720 6423111.7140 3082327.8940 2409883.2600 2402656.3480 4181320.5320 1194798.7210 3990198.2290 4644252.8120 3644233.8370 489575.1971 7494346.4580 1186442.2170 4611418.2540 1382575.5950 1629821.3820 1773543.4130 5023380.9740 7508087.0600 2054416.4040 3686778.8360 3637658.5370 2023932.4660 4446608.7300 11690002.8600 5756147.5700 3176950.9130 7604812.5400 1610340.6730 2074592.4560 1903784.9550 3692060.7140 3745208.7710 6139841.5850 1399720.0610 965128.0959 4318421.1640 1745483.4860 6872969.9350 6147653.7200 1702062.6240 2912721.4160 1798715.0850 3140589.4290 3928534.8050 7408463.2580 6688995.4660 1103960.5530 2383904.8000 3618336.1520 1688015.3860 3400138.4430 997937.6717 948834.1418 2416613.8450 3172387.5790 3319383.9510 2770060.0590 5034367.9310 1618067.8140 2979892.4040 8377095.8880 3689195.9940 8025579.0620 597010.6911 2042314.0960 5982456.4940 1823082.8490 8763384.7770 5439252.2820 5574569.8930 5685690.9700 5669661.6590 4980025.5420 5004425.1200 5061114.0740 5104822.9820 4601855.4890 4526504.4490 4329217.6350 4659496.9840 5508498.7130 5301997.8670 5099116.8620 4864774.6940 6165557.1220 6077493.6710 6066534.3770 5558182.3410 5710566.6160 5378904.5190 5844401.0310 5751282.3320 5889240.6120 4313695.7590 4233872.2840 4652036.5650 4405779.6840 4642444.2840 4450400.1020 4076583.0920 4101039.8140 3982170.3490 4340522.2430 4383336.5720 4272443.6270 4049389.8520 3616712.2310 3806345.2760 3618557.8330 3880920.1230 4042076.8920 4579099.2480 4380930.1970 4635868.7930 4300668.9970 4485160.0320 4404124.6170 Histamine_R1 Histamine 6439.3364 5744.3576 4140.2926 9163.0225 4311.4723 4057.9246 5295.5492 6883.1920 3599.2013 6389.1784 7756.3272 8530.2567 6726.7710 3973.8257 3065.1281 3153.3426 4010.7557 5043.4845 4734.5775 7835.1058 6431.7726 5967.0475 7122.0422 6049.7068 3600.1581 8191.0796 6446.8582 4222.8510 6110.8034 6777.3657 5121.6475 4576.1859 3905.9209 5774.9666 3287.5488 4079.4176 5877.0887 4597.2959 4055.9808 2875.9864 2679.3430 12059.6514 8827.0313 6285.3228 6016.9241 5237.2462 4932.1307 4997.8637 6590.3851 7718.6683 8022.5561 11653.8751 5978.0830 6612.2227 4834.7620 5677.7333 4930.4464 8138.2039 4813.7742 10795.6770 5260.5613 5276.0181 4187.8686 4144.1592 6498.5205 4272.2493 3463.0856 4178.2259 7558.7895 7979.8389 7726.6510 5352.5148 5212.4161 8196.7275 7751.6888 9395.6011 6965.9803 7323.9186 4426.5796 6878.6666 5707.8220 7332.9792 4479.0754 5162.4729 6544.9860 8488.7947 8651.6870 5669.6910 4953.9600 5007.8236 4250.5441 4408.9937 4887.2841 3494.5467 5237.4256 3703.3340 5475.0283 4359.8118 3820.7944 3832.2051 4691.2940 4316.2870 4393.1246 5597.9309 5639.0689 5985.1598 6160.4411 6100.6070 5985.1760 Histamine_R2 Histamine 6812.0785 7109.4275 4720.7458 2358.3729 9106.2984 4183.4541 5378.8938 4800.3788 3750.1231 7433.2485 7883.1408 7450.2890 7132.7085 4372.0995 3961.2044 6370.1432 2793.0420 6558.2605 3833.6841 5333.8790 6185.5955 3336.7879 1883.3685 7408.1422 3265.5695 5297.0960 13321.4345 4038.7131 2467.0768 6338.8592 5369.8711 5849.6909 5808.1629 5578.3728 7389.5562 3867.0934 5015.4032 4090.2081 3970.6113 4239.7698 12605.1373 8696.3887 5437.2556 5741.4267 2626.2736 4990.8253 7172.6051 7377.3842 4231.2811 5976.2215 6802.3972 11229.7521 2669.8654 5503.8062 8101.6913 5097.5260 3937.0974 11589.2292 4906.9958 2481.7749 2462.8370 11337.8135 6386.4668 4455.1087 3235.2472 5276.0606 4547.7629 2229.2981 2297.3680 5143.1611 3242.2902 4417.7686 4093.3443 1624.3505 5270.3346 3669.9092 5141.0039 6360.4119 3113.8515 1234.9484 6319.9098 5755.8537 9373.2222 4744.8450 7052.0284 7215.2370 6867.9803 8980.9895 7493.9015 6952.8855 6163.2597 6086.8349 4938.0784 4490.0544 6997.8382 9116.3974 8824.8656 6248.1278 2919.4476 5238.4183 5726.1084 2722.8723 4437.7693 7772.7633 4817.6743 4059.4103 6617.6963 5787.7516 4673.9644 5124.4205 5031.1076 3077.8487 6035.2767 6747.9891 5519.3282 4998.6540 4730.3097 Hydroxykynurenine_R1 Hydroxykynurenine 49631.4253 100769.8855 50057.9539 53382.8483 33796.4158 18340.9264 29764.9612 20703.7941 26358.8211 15065.2235 46561.2735 45969.9121 50554.6032 88344.9954 31976.7241 87409.2239 34574.7107 38412.0747 58628.5113 25133.8298 25300.2942 34556.9043 83323.1850 24292.1128 70776.8176 57802.6208 49930.5514 46696.5635 24266.5465 10581.6733 51989.6050 24839.5277 21086.9725 56297.0678 40529.1286 63686.0529 57310.1341 51768.1649 19675.8014 42370.2305 28045.4638 32492.7080 43128.4267 23784.6210 39714.3760 23531.1184 48098.4777 89858.9600 17663.2139 28892.6248 79376.7545 38163.7996 31104.8898 33993.9086 25374.7150 37801.2090 43179.5125 52268.2568 54276.6307 43343.1704 27648.1142 39491.7815 14824.3411 22225.1537 43308.8179 36697.2505 56783.5632 36263.7656 10487.0096 23729.5644 24923.0254 30366.5106 26079.4258 38433.5687 57474.6807 11793.3146 46417.7886 19214.8781 34526.2338 44185.7145 61673.9614 26628.5854 55859.0048 46739.1697 32130.2878 56379.2609 92360.7714 15033.1781 23165.7138 75037.2966 19981.4324 23272.2942 50738.7277 34425.7234 75829.2438 59650.5361 63270.8637 31883.6396 43055.4769 23101.0217 30506.9724 26764.5622 50376.6829 113375.2559 44961.9809 88567.9896 58439.9824 66537.2405 29171.8498 73854.6361 49676.5901 49756.8047 25885.9310 36025.7927 40600.2167 42068.9871 91221.1910 16876.2090 31291.0322 59826.6649 48214.3944 43751.5436 45257.1747 29353.9970 29860.8419 22710.6771 38289.7319 26476.9940 17352.1041 108533.4460 78929.6700 41130.7497 28429.4334 50959.9323 50820.7596 37943.4100 38134.0611 95016.5413 75569.9602 110902.6395 43230.2157 51677.3677 29651.9918 39960.3295 41312.0488 64335.1537 23237.5842 14590.3343 49386.6763 20539.7522 28739.2468 54186.9291 49962.3404 37166.4568 21729.3670 29355.4241 28593.6721 129890.3027 19781.2228 55985.2233 63864.0397 29277.9964 71737.9063 53746.6358 49099.3685 30282.8272 27109.9825 27075.0983 29297.5255 19143.1775 16487.4279 18469.3442 22855.1717 20507.2656 22987.0795 20468.8464 20649.8025 23367.7526 27003.0074 25670.8148 24275.2672 50535.5208 48247.3229 50725.7115 34996.0291 36320.8377 38194.6759 42468.2854 38522.5705 39822.1741 57192.8123 50896.5538 55551.2323 42728.5648 49995.1874 42341.2409 37654.3313 33272.2511 33857.9064 44104.8429 45668.7417 43069.6125 40852.3485 41771.2988 42632.5788 40615.7228 39877.7394 46494.8710 46869.0382 46061.0407 50774.6748 50100.5100 45353.3310 44538.3768 Hydroxykynurenine_R2 Hydroxykynurenine 52799.0600 102895.1897 48004.3228 58898.4639 35288.4093 25687.6883 33187.1023 21688.2229 34093.0855 15148.8557 47311.2428 48448.9876 55185.7760 98181.7872 36456.6205 90429.4232 33331.2191 40458.3960 56899.5667 29923.4075 26863.2675 37105.3411 93924.3039 26024.6534 72371.4934 72168.8762 46863.3212 42672.9358 24425.3098 7170.3509 52311.2362 23243.6792 19365.3314 52247.2378 44540.8036 65767.5786 63585.7458 53879.0559 20130.5837 43666.2133 29032.3759 37084.2954 48028.4155 25074.7618 40228.4142 25264.4870 62586.3030 91876.1745 18216.2713 29488.2569 82369.8094 42221.9466 27834.8475 31778.8607 27275.0201 39169.6104 48825.2767 54081.4512 55888.3146 43316.7740 26811.9507 41937.4474 13814.4624 19588.7544 44597.2254 37028.6465 54779.5139 37338.1980 11197.7638 27578.2968 26086.4891 27763.4785 26192.0751 41224.8684 64325.2615 14626.2155 49386.2612 12444.0878 41834.7246 48674.4000 71263.3313 27634.4569 58785.4545 48214.4411 29730.1106 64956.1911 98300.0573 14562.9891 20376.2674 78808.7326 24430.4990 26415.4310 53904.1980 32517.3312 75104.7241 58661.0406 64786.5745 34424.4902 45257.2054 18209.7101 33206.6739 30085.4510 53679.9504 115443.1706 48859.5119 86165.7244 61854.4397 83785.1550 29765.2255 80594.3202 46983.0125 56166.8879 23929.3126 36441.4150 44214.7825 43873.9661 95273.7111 24812.3873 41324.9183 61053.7072 48643.8897 44554.0041 47487.7429 30066.8246 28898.5571 24366.0641 42807.6345 29017.3179 14658.9955 108645.1643 81696.0742 44500.1975 24358.7471 49614.7935 52853.1137 39396.6202 43621.4876 93754.1631 80554.0741 106048.3937 44749.5619 51430.6800 35148.2699 39251.1412 38009.2521 74266.2964 27528.9592 17535.3557 42852.7692 22127.5941 31062.6960 55245.7836 53957.8243 33118.3658 24386.9351 30753.3803 26941.9643 134040.4938 21875.1959 61768.8839 63401.2487 38860.4859 75288.0350 56360.0385 43929.2167 28701.6465 24520.5761 23603.4179 27996.2971 20908.7027 18138.6910 20477.0223 20530.8435 20997.9755 23247.2840 22979.1098 26683.7765 23285.1695 28922.6571 29722.4481 23108.1117 52061.6494 55027.3414 52894.6235 38950.0513 37153.3363 36920.7780 45823.2251 35377.8607 39877.5715 52914.3860 52803.8579 53660.0236 45817.8822 49486.5188 52077.9563 39621.3292 34741.2606 35879.2364 49053.3262 48760.9552 45319.4023 41644.6344 47636.7104 42432.1917 45268.1387 44574.0761 54631.1975 48607.6186 47391.1016 50405.7924 44229.7124 46595.8161 46101.8544 Hypoxanthine/2-Deoxyinosine_R1 4483876.0590 5890810.2170 3306113.5290 5454160.9610 7382324.6130 6771606.1430 8217423.5190 6503508.4930 2958524.2670 4401271.4060 2308141.4590 1635151.0690 3893954.4730 3159414.7730 6976643.5060 7620609.1240 5480105.8060 5776344.9900 2021572.5010 8470627.0760 8242081.8940 10849521.0800 7565665.6140 6501612.7230 4349282.6120 10918339.2400 5649675.6890 16610986.7000 5383899.1280 9012080.7550 4386688.4680 4003838.2070 4329339.9600 6621183.8550 5141846.1510 8604948.3100 5251640.6420 5025333.7860 1966785.0730 16473317.8500 5211591.6810 3478619.1450 2800409.8970 4199707.3990 1707029.1280 11785085.2700 7611794.9190 4306640.7890 8205860.6500 5685550.7050 6072982.3750 16997559.1400 6239464.4370 4018220.3570 10034408.1500 8330297.2420 15519548.6700 10225115.2900 8165244.8320 3292236.3120 15184492.1100 6042194.6990 6258439.3150 4572510.2760 2944046.8100 5044185.5920 7991004.0190 5035611.7910 3774460.1260 7538642.7160 6507668.5100 8972311.4650 7515651.4410 4818840.2160 12069524.3000 14693123.2500 5891655.4730 3465017.4250 10990325.0400 2134680.6470 3098959.7410 9005370.3620 4964775.5910 2416097.4640 6323086.7560 11266750.2400 9352896.2030 4500639.4810 4956776.5030 14816040.4000 13039353.6600 9466401.3180 6090824.7210 5180620.0670 12613816.8600 3521733.7280 6188799.2100 4719632.5670 5074196.7880 2047946.1040 14226906.2100 6866066.4080 5533163.8200 9552538.3610 4738667.3190 6665578.5930 15074890.5800 5947385.3670 5018461.8500 10047474.8600 5705484.6160 3203362.5070 2148652.7450 3120847.8870 10120401.2200 2403149.6440 4585209.1050 8000897.4060 2612953.3390 6751362.2630 4161952.7970 6349939.2310 2446922.3890 7210764.1780 14309470.0400 3910263.9830 2651499.6800 6610068.4820 2761953.8450 6767114.4820 13343493.1100 6850528.3140 2553269 8225466.3850 5866504.2180 5802121.9920 4606419.2730 8853770.1430 3013790.4240 2662498.3470 5099007.7950 3343315.7180 14637378.7400 10611894.2600 7879558.1340 2582809.2070 5640941.9030 6232862.1240 3596980.0720 6723792.0340 6815705.6080 5610745.2510 2449047.3950 5313235.8670 7989479.0090 4591142.9610 2762297.7890 12353073.4100 9547011.6350 11074583.0900 2337226.9860 5214460.0500 8608003.6940 5995466.9360 2573032.9960 4263817.9470 4210925.0060 4404944.1950 4439301.6410 3492408.7500 3481320.9070 3493751.2490 3360441.1410 3544607.3280 3709638.6200 3241608.8650 3339850.9870 3680259.6580 3631881.9640 2886546.1500 3223786.9960 4399878.4490 4021268.0270 4201129.0320 3552511.2510 3616729.7840 3586752.2400 3125711.6450 3259239.0840 3311838.5140 7515424.5850 7279867.0890 7150592.4520 6909157.7240 7528740.8200 7335293.2700 6211120.3720 5697846.9370 5406316.7410 7009104.5010 7364519.4380 6564359.2320 6731030.7240 6258744.8400 6899818.0860 6423173.2370 6478626.1360 7107048.3160 6621497.7980 6215408.6760 6149971.7380 5772583.6590 5036753.5570 5444238.7830 Hypoxanthine/2-Deoxyinosine_R2 4384645.9870 5767484.4550 3247421.9050 5316130.9650 7237350.8550 6608367.2590 7997909.0180 6349542.3380 2933434.0090 4297080.7980 2280080.6810 1964281.5610 3796157.8660 3087479.2580 6829454.3820 7494333.6550 5375641.3260 5655074.4250 2011994.6260 8188222.2640 8075020.9490 10622097.6200 7459189.8940 6347136.1060 4274284.7390 10601467.9000 5501621.9410 16112518.5100 5273071.1220 8767019.0040 4301136.5390 3911443.0200 4215378.4270 6476914.1330 5004748.2680 8425791.0550 5134578.5670 4882123.8960 1933795.2110 16167214.6300 5145915.3090 3425134.9860 2740027.8910 2923127.6150 1727361.4180 11434621.5100 7409681.9200 4198872.0810 8052906.9360 5492780.9320 5938687.8960 16485933.9600 6086125.3340 3955491.9520 9820332.3460 8085263.8920 15090055.2900 9903691.7690 7965544.2150 3220336.0410 14822490.9700 5869151.7150 6078127.1530 4453584.2940 2910884.1550 4903742.9410 7806779.7070 4924637.9710 3722425.3470 7353773.3470 6377797.7470 8808359.9250 7317102.1750 4704491.9280 11788429.1400 14320121.7000 5763739.9440 3378355.6510 10677855.6500 2117988.6400 3031019.2740 8781250.5180 4836301.1380 2385021.8490 6135762.5610 10955336.8500 9081056.2970 4381866.6570 4863454.2760 14389985.2800 12679662.9500 9234342.1120 5928273.6560 5025884.3860 9657051.2370 3449600.0950 6026504.9270 4618790.5950 4932439.9160 2258633.2530 13832077.7600 6707508.8180 5392798.4090 9271056.2490 4611101.4600 6527520.7330 14736775.9500 2431344.1020 4901474.3870 9767638.9610 5555956.8280 3162765.8940 2488428.6980 3055568.1630 9887748.4480 2388738.4090 4482059.8340 7834906.4640 2542361.5250 6564511.7820 4074755.8910 6217537.4610 2379816.8080 7019183.9220 13980147.8500 3810294.0800 2593042.4910 6442190.9670 2686561.0060 6590751.6370 12947139.1600 6677701.5590 2479407.4590 7991539.4460 5696879.1670 5665484.2010 4479212.4620 8619202.3270 2961263.9260 2591671.7490 4983992.6010 3296155.8420 14274493.6100 10317730.8200 7720144.9310 2508177.7900 5544860.1000 5243379.6060 3540541.7470 6564899.7890 6670745.3770 5505648.4750 2372501.1220 5170166.3780 7845529.7990 4464053.6950 2747568.4390 11988958.1500 4930501.7770 10795741.5300 2335793.9210 5110631.9360 8386134.9670 5852465.5360 2527852.8300 4217171.7600 4178392.0930 4338442.5070 4364141.6680 3447729.8840 3442657.9430 3428677.6450 3287543.7890 3462777.7810 3628403.3880 3196729.1600 3270351.3410 3604239.8430 3567746.6220 2839095.6590 3161393.4630 4342254.6550 3964963.1210 4166547.1160 3479977.7990 3517576.4900 3504509.2830 3059966.5270 3199187.2480 3234816.3810 7400083.7680 7145083.1200 6993273.0110 6792013.2150 7377558.7640 7177996.2200 6110623.3360 5569628.7010 5304835.7830 6806918.6170 7189706.3810 6395093.9450 6552150.2370 6079512.2280 6717102.4370 6257646.2200 6300091.1970 6925777.8940 6411382.7300 6063454.6640 5952867.5070 5632111.9500 4886165.1790 5294033.8740 Indole-3-Acetamide 1H-Indole-3-acetamide 7404.2683 8160.6942 25139.3541 42566.7931 1266.4467 10025.1088 4756.3332 3278.5306 24116.0331 26803.3399 22678.1893 9314.1656 20699.4858 10910.1083 17132.7183 29533.9943 5166.6637 8105.5836 11161.5233 4404.8588 8032.0603 8923.7808 9744.3895 16236.2550 4675.7160 13544.0956 10969.0001 38441.4624 2645.9703 12399.3653 7632.4832 1480.5119 10713.2988 1992.8081 5855.8859 3230.6795 15174.4199 7080.3968 19888.0373 17095.7165 7081.4863 54975.3302 5126.8985 7001.9027 8932.9270 8791.6437 10250.4523 66363.1937 4599.6830 2319.5732 9505.8995 16075.0720 6887.6458 10324.0910 15945.8547 21748.6172 3369.2764 6269.4671 25370.9922 9785.3741 24370.2482 11199.4765 51435.7407 13563.3049 10105.0868 22420.2576 7652.4930 6959.1366 20594.8114 13381.5436 5885.9487 4104.0388 18404.1742 6748.7903 11328.7778 3983.6376 20689.8154 5509.8661 5348.8525 14069.3878 7066.5997 9455.8636 24335.1379 25228.8270 8878.7315 14944.0551 3762.7370 8339.4806 17326.3402 4529.8322 16230.4836 62645.8268 8756.6564 6130.6010 25982.9899 10999.5661 4984.9442 9364.4339 13946.5331 2796.5682 4234.1987 10705.2176 6167.0554 2701.2315 2456.8166 2188.8086 3481.2213 1898.1715 4563.3869 12147.6795 5430.6207 4562.8155 14629.3828 11218.9118 9472.9293 9123.7210 8629.2543 7678.5152 7362.4997 8482.2548 10722.8502 9618.0141 9353.4798 8543.3235 6923.4853 10550.5230 9798.8142 6942.3350 6544.7198 8251.9944 14758.3754 9368.4570 10561.1457 7775.5731 8511.0257 8374.5601 7763.0460 9633.0602 9275.2726 7221.1248 6733.4692 9034.3083 7692.8164 8778.7309 Indole-3-Acetate Indoleacetic acid 37995.7413 2333.5766 24151.0738 10311.3145 17659.6402 19166.7438 3698.8551 22523.5114 32336.4144 23501.2762 20409.2708 13955.0790 30603.3665 2101.2989 11311.9330 13521.1093 12908.5350 21639.0129 22374.0678 26240.5011 16609.6207 14621.8931 16632.9037 27927.3586 11111.1799 11018.0005 8056.8056 14646.5591 8828.2587 5401.1273 13848.4636 23522.0912 18091.9249 29021.1528 30394.7441 3202.5937 23068.1964 10138.3956 52872.6513 18474.4089 19844.7907 14967.1230 36844.1778 15842.0287 20486.3485 23050.5684 20432.0398 28742.6204 12752.2420 15280.9102 41955.0028 12013.7154 16907.0841 37885.0250 28414.7650 13484.0903 26373.2736 23681.9355 17377.0613 32682.4760 25551.8333 18568.9789 1476.9179 12084.6767 4384.1498 15201.2288 22343.4889 26903.3990 21679.7323 19331.5503 1684.0768 5108.1047 17583.6857 7950.3721 2092.7335 4414.9745 30242.4591 22539.0141 25440.6092 15809.5649 4374.7675 15143.2658 20249.3649 22474.5018 51189.7327 13554.0815 14299.7504 29311.7918 26839.0954 55967.0511 44161.6787 26472.5635 8642.6328 28037.7392 31712.1656 31776.4062 65497.3033 13785.0025 10272.7594 45508.5373 14419.2766 38190.6372 14049.2018 12820.1444 6992.1144 12828.1517 9385.8467 52724.6292 15705.9081 54723.6886 20063.6918 30841.0525 10588.5233 43260.8398 4003.4031 17390.6566 13351.5266 20687.8132 40404.0987 2097.5689 8890.4407 3774.7464 7489.9215 8796.9992 2081.1264 2313.3647 40567.8597 20920.3114 22970.8157 13939.7188 6245.9180 25922.0373 16641.2177 20200.3946 15242.6894 73312.0827 31083.1547 15585.1485 23256.5040 36338.1255 8364.7532 32189.9472 40296.9403 20441.4006 23190.5651 39992.5464 29923.8938 20726.6284 2349.6581 6614.2825 42710.1957 22499.4941 7750.1190 17426.9162 13868.9101 5869.1902 7158.3264 15069.6225 2688.0514 17319.1382 2551.9778 19045.2680 22579.9586 23228.6022 34271.7309 24801.5412 27679.2467 28170.1721 28726.0039 27762.1376 26061.8048 31284.5981 27702.1410 31337.7210 29862.0463 23160.3331 29089.0733 26166.3533 29880.4228 31826.2695 26771.3396 23437.0762 20001.9779 19504.0215 28616.3004 26277.2859 25576.8745 24172.0736 23354.5130 19145.2054 16436.3885 14517.5109 17070.1050 16188.6117 16834.1435 16415.0834 14971.5405 15502.6814 14693.9108 20816.1736 22726.6235 20221.4226 20771.5002 20779.1327 20557.3976 20638.1461 20293.6941 20017.6073 22075.1003 19894.2562 20132.6909 19122.4968 21644.3371 17907.9006 Indole-3-Acetate (B) Indoleacetic acid 35968.7679 20590.2031 15819.4294 15242.9662 15966.8257 28508.9175 20232.8012 13826.8149 22936.5913 19577.4664 21555.2467 13246.5198 11860.4301 21847.7549 9716.5257 10392.0109 18545.4240 13606.0804 22023.4513 23542.7649 48408.8060 15589.0548 17250.2514 26431.9502 16776.0903 17116.7048 24397.2907 13994.8042 37342.9863 13482.8104 27729.3638 23303.3558 22742.6221 19173.5377 29032.8959 21596.1555 16034.6807 10162.5933 11925.2465 18665.7125 21864.2317 16129.4388 22419.8170 20655.6765 22337.7958 16125.6226 17494.8404 46325.1828 12329.2969 26893.7692 24384.5024 49637.2050 36142.0463 21933.7244 25266.6602 27989.6424 27203.7501 60664.5143 38839.8344 31629.5141 11311.3497 47736.1327 12709.9564 49011.4463 27101.1140 38034.7605 14641.6240 15991.5919 37823.3110 35621.9956 17291.3555 20766.2178 20185.3396 13619.3055 13176.6241 67472.8749 30023.0780 13501.9622 34199.5280 6323.3297 26406.7015 32832.8155 16689.4285 18104.7501 34968.6961 25748.4139 17901.2504 37160.6202 15722.7688 18180.2579 19206.6771 24157.0867 19991.0044 21449.7661 19648.9532 18806.8562 24958.5010 23476.0008 22783.4664 23218.9005 20555.5504 22949.7349 24042.5611 23555.0760 21607.6096 17248.8330 21775.8124 18950.5463 21471.4631 19173.1126 33190.9706 14680.0188 14536.1089 13791.4081 13385.2641 13702.7531 11278.7280 18898.2392 18816.2766 19171.2736 17978.8377 16905.8494 15891.6815 18668.7346 17358.0708 17971.8727 16383.1232 21567.9115 Inosine Inosine 30545.9320 26948.1304 15195.5606 83039.8274 31716.1053 48277.9943 32021.6067 35906.8518 29478.7156 41300.3277 25469.3612 21181.5759 29677.3312 32106.7265 75202.7920 35820.4656 23900.2630 65095.3977 21621.9059 41928.6877 29513.4007 159438.5060 10413.2614 31678.8857 30020.1361 83421.9454 38831.3680 50854.2738 11850.4386 75695.7369 41040.7052 35438.0662 18502.4415 52977.3433 13086.8892 4009.1853 47263.0545 42587.5943 9388.0169 29112.2525 73046.9264 18412.6321 29386.9799 21538.4312 21211.5327 47973.1083 53766.5249 37672.7893 25558.5147 21717.0449 50558.8518 37969.6941 30912.5491 18392.8425 60430.6379 76994.4744 97146.1089 35859.3086 26147.5327 26473.9609 16331.4379 58901.6798 45677.1812 59939.8812 40950.3347 44653.5517 33453.8117 61785.9375 26954.9281 32043.6501 32169.9823 55652.5848 83809.6978 36083.3094 41986.3498 24384.2879 20518.2518 7724.1919 27020.5175 42701.0285 13105.8541 55965.9416 33008.1000 22858.9852 25566.3859 70486.6487 42735.6769 12545.8433 24575.0229 36436.9628 36752.8871 53010.0981 47032.5296 16136.5805 36823.0282 51622.7705 46417.8713 19006.0630 16569.8537 24875.1167 125858.9426 10146.5090 18010.6106 91699.4489 29336.5158 55499.3994 250583.6030 78948.6848 62387.5384 58133.5030 45854.4821 23922.8629 35785.4065 13658.0687 63090.3181 32906.7812 35239.5421 81396.4019 42788.3699 25298.1819 26354.7261 15309.4265 34967.8066 22199.8513 37652.1185 52746.9709 21415.3075 48435.2468 27529.1590 30199.7485 55107.3748 15540.2830 45998.5841 43013.5563 42655.4068 43518.8264 50130.7007 40626.3676 38884.1365 33703.0954 30344.6689 56604.2410 74912.2312 33277.5134 19354.8668 12474.7454 19410.2084 73604.7017 38735.8501 27111.1097 29005.2650 90329.4205 35202.3443 54860.5649 38488.2900 26680.1551 9919.3924 90358.2217 45264.9757 66637.2393 20901.3872 45599.8002 27320.5548 34166.1242 53728.5833 42944.7521 43087.4287 55016.4512 59449.6771 49244.5429 54292.7853 46168.2726 41030.9002 41768.6466 34220.5513 44751.7228 43256.9807 38895.7019 40167.3454 45432.2769 41251.3039 35555.2107 37310.6696 37988.7781 35331.8692 38737.9813 39241.1687 26539.2235 29720.8651 30404.4941 39307.2266 45623.0461 58960.0015 47910.8605 50987.2983 53567.3124 45762.2889 46202.4176 30635.9855 47453.8292 48209.5668 44744.5270 44495.3774 27433.0734 43712.6149 37449.2277 49531.3624 46512.1991 42861.7757 27947.0078 49069.2166 44601.9662 34523.4380 35879.1379 Inosine Monophosphate IMP 21392.6993 20791.7246 29082.7523 15206.9887 9536.5337 7799.6621 10589.2058 12426.4200 13018.4046 12537.0681 14799.5802 12767.8135 10766.9506 10767.3710 14804.5297 9388.0705 8093.5575 6934.0068 5591.1351 2462.8110 5255.8061 3496.9934 3743.6073 4126.8059 3457.3961 Kynurenic acid_R1 Kynurenic acid 2837119.2900 6556279.5980 2504992.7740 2507847.2450 2778994.1140 2872442.2890 2320241.1120 4236017.2310 2098809.9270 2233590.6140 2214273.2670 3236371.3610 2479012.3940 2295169.0060 2633027.8620 2575155.4520 2795321.6000 1815085.0310 3174262.2930 2464174.7240 2089482.4600 3357693.2570 3682852.8790 2944048.0120 4891003.8030 2902137.8380 3416987.8070 2446912.1260 3698525.7830 2933907.2270 2924560.1720 2345887.6780 2187735.6550 2453324.6410 3292107.8870 4276830.8860 2332584.4790 3708879.8260 1682251.3460 4487424.6800 4405466.8580 2950215.9860 1920617.3680 3124445.3660 2440858.0440 2495667.3110 1961813.8980 2455695.6720 3268319.5050 3096110.8530 2815070.9790 2735763.8100 2101707.9240 2373805.2500 2754553.6730 3067944.1000 3866314.0150 3983372.7460 3848849.2480 2269664.3620 2897223.4700 2199247.9670 2544359.4430 1362140.6510 3290932.7390 1968546.0160 3669203.9870 4450775.5600 3499721.2760 2548627.1750 2979669.7910 5104412.4220 2552526.6680 2291874.0930 3510506.3500 4352024.7000 2330408.0960 1704675.9710 3174685.7180 2191073.1170 3129721.0820 3143026.7060 2236972.1760 4096895.1850 1968110.4380 2799558.7170 3052062.7940 3298861.2460 1633507.8700 3348689.9580 2224870.5700 2496375.1780 2692886.7680 1707174.1390 3223287.4170 3372305.8740 2377691.5630 2141277.5460 3415706.8610 2341582.5350 4090388.8140 3092976.5900 2115447.1890 4077750.0110 2440571.9060 3608630.6520 3157879.2900 5251249.0270 1928343.0870 2566497.7420 2998109.7040 4639952.1770 3542193.9170 2148338.4760 3226886.2360 2448052.2320 5669342.2540 2159077.5390 2459759.0110 2591808.3640 2714743.7800 4468059.2020 2420499.7600 1760123.6430 4931409.0430 4750594.5080 2178251.7730 1942958.5960 1512966.9800 3067622.2580 1768958.8880 2194815.3820 1451010.4840 2725418.4710 2634863.6780 3076927.8580 1914821.3200 2888912.6540 2941539.4460 2996095.0990 2168332.9450 3281230.6770 3414484.5870 1980349.5090 2703405.2250 4645528.5260 1727426.3230 2945325.6580 2730205.5710 2239669.0310 2222497.4880 2766427.9900 2671577.1350 1974653.8100 1896759.0980 1931468.6170 3527811.8640 5199051.3550 4549723.2650 3593897.0820 4236546.7810 2325157.9720 3329350.0100 3070464.7160 2813041.2480 3299404.9730 3139948.2030 3352670.7930 3216659.0730 2776396.9020 2756960.3590 2457993.7270 2348907.9930 2180788.0700 2436376.4510 2150821.1710 2379362.0820 2686661.7620 2648584.6090 2295251.2200 2059450.1070 2723854.9100 2659060.8390 2707615.8470 2227079.6280 2207305.3230 1971665.3810 2228330.1480 2266503.7480 2155131.7340 3508580.1470 3370660.5260 3481820.6370 3230604.3260 3428151.5900 3285717.5760 2954583.2090 2863704.3890 2850079.1200 2916297.3640 2799471.3040 2684645.8350 2510198.3030 2386631.4320 2753922.6200 2596688.0020 2757597.4130 2903490.2740 2920972.4050 2741876.7070 2989908.6750 2833078.8520 2453518.6850 2714443.0500 Kynurenic acid_R2 Kynurenic acid 2629925.8050 5915099.3520 2274072.6150 2321447.8790 2561880.7330 2663777.4700 2091906.8380 3893780.6490 1937532.0680 2038504.2020 2035052.5190 3015654.9320 2265715.7470 2109814.8100 2461394.2860 2394073.0480 2575255.6200 1637588.6460 2948380.1300 2283588.4090 1895988.0200 3073105.1730 3419415.1550 2722271.2120 4581582.8960 2645913.1130 3143829.6360 2367511.8980 3418235.8200 2685697.3760 2660350.9550 2173098.2570 1994044.1280 2247567.0340 1532616.1960 3924741.6750 2113817.4720 3440418.5980 1575085.8200 4103848.4720 3959819.7680 2704298.9930 1754999.8300 2890519.5680 2256298.3710 2318905.9050 1817090.0870 2307539.1300 3013449.4640 2808192.4610 2564432.4860 2560412.2040 1945560.8250 2204108.4510 2530610.5030 2786066.6370 3544741.3540 3614432.7160 3531923.8060 2110718.0540 2647949.4850 2029343.8020 2337452.4730 1262716.2200 3065414.7470 1819410.7980 3325610.1370 4102251.5160 3243204.2380 2372453.1930 2767001.1730 4669751.4580 2331257.4070 2116270.8770 3206139.6970 3934929.3020 2159885.0610 1567123.1110 2920232.8010 2023912.4600 2883913.7290 2855727.8610 2043336.7220 3801118.2270 1813950.1620 2595803.3400 2770783.0840 3016589.4390 1524966.6370 3077658.5650 2034977.6900 2329830.8200 2482859.5640 1580551.4060 2985968.0790 3099573.3840 2195696.5590 2001028.9300 3151833.2290 2129071.9770 3734021.8110 2841090.5720 1953863.5950 3719894.8200 2254284.7870 3276055.6870 2929264.6820 4814914.6070 1817478.1340 2329443.5890 2765140.0240 4225028.4290 3272397.8320 1986546.8560 2994294.3240 2218347.0900 5214502.6350 1990662.0860 2237176.2680 2360435.3090 2485711.1280 4073096.8670 2258203.3020 1650422.5110 4517703.2960 4337950.1210 1988559.8550 1812180.6260 1411520.5660 2836970.5130 1619076.7860 2009876.6150 1339808.4450 2542541.1490 2401860.9990 2804279.5090 1849173.5600 2745279.1100 2700844.6670 2730677.5490 1999191.5260 3015567.3500 3162746.3230 1821359.4680 2506106.1760 4297726.2490 1611813.0690 2736586.3150 2465401.9650 2051498.3580 2037765.6680 2547436.6850 2476579.6500 1794814.6820 1733758.1170 1781603.7880 3251834.7900 4743871.0670 4140106.0110 3289988.3670 3899207.9080 2137429.2460 3011248.4810 2796353.7870 2608712.9940 3135729.3230 2972364.2030 3159556.4350 3031791.0420 2623912.3860 2550558.0310 2312737.9000 2181763.4960 2036622.4370 2284565.7430 2036227.6410 2233639.5580 2524675.2350 2477360.6980 2160626.2750 1937422.8260 2549090.7130 2483175.8100 2542860.8640 2091850.6950 2056674.2180 1854790.4850 2126030.9000 2131752.4720 2004886.6140 3242503.9720 3123537.2020 3187030.5780 2962960.1490 3158966.9840 2997226.1520 2730947.3040 2617620.7420 2625885.5420 2662479.4770 2551279.3520 2481767.8410 2311457.4830 2181189.6990 2531031.0930 2388618.6300 2523348.0420 2644667.5470 2693560.0140 2502466.5930 2723818.5180 2572508.2190 2245438.2460 2488970.5830 Kynurenine_R1 Kynurenine 258601.2615 412289.4761 81638.8034 152068.9836 77342.6572 53976.0505 199337.4078 63132.7261 149148.0006 92617.6886 376948.8956 311717.9193 187491.3028 236036.7980 172808.8290 174039.2295 139343.6291 116074.1725 237591.6258 106326.3894 69016.2766 72465.4165 730527.4397 94607.8055 318606.9987 361332.0441 151397.1973 85445.8819 140228.9664 55371.8210 67360.1486 125262.1901 29186.9462 96406.4894 84757.2870 97279.4456 85867.5215 168017.8470 47366.8818 297793.3243 201425.5417 152060.2872 96598.4573 107700.1988 283227.9358 36133.1208 95768.5596 72531.4023 166002.2940 85633.9529 100857.9569 97898.9507 197715.7876 111205.0906 53409.1278 38773.1970 361563.8498 59105.2220 97119.3324 184169.5072 93979.6183 276548.6798 67127.8881 54647.8124 80040.8141 76122.8709 478139.7050 82699.9360 48140.2023 74637.9478 64435.4321 165771.0291 49772.1813 92709.7345 240717.8091 104632.0032 189283.5313 89070.4025 153703.0850 109239.9526 159184.6860 54179.4360 115107.6326 115776.3260 59718.1344 357479.8797 374794.8313 38592.2380 39925.0560 320672.9105 47638.6843 48779.8197 172835.3343 70089.4878 268679.8077 85730.4696 141194.4404 103627.9371 269504.4613 114542.3773 53768.3680 129121.4801 78893.4505 531472.5357 81735.1157 357377.1224 244915.2074 180603.5647 43428.9426 111238.0352 104704.7804 341701.7594 148485.5551 35308.5332 364942.7919 347506.2046 277033.3259 170176.1330 68323.0039 237273.7247 77311.8533 305584.4268 299274.8421 198774.9579 137438.8537 109070.4506 65722.1375 46489.0062 103924.6721 300281.6693 115048.6493 262253.5492 45062.2521 99087.5601 123206.6676 80162.6008 72935.0752 355195.2928 144249.5060 184036.6853 218784.0218 82808.5853 72154.8430 92502.2603 96512.7153 458979.2551 37849.9480 88746.6384 208548.6513 86365.1559 115800.7747 66060.6902 199418.7937 73452.2739 63847.6646 142796.7469 164004.2865 325703.5295 134379.2541 186309.7208 162067.6094 123746.5045 135206.8614 217479.0100 390695.4881 174668.4250 166320.2694 168647.1716 172599.2672 137360.3227 150793.0829 152037.3211 151499.0544 145339.0964 140436.2207 126796.8859 140444.0604 132590.9229 134105.9195 141862.8895 135473.8451 187710.2778 173443.6964 166836.2523 154721.7986 158222.1237 164981.1931 131313.8560 128860.3095 137159.7565 191660.0597 181323.9137 165689.3177 207965.7373 173326.3555 208545.8320 184533.4455 162973.4334 169113.5739 101904.4713 109988.0790 93361.9986 104526.1977 166277.2409 125720.5779 135792.1629 95765.1391 93300.2116 97119.7649 90025.7806 91070.3011 105817.6127 84436.8539 91625.5902 Kynurenine_R2 Kynurenine 236133.2664 360059.3210 67240.2446 135311.9613 60925.7256 42159.2139 172505.3769 74494.0385 123419.2271 76507.2566 351460.8200 283447.9687 166787.0847 216653.0651 154177.2101 156151.2651 122905.8075 95675.1641 218273.3100 91802.0701 50276.6719 56165.0369 690883.7385 77351.7573 285472.4515 335130.4384 131225.6451 69983.6711 118364.1939 37991.5880 52127.3385 105138.5106 21250.0305 77196.6386 70803.5172 82103.5697 72687.9506 144617.1091 36648.9920 276100.8691 182647.9338 136729.3536 76362.0424 89425.2105 264228.2743 23607.9244 73423.0908 59462.6005 149897.6169 67892.1524 84876.0276 79482.6743 178192.7781 90180.1713 36738.8888 24765.6103 333315.1863 39237.3070 81577.0236 169726.7502 79524.8088 252481.3529 51811.0235 41123.7924 62108.7663 55284.4725 446675.2683 63839.5272 36934.5209 60899.7134 44519.4116 149229.2196 35683.4658 79667.9090 214338.1676 86992.1556 167871.4618 77523.7948 141866.2831 92338.4820 138944.9588 41754.6751 91017.5103 102609.6788 44453.7230 330684.0670 341541.9088 26895.3850 28319.3255 291294.2469 31151.0652 35476.4810 145054.6231 58664.9555 247269.4676 69479.3558 119780.1461 86675.3842 246075.6135 102630.9692 42524.0943 110720.4527 64272.4091 492094.8761 72333.3711 334034.1006 215273.5853 201149.8351 30911.8692 89233.7868 84991.9658 311942.7987 132998.9154 23432.8989 347985.5420 324478.9140 242091.5640 149417.5894 74286.7363 217414.6914 65209.4056 281875.1262 274378.8835 180007.0406 119931.4076 92336.7627 52996.8406 34114.8470 88561.9302 264742.9047 98076.9135 241225.7233 54679.9818 78691.1360 96558.2480 65065.9721 55951.6111 326836.2875 122401.2988 150342.7448 195681.5144 65691.1388 44777.1668 77050.1649 73975.2947 435071.8281 26874.4878 72653.5076 186215.3064 73628.6025 98702.0978 49290.2612 178839.8772 56164.2855 45171.2537 123304.6217 147947.2678 297955.3574 110743.9450 158581.1258 143092.6863 107766.1072 110818.4740 214748.2075 364275.0597 158209.8386 147946.2708 149933.2325 156063.4477 130311.5929 134956.6378 138726.5093 141791.8233 132565.9664 126029.1206 113683.1044 125861.4466 119358.7280 119674.9597 127963.5469 120631.9093 176911.6005 170964.7410 170948.9703 151420.3928 149221.8090 150316.8786 124621.3971 123059.7153 124838.6865 175355.9369 166887.7016 149119.4376 192948.8714 159323.1725 190341.1137 168238.8069 148769.0402 153654.9393 87535.8385 95714.5738 80528.1931 91271.5051 152792.0595 113347.3728 122403.8094 82306.8004 83843.4015 81918.0053 80811.4518 78536.1046 93335.3328 74451.0493 79180.8113 Lactose Lactose 193606.6009 102503.9521 90563.3420 103198.9753 49773.5776 96379.2526 24183.4692 154043.9812 256890.6883 87637.6307 230060.0828 108239.4788 148849.3052 71596.9063 58672.4621 115917.8307 64280.4857 125278.2769 146556.7746 107692.4875 106352.1161 321665.6562 220538.3736 167931.9785 156375.2859 156671.7113 219450.8115 46113.4855 227291.0138 150362.0716 118147.1243 144372.9477 69387.1205 72589.2057 48767.3646 61764.7041 47090.0912 149461.9852 83541.5099 143240.5862 225107.6045 148008.9192 88211.6693 102420.1545 61919.5611 73549.4011 110959.1608 186254.0326 139419.0879 69210.9790 130722.2894 59779.0698 138064.6386 240569.0186 163388.9314 57818.0416 118892.2165 54060.3704 180235.1957 64081.2004 119888.6943 146041.9382 78091.2119 86187.0178 85119.6401 11219.8278 92060.4553 99709.7045 391547.7393 105909.7193 65097.2235 176700.4921 83289.7154 51522.0326 67249.9897 49250.0996 75706.6633 79461.2449 128552.9565 148653.4887 38626.2148 96021.3575 54469.1424 619228.0042 143975.9045 149241.2502 107839.6819 404605.3735 69287.4224 466664.8794 39152.4120 162317.9953 182149.9153 59401.8785 142311.5596 74253.1595 68096.2506 105674.1209 144564.9778 61457.2983 92650.2525 443907.2538 86960.5608 54611.5962 56326.0574 183155.4019 73183.6373 68793.0292 63859.1665 238822.8340 53116.7406 139814.6406 116284.1024 218891.0362 120044.2278 274751.2082 183002.9927 111306.6076 353333.4204 62597.1732 98854.7824 96926.7835 90978.1166 172578.4159 67636.8999 123579.0949 334540.5389 29498.8498 84504.3768 43016.3777 29610.6611 35216.3706 140776.6281 15115.9339 85562.6573 81489.5252 114488.4763 98842.9381 208709.1444 132657.7869 190511.2075 114768.0554 139304.0062 62325.0435 72677.5822 264673.6508 63102.4354 89883.3840 99010.4178 19308.6673 137380.6522 111661.1957 96197.1783 8140.9900 89464.0698 115760.7661 180636.8353 80516.4258 77584.5130 137134.9921 41442.2951 20951.9390 66743.5604 73502.3724 220437.3521 146135.1698 157351.9299 161422.9275 169962.4528 127118.2701 126269.4624 133454.6100 127930.9455 96390.0948 107987.7371 109478.1573 98650.1377 106761.1665 97859.3831 87694.3364 81820.7745 128283.2427 109653.4751 119685.1572 104294.9841 113291.6245 108080.6759 88103.9370 82705.1395 83680.8764 182438.5597 207769.9776 183326.4315 252001.0938 154500.4521 160395.0810 163352.8563 119423.7380 125478.5191 123007.8084 118971.2301 101751.3697 106609.9781 142247.6917 114019.6585 107285.1189 104139.8100 105622.9101 109175.4892 106141.6679 91662.5732 92791.5663 82787.3533 85879.4823 L-Arginine_R1 Arginine 78606.5365 73623.2018 54252.6779 62167.5914 52849.1310 33794.4296 32524.4046 24545.2505 55578.2895 34981.3661 41582.1018 30212.7345 48347.7603 27100.1065 43803.1824 44190.7868 50151.2069 61160.6142 41508.6600 79046.3418 66011.5217 104882.6001 49975.9849 77016.5053 41716.8367 39031.0532 47277.9074 236083.1579 30149.4546 115504.7084 79362.9913 32563.1966 72606.5388 49223.8410 73832.4836 70673.6993 65822.8602 41619.7303 143488.1151 56378.1735 34601.9647 28951.3575 83414.6442 56870.9645 24816.0333 55910.5276 70481.2777 64422.2750 36955.3126 52758.5837 116340.5779 276035.8664 48321.6619 63185.3308 175806.6010 83216.7095 33441.5984 58111.8950 92970.3969 305499.6870 70128.2023 44500.8688 50676.8613 55819.5137 93090.6336 39917.3326 34802.1129 53818.4333 64704.6870 34126.0804 53014.2520 59131.6639 51992.8782 83790.2372 50661.5111 33601.4991 99740.4034 28605.1058 35478.0230 65732.4653 40356.2713 67437.0158 79426.0034 36874.3933 149238.1851 59952.6517 26054.3555 80387.5013 63071.3978 52051.8825 134165.2115 171352.5388 35163.3231 274732.5544 37211.7915 80747.9266 97609.8307 64731.6252 28967.0257 122589.8533 62864.4626 63430.3941 58410.0986 20748.0791 84967.1652 64381.5671 66794.1621 19309.1959 68679.4222 184972.6873 71815.4395 29990.8179 19587.8477 88439.8566 26695.1454 36934.7029 53387.8133 50913.0874 54873.7628 32186.5313 65010.0843 32999.9946 56923.6191 56633.9923 46906.0158 42119.0549 51070.2312 67277.1459 27565.5515 51454.9225 96528.7968 32422.0860 43410.7466 134870.7914 53132.1690 85127.0837 57175.1396 25039.4965 40522.1775 73504.3119 28859.7891 73192.8373 124775.0612 44985.2424 60339.4324 30436.1869 73498.9550 35389.9388 73532.1848 48564.4066 50248.1414 101568.0830 68866.5672 36142.3797 63094.5569 26391.1442 34728.0889 46520.7205 34501.1686 48256.0549 52843.6641 54215.0106 56705.2857 33813.0314 48777.2757 21128.7960 20884.7043 24565.1710 19873.4506 17976.8661 15970.1370 16807.1634 14233.2736 18070.1533 17430.0939 15865.4358 13742.5533 14617.8812 14466.7701 14043.5143 13430.1028 61161.5088 54447.6452 62631.7274 42682.9150 48593.3044 45213.4228 49874.9230 50247.6087 47905.3331 43973.8974 45190.2131 55573.4147 38004.3871 51999.6130 51352.6639 51547.2241 47365.2762 42992.2305 52270.4200 55909.9180 49080.8396 59592.6748 32932.7961 53213.0574 45360.1801 62323.8305 62249.7489 46718.2292 44605.3342 53818.1809 48189.4536 42010.2473 49857.7019 L-Arginine_R2 Arginine 79223.6249 77481.8647 54842.4567 61514.4990 53371.9544 33232.7219 32591.3265 25065.0713 56275.3895 37679.3930 42407.0186 29066.4863 47001.7337 26568.9528 44886.0376 45134.6700 50682.1158 62005.7615 42195.2974 78987.4990 66166.8944 104251.7095 48769.8633 76924.5801 41214.5712 39889.0076 61213.4445 228527.0662 30637.7682 114220.2541 78429.2915 33451.0937 71028.4181 49072.6859 73298.4362 69991.8363 66303.8944 41109.6899 141057.1063 57229.3330 34137.8551 29182.0050 84735.1190 58070.2647 25322.7109 58584.4958 69683.7450 63170.1179 37999.6085 51371.2373 115512.3744 266255.5035 48388.3040 61829.7567 173577.5496 84541.9448 35668.9735 58260.7700 92131.3996 292999.5865 68171.3690 42531.2862 49950.3226 55192.4099 91744.0084 40066.1990 35625.2410 53911.1140 64376.2416 34506.6940 54426.4136 59366.6449 51486.8229 83238.3758 52846.6271 33784.3004 96724.9579 28021.9480 35964.2583 66717.7285 40905.3544 68858.8183 79242.8077 36051.9968 145840.4316 59921.9682 26655.5946 84485.9497 63118.1630 51857.5692 133220.9945 168265.6164 35272.7908 266086.1070 38455.8446 80384.1001 96357.3913 65708.4246 30231.5358 122796.5384 62573.2262 68964.9940 56540.8170 24110.9801 84282.5222 64236.9447 67194.1219 19524.9028 69727.0588 181200.1464 71417.3361 30018.7828 19392.6826 87844.9468 27349.0334 37197.0513 53411.1192 50662.3325 54512.0508 32962.3584 65370.4833 33344.7966 56043.0333 56365.0551 46025.9230 44308.2272 50816.4505 68317.2362 26494.0670 52509.3393 96260.6833 32812.8209 45924.1177 131549.3567 51843.3108 84894.7074 58108.3883 26803.8346 41534.2677 73719.9832 29608.1993 72144.3276 122955.6721 44822.7420 60893.4317 29938.4171 73207.7660 36517.3795 71731.1099 48425.4573 50860.7367 101577.5298 68771.8800 37115.6286 63073.7723 26064.0989 33780.4961 47005.6394 38193.6944 49209.7413 54667.1976 56613.4201 56676.0601 34491.4506 49810.6862 20855.3350 21885.4988 23862.9498 20265.6411 18096.0960 16773.3007 16505.9958 15717.8231 18304.9893 17604.2499 16457.0885 14546.9907 17404.9342 17267.7639 14975.0599 14162.2985 5153.9165 5717.3045 5292.9853 4757.9318 2452.7117 4633.4492 4104.3935 4153.1292 6038.8107 3930.9985 5012.6445 4107.3631 62011.5324 55172.2376 62737.6907 44506.4405 50212.7047 44863.9198 49184.2873 50295.2106 49122.2490 45329.2957 45040.1417 54935.4383 37789.8501 52356.0085 52530.9096 50783.0997 48542.5153 44081.5007 53306.7019 56531.1471 56310.1557 60484.6150 33574.5447 53862.0115 46257.6442 61904.5646 62063.2879 46689.6324 43501.3288 53011.2719 47424.7004 41782.6211 51627.0696 Lauroylcarnitine CAR 12:0 5401.5878 45199.0921 7704.0986 8521.9907 13662.1031 7657.1235 17774.7728 5683.0209 25888.9752 6578.2607 6056.5488 6396.9128 33106.1279 7268.0993 7020.9982 8447.8497 7827.1424 5441.6002 5206.2699 23939.0758 5345.9767 7436.1404 8144.3689 5257.4582 14343.3692 7638.7865 6146.7062 6204.8439 11840.3395 6431.0962 7703.7772 10628.6178 9872.7813 4881.7191 3581.1105 6256.0746 3336.3913 11664.3346 9690.0737 4595.8779 12951.6900 6824.6074 7917.2886 4060.6203 8329.3356 18516.3449 8120.3549 9540.8883 4970.7063 15732.3582 11447.8310 10078.5299 2313.3890 17999.0320 10561.6225 4510.2732 14528.3768 7449.8431 28584.9715 19983.3180 8476.6714 4323.9315 15422.5586 7395.5109 3698.2146 4847.3343 10729.8242 12704.8045 5283.7325 9675.2475 9942.4206 16812.6990 25775.5604 8032.2299 9505.4218 7208.2506 5008.2315 9312.9908 11307.8114 15087.6211 6762.1082 4916.0096 9926.8193 5997.8062 54197.1307 9568.8427 8331.7182 1150.9406 11334.4384 6266.4631 8670.9804 23955.0882 8135.1136 3499.1618 10568.2892 11263.2985 7208.6465 6810.3508 6005.2442 5503.5320 14650.5794 14823.0215 4065.2712 17885.0073 4787.5982 9961.1941 9403.1103 56109.8577 11216.7825 7332.5291 16569.3358 5487.4184 10723.3188 2958.2581 13498.8229 15447.2653 18169.3696 7009.9527 12577.6281 21750.1574 4112.7692 7516.6478 4744.4626 4816.6354 4549.4783 4163.2589 3809.6308 2723.2412 3635.6800 1999.0042 3693.3279 4201.5555 3749.3098 4529.6026 4035.6384 10629.8633 9669.0187 9435.0347 10480.8475 8828.3633 10772.4849 6963.1493 9140.5698 8019.5464 9907.8706 9386.2541 8496.6238 7926.5249 6158.5334 7943.0444 9201.4144 10890.7208 10037.1244 9703.8178 9940.1192 9522.2707 7471.2265 8147.3623 7561.9207 L-Cysteine_R1 Cysteine 6669.6922 63601.5195 15079.8970 17869.8022 6590.8477 13982.1776 33618.9959 6491.5695 30298.9672 5411.2100 4224.4608 12318.1333 7885.2970 6031.9091 7293.8291 78683.1628 18417.0510 32033.7398 2836.1406 39826.8700 59829.8156 36897.2768 12051.9418 26793.1021 32489.8304 77892.9206 32374.1452 22170.3406 16308.4977 18634.4590 35768.0931 7388.7459 16858.7383 26840.3083 3755.0661 9553.1322 39276.0980 11416.7505 21292.6709 28413.9033 77522.4793 7961.2059 10194.4409 47028.1931 10692.8375 43391.3453 32915.1071 21001.3046 40368.0801 15322.4754 37625.4656 8399.6231 73574.0680 23208.2203 16072.5304 6825.1908 10446.0111 9508.4879 45522.5512 15344.8687 42810.3364 12254.5096 25394.7586 7712.9730 35379.3425 17907.3190 33732.3441 39841.7192 3842.4833 26382.9714 25099.8570 6421.9453 7515.5627 33115.7300 22214.8466 45882.4996 5878.1436 3468.5548 37439.5626 26110.6171 20518.7952 30131.4584 39262.0953 48101.6932 15595.9183 4705.0542 33823.1894 6506.7335 61771.5519 6630.4030 5711.0160 5401.4907 10399.3248 4356.0069 2062.0629 7114.1242 8298.7865 2271.9715 13361.8484 15452.5999 14930.3809 12679.1708 12263.3788 11938.8456 13003.2141 15256.5194 15486.4294 8568.2445 9870.7027 7857.2556 5470.8818 4828.0803 6196.8395 8068.3621 7435.3921 6559.8102 10077.4486 6361.0115 6570.4656 11219.8182 10565.2867 6932.1146 5730.8043 7745.1031 6095.6197 L-Cysteine_R2 Cysteine 9528.4380 70403.9331 16833.1397 21979.6937 8343.7957 7791.6484 17059.8286 36147.8836 8935.9420 34177.7548 16268.2256 8192.4344 12065.9336 83422.5408 21034.5691 38050.8565 43464.2807 63583.9092 43917.9913 14020.8779 29922.5227 37765.1315 83843.8707 35701.9535 28321.4540 20184.8072 23523.9311 39494.8106 2595.8896 17584.7536 29160.6976 13079.7763 43602.4737 15302.6518 28307.4402 30494.1933 78157.1654 9183.8200 18605.8262 50165.1820 8438.6446 16231.7619 48872.5215 38864.9736 26116.9711 42342.5678 18270.2641 40087.4261 10418.5760 75374.5863 27499.6309 19145.5236 11331.4495 11962.4313 12157.5342 51777.6497 18142.1854 48357.4099 16594.1213 10475.4300 39868.8299 23310.1319 39084.6349 47582.5853 5367.6321 30035.1548 28743.9121 8842.9352 12278.7364 36578.1942 26886.5724 50699.6136 5897.0650 42803.4454 33352.6188 25985.4080 32069.4865 43209.1676 50575.3308 22889.1336 37062.5373 11033.7632 66434.2253 14471.1710 3724.3172 11866.0735 8701.0775 9944.1782 11101.1510 10613.8760 3486.7718 20171.2460 21021.2180 19348.7055 17282.7461 19709.8085 21976.1875 17142.1526 20966.4808 24597.2268 12467.8481 11955.9607 10214.0862 5665.1056 10025.9817 9713.5764 9419.6202 8921.2550 10853.1154 10550.9014 6118.9140 9968.4487 12727.8046 14017.0305 10969.2195 8958.6028 8260.6664 7790.2407 L-Cystine_R1 Cystine 62276.3880 47078.6691 74101.1806 85759.0858 37141.0007 58091.4172 41811.0265 47410.4647 36228.5897 66257.6040 27863.0314 26997.9561 58902.7550 29760.0938 116514.1097 22402.4872 71754.4855 64148.9312 22600.3106 59508.8950 63223.6140 96183.7164 91603.4189 13642.1539 54363.7842 101186.4237 26003.9253 80808.6972 39333.4052 168462.3219 31220.4879 79193.5540 43914.5276 43975.0535 38707.0526 40700.8602 67794.9099 57828.6992 59808.8235 47933.3038 49265.5145 63584.0987 80179.1581 43538.6013 67243.7940 50150.2999 52969.9475 6993.6757 95876.1344 24917.3989 63651.9041 94738.7027 42102.4200 81211.7330 45313.7394 68260.1374 69846.0577 66114.7275 67837.7745 38556.0214 95454.8442 69670.4358 34287.7107 31343.8064 34237.9247 27182.8386 54856.3123 60251.7582 28648.6544 58181.4070 30273.2912 73417.4749 40887.6597 50280.0633 56984.7959 51255.1033 112435.0082 48011.5105 71565.8325 92266.4520 27305.9758 72628.0771 58706.8092 27936.7879 99895.9944 72267.0811 53491.5214 31676.4127 67367.5929 60205.6966 125416.6245 53773.5354 28979.4760 262184.8368 71339.9220 25157.7413 81735.3093 49099.5182 39515.9433 108166.0615 50338.2519 68177.9508 45657.2015 35588.1738 48001.2014 49368.9932 52925.6688 33221.8659 43444.6032 64547.8338 110502.6271 51934.1946 23728.5288 28643.5535 57038.9954 23381.7137 46746.4935 55510.3820 36508.7686 33131.0328 62438.3418 38513.7583 48701.8944 87508.2558 84274.1111 31797.1747 35214.7266 76137.3500 21232.0807 36071.4024 42246.7939 26224.5084 44704.3031 46449.4159 48699.3983 58333.7030 13147.5302 36235.5997 51204.3252 35116.3481 27460.4877 23110.2589 90129.5403 71902.5455 76534.4470 26659.0997 47194.7107 104395.1587 36272.2048 51596.9080 49028.1090 46153.1190 41158.8095 28501.8635 58123.9466 22386.2682 44139.2309 39717.2096 54701.7974 44746.4088 28490.6083 63891.6394 28800.3221 68220.3303 40178.2116 75788.4329 96773.4855 91892.2688 41294.4161 46614.3584 49547.1194 56587.3144 46529.2394 53925.1681 40867.8668 45071.6725 40533.8387 58437.9789 50407.0777 45665.4435 60031.2749 43904.3236 62459.4357 36483.1502 55337.6341 32752.3747 34599.1044 45121.7138 57757.1230 51157.6102 33880.5675 35846.0342 54039.5356 19650.8297 57228.2640 42434.8332 83636.7599 86153.8884 49994.5045 42739.1473 47159.2214 51935.0915 33965.2616 28150.9500 52554.0213 63780.3636 66955.8680 67410.1079 45637.1334 41041.3151 54098.5211 38719.8407 55262.2157 62603.5396 L-Cystine_R2 Cystine 38833.0299 32559.7479 53727.3588 71777.9263 27173.1287 43027.8640 33821.8135 33564.5269 34728.4828 46479.4351 21971.9146 15572.7550 61456.4160 25682.1633 81186.2606 35257.5769 45432.8521 60241.7135 29000.5559 43988.5771 52413.6679 65971.5542 99833.5953 14794.2676 50991.5014 69181.3500 21484.8495 56102.0407 35182.9597 148748.0067 32783.7127 58512.7525 44997.8411 33329.9328 31055.2881 31957.5031 55755.8975 44760.2188 36588.7025 63692.6953 39016.7169 49730.1450 52424.6943 30915.2789 45955.3247 58224.8149 50598.5571 10061.7322 68725.3865 30894.7313 43149.5859 67087.6997 37490.7913 59283.2060 52243.9164 53886.9294 52703.2968 53718.7446 52637.4292 25910.1820 75008.5240 54349.2345 36129.8367 35536.4593 23966.6883 21319.1341 46945.8315 46496.8475 16864.7093 43993.8602 20183.1409 56935.1067 33085.2051 42142.3819 34969.6837 55578.5625 82780.3697 33147.5309 52936.3523 68890.3951 22870.3406 56766.3519 56446.8387 37638.3939 95082.3182 55702.0691 40278.1321 25135.9403 41878.4565 51204.5979 96083.6478 41396.3451 26222.5087 222056.9242 57144.0823 27622.1873 58547.2004 35635.6367 29744.5897 83255.0238 52753.5325 56614.5081 36018.3372 30731.4455 36258.7490 37838.5770 42825.6723 25295.0768 43925.8019 72806.8747 77228.0826 33088.2880 19886.8901 23423.2899 42248.3027 21272.9745 30758.5867 43402.6627 30758.4552 27168.3448 42799.4117 24894.5251 36787.3517 61317.8654 50553.9229 36630.2613 31146.3074 50275.4928 24434.4306 27985.9801 35771.2961 25532.6239 32182.4560 31809.4812 49444.7022 46779.5489 16186.7292 34626.8783 37972.8096 35768.0780 34916.5503 21317.4243 70685.7007 42380.7417 52613.9188 21365.5929 36702.0594 73481.8535 25148.5196 42983.0850 51333.0282 35579.5166 35538.3631 20529.1040 49635.9734 28465.2653 37814.0323 42083.8141 47823.4182 37898.3854 21075.7466 45514.1223 29197.2699 46102.9828 36357.6972 68520.4320 69749.3641 66289.3607 66360.0832 57720.1051 53999.2400 45448.3673 49390.0119 48053.4074 44868.9508 47829.5133 51416.8677 61749.1356 63121.5918 54018.4414 53831.8863 3558.1565 46115.9536 45943.4049 47304.6919 33413.7055 34972.8336 38907.7378 42345.2316 40564.6111 43724.4613 32756.3545 28762.0648 39485.8166 24642.3541 39059.3491 34104.3712 55864.6209 61241.9012 58368.3505 32493.1458 30642.8670 36899.9126 41986.7550 20661.1902 39577.1258 57682.7064 70159.0553 71019.5143 35769.9929 35652.9366 44686.0341 38299.9139 42126.9962 43515.2021 L-Glutamic Acid / N-Methyl-D-aspartic acid 81817.8378 84291.6490 51506.6373 74155.8727 56467.3938 72496.5928 80705.2391 62714.0746 70681.5278 87543.4171 159847.4089 42415.3676 39054.3182 50138.4432 104912.0678 82502.3076 34562.8782 68136.6891 34774.9014 118702.5982 56006.9924 98947.5627 77156.4930 24243.1709 39009.0754 94321.1822 47024.6027 119368.9987 56467.0379 59993.9859 73682.0782 42562.4332 53861.7287 94457.5834 60601.4269 47969.1717 72084.2504 53728.7745 52430.5960 70768.6997 72594.2406 57943.3836 60268.2279 39778.8487 46303.6909 111217.6399 73949.3775 22041.2149 104103.1502 136253.4868 40450.7910 137732.6249 64519.0826 83962.6100 72422.0249 120827.1494 73130.6056 86254.0779 54613.4493 153255.2778 75143.9506 65028.5059 57851.4247 91261.7852 33299.8566 39742.4679 53865.9132 57466.0123 51859.6575 94664.5032 46472.1898 74898.3836 52059.9774 49653.3791 76134.8442 61046.7146 63003.4097 62771.6090 85439.0167 59938.4175 80524.6636 69154.6274 85482.1585 41332.8219 63533.6955 116429.9411 126933.9048 48206.0228 55000.2036 87235.5986 168659.4964 68127.8947 54966.6611 44052.9374 153199.5960 36540.3822 72008.4477 70404.0861 48892.0574 73783.3344 109795.0375 132792.9034 46009.4825 58459.9084 53534.1180 90551.9440 92052.7618 37007.3819 57786.6628 121258.5315 61404.9178 50208.7152 34015.0998 44112.7347 67363.7330 157904.2138 56454.1885 84166.2652 52882.5066 32541.3749 84612.3353 46291.9705 40405.2716 67276.5244 48847.7472 117440.0456 84784.7079 60752.7657 49270.1841 53467.0307 76848.6154 54725.2877 52556.1973 46729.6464 72499.6133 84388.1512 99394.5893 130560.1263 57317.0053 50046.6443 43919.7609 54347.0316 87442.0035 61569.1010 104464.1337 38570.3984 52972.1869 91747.8791 131356.4351 67238.0848 79113.9005 59870.8255 38847.4672 47760.9942 50556.2602 69270.8111 39077.6683 74890.7173 41852.6286 92564.6690 41471.4063 86737.6156 63245.5969 52109.8711 82631.8869 1438630.8480 1406533.9450 1362044.8720 1407089.7440 1217401.0810 1236298.4840 1126240.9360 1172913.7000 1056013.6160 1004851.8390 952244.6516 986148.9656 1584040.0210 1623234.2260 1353746.0730 1292543.8860 107814.6028 92537.7257 87352.5945 84869.2429 86744.0178 78628.5599 131369.3236 156114.6722 91788.5224 78603.4577 56382.1262 61872.4615 62628.0377 59334.7679 82348.8628 51405.8870 81695.0869 78586.3956 73770.0003 65081.3040 63836.6464 85492.9051 43741.9346 75270.4417 51456.7443 88117.6491 94811.8749 92258.1063 75171.5081 61490.2462 78097.1903 75576.8264 85414.7438 L-Histidine_R1 Histidine 19463041.2700 8470329.1390 6161476.7880 20886779.5600 15740053.3200 7660294.4640 4204825.1180 5429744.3330 18655012.3600 17695117.9600 16114566.6700 4385642.4330 10725525.0600 5616755.5260 7484137.3240 18277199.2300 5504314.1480 19949208.3400 15633917.8000 16150020.2500 10212918.9800 18993703.7900 15092486.2100 18686972.2100 7576936.9580 8375315.3170 7314624.0660 15133813.3700 3525211.0260 4823490.0700 7872379.2180 4679056.3540 10631006.2300 14260733.1200 23833775.0400 3859186.2040 16447899.7500 5893957.1260 16469553.8500 16564454.1800 17754838.2400 11230064.0400 28931714.6400 4258983.0320 25560492.7400 14185836.5500 12618046.5000 17382853.2300 5793963.8150 9490792.4900 14834948.4300 16201103.3500 8078744.7880 12561576.9700 26716685.6100 20835330.7400 11748116.9700 16629176.7800 15603375.8400 3998496.6300 20848995.9400 18821573.6500 6277062.5500 13379631.0400 7416430.9710 8967156.5290 25643152.3000 11616008.4000 10715613.6300 4861746.1590 2885999.9890 8145625.0730 6458742.1930 15084521 6301717.4140 4746751.1280 18232564.3100 16429999.4500 11825730.3500 16268191.7700 4692278.8270 14369937.7700 34221351.3000 25429964.5800 19063211.9900 10651808.2700 3252800.2290 13155672.6500 6113327.9300 24491149.6400 14702166.4400 22973899.8300 4196770.1340 17773797.4900 28542879.1500 16085922.1200 22192062.7700 6443543.6850 6514610.3770 19828310.9500 18814118.5000 26490509.6900 12331215.9000 4567884.1930 14869205.9700 14333120.6400 19809049.4600 6784190.9670 11885657.5800 21578817.5400 20868849.4700 6016100.0580 4471247.4900 7756950.1650 3543177.1540 14402131.7100 8567552.8180 10882719.4100 16928285.7700 6055081.6330 7471932.9700 4500760.9120 7388657.8720 7055522.9490 2292399.0260 5492603.1230 16310585.4200 10149217.8400 6103352.8570 13765551.7400 10146861.3000 7353348.5720 11843622 5723475.4840 9808435.9160 19576369.1000 13482545.4500 3041175.0980 19676085.7600 20711119.6700 3333320.3730 14853857.4500 17892035.7500 3523081.6030 20303216.5800 21746021.5300 6732661.4560 3893821.5640 4661327.2910 7785887.5760 13719748.8400 25605774.6600 7214611.5470 9354242.8360 9238486.5110 4122193.2010 5702618.8110 11630859.2900 1790667.5040 32843458.7000 3972112.1870 21709967.8700 13408007.6600 7405315.8030 15491346.1900 7946312.1600 7669102.1920 8038039.8780 6894347.8600 6095189.4050 6281575.4730 6731147.1850 6182640.0890 6334118.2360 5880368.2120 5400801.8570 5503539.6170 8166097.8310 7702462.5500 7310366.4250 7285186.5930 7096687.9240 6810257.1570 7186287.1880 6291668.8680 6473476.2870 6439873.9270 7039966.0940 7200586.9480 7228536.4070 13683711.9100 13978784.6100 14866494.1900 11776167.4800 14062989.7000 13393873.7300 11950631.9800 12485924.9400 12425598.7100 14601076.6600 14626760.6900 15251337.5700 14644338.2500 10697083.1900 13813367.1300 12481852.1100 14955633.4800 15649540.3900 16206598.1800 15684515.6200 16778967.1900 15248306.0400 14815727.9100 16291396.5600 L-Histidine_R2 Histidine 18567209.3600 8117735.9880 5829969.2930 19870745.2100 15085322.2700 7287603.0350 3935051.7130 5182585.2500 17858488.2000 16849918.1700 15427821.3300 4153457.9400 10160421.4600 5328224.4090 7111544.8820 17675152.5000 5211583.7000 18990861 15079042.1100 15401756.0700 9722480.8700 18242220.6100 14551361.7800 17858681.9200 7198238.4860 8004955.0200 3276778.1470 14373813.9100 3378857.6400 4572449.0980 7491767.6830 4434458.8070 10140165.8100 13641870.3200 22715849.7400 3718657.7170 15777650.5700 5613514.0260 15671842.9400 16016265.7300 17107789.0900 10667621.8700 27682605.3000 4054390.2850 24447518.2300 13513806.5100 11988094.5600 8066363.6770 5516880.5660 9045097.2800 14207847.2700 15449255.6500 7669873.0160 12003900.9800 25706922.7000 19842331.1800 11329766.4700 15869345.4300 14982258.5400 3784584.9890 20022446.0600 17936987.6000 5939818.4060 12778120.7600 7091345.5660 8496100.9290 24673575.4800 11074828.4600 10292434.5500 4578610.4480 2714938.0540 7800910.7630 6165358.9340 14349729.2400 6043205.5160 4538420.4880 17408870.4300 15674753.5100 11255221.2100 15512534.4800 4430780.8490 13725497.7500 32603784.3600 24460284.8500 18230955.8000 10145140.2700 3070233.1610 12567634.8200 5881618.8620 23365403.3900 14000276.5900 22004480.6700 3976356.7090 16904445.5700 27247797.5400 15510471.0700 21351798.2400 6109296.6480 6162728.6400 18959860.2200 17968481.7700 25402920.0200 11788035.6100 4327593.1750 14217126.6800 13766895.5200 19004663.1100 6453127.3460 11341611.2500 20633338.6300 19931979.3400 5712976.6480 4283951.0980 7381808.2950 3353866.3730 13701351.8700 8185199.2570 10448250.9000 16152257.1200 5732613.3370 7113059.9100 4265733.3770 7022898.4000 6701663.4030 2194138.6940 5256078.1270 15603383.4300 9741880.4870 5821800.4740 13112542.4000 9633032.5420 7012757.7470 11281099.2000 5416971.3430 9336492.6260 18734937.2200 12845211.1200 2852846.8820 18824646.6200 19834471.1600 3142840.2850 14281935.5000 17140573.3300 3349265.6090 19568884.8000 20921550 6476747.7860 3697906.8020 4414624.4430 7409311.9280 13101963.8900 24556028.2400 6830198.1510 8941960.0710 8818477.8310 3878476.5060 5454013.9570 11074281.4900 1718768.6240 31501570.9200 3800795.6450 20953498.3100 12746433.5500 7056364.9430 14808680.4100 7625936.4730 7392987.0010 7739655.8680 6605910.4670 5839448.7140 5955673.0010 6375372.7230 5860251.0050 6012226.7790 5582847.4660 5173866.3170 5265689.1610 7760066.9200 7327632.6730 6958152.0610 6928042.4410 249916.1556 138345.7013 95038.6006 181487.8240 101753.5347 81228.4796 300172.6451 140924.7352 104117.8932 184274.2180 112842.1782 93139.4168 297301.8503 152336.5206 108326.1221 204622.3206 107367.0132 101992.1890 6829392.2600 6560859.2250 6918662.1190 6023915.5990 6158552.9330 6117738.4020 6697747.2940 6895006.4670 6891958.6660 13169508.0100 13457970.5600 14315262.3000 11330789.4600 13430824.5900 12802307.8400 11409680.5200 11896163.7000 11860279.6600 13962440.9700 14015794.1500 14544360.9300 14020737.8400 10200609.7700 13186748.2400 11936341.3100 14182164.2500 14867285.9800 15522905.8700 14973476.7800 16094495.7600 14550159.2600 14076514.7800 15511643.7800 Lipoamide Lipoamide 3769.5480 1460.0755 1867.6590 1636.9429 1327.6544 1252.9252 3224.9421 1828.2966 1593.9346 1387.4096 735.6944 1539.9640 988.9398 1064.0944 1373.9503 604.5394 L-Isoleucine / Norleucine 283357.2878 531696.6217 325513.5570 377593.3569 51347.1018 256922.3350 191173.5626 328316.3257 284281.3839 169319.7940 478790.1656 474829.0981 252780.0400 507106.9370 358413.9876 440208.7333 119590.0587 233709.8303 436586.2257 329183.4045 324528.8400 286788.8536 911325.1449 359850.3892 358300.2502 273562.8407 240828.4626 141178.3837 253396.0537 265143.1651 120381.0974 274721.9495 29062.8937 236456.5138 50694.1191 241028.9617 52989.6540 349217.0041 60793.9500 342073.7163 350774.2824 338038.5859 79056.0762 385175.4580 357697.4956 371013.6613 207813.2932 299389.6686 385561.0452 209214.5576 53595.1990 131993.8343 197191.6235 203275.3970 191763.1843 241946.7677 216215.0678 242404.9625 46792.4288 329341.5851 360223.5074 332069.1456 207100.7587 226805.9407 47301.4880 134518.6505 571873.0395 187729.6429 245428.1306 249988.1798 79718.5855 488422.0257 335712.1816 54122.5784 749967.5662 363942.6559 293955.6930 178367.3806 402429.2806 275275.6790 289103.1949 252005.2543 58756.1743 338833.1443 283096.1753 405331.7809 381664.0958 216712.0435 153132.3745 579530.2161 61347.5793 221898.5888 184767.5471 103132.5823 484579.4288 57436.0277 469142.2953 398015.0708 430678.4908 522488.3202 151054.7774 378114.0414 110389.3867 367719.5436 41312.8760 495368.3364 426590.7918 395272.6708 126194.5413 373917.0765 236511.0822 297104.6363 213602.2739 173417.8979 424473.8878 449281.7736 369644.5323 331043.8755 46909.8883 321722.8462 52782.7477 416794.0323 307662.5824 412308.5766 414695.8898 370520.3134 54084.1023 43654.1019 216171.5272 393189.8716 244846.1692 266533.9105 90447.6909 82212.4879 322129.5805 319541.9929 695814.4789 394417.0604 422456.8220 59890.7655 203989.9810 50483.3253 36916.5125 308975.7541 395900.1708 390211.4600 122922.2499 325407.5610 407772.7648 252208.4231 246604.9612 242824.4546 339772.5243 89044.6888 287511.1118 241027.1543 368104.3419 428060.8481 295609.8950 610910.3563 214958.5930 382715.4165 244847.2897 470778.4032 342700.4954 64249.0092 76408.5092 59094.6627 68264.0046 51989.5882 55448.8307 59438.0085 54382.1008 61678.9094 44154.7689 51453.2556 49584.0171 58976.4969 62182.8058 51132.2671 50814.8094 431127.1385 418503.6205 427282.8566 373716.4077 364235.4912 368177.6572 382405.8593 391824.4491 373869.1247 415370.3847 333109.2837 379388.3654 279030.5688 376166.6282 335654.8387 315114.3433 277909.1587 313473.1702 320232.8284 310091.9830 274608.3792 276262.5154 258995.2126 282856.5996 268961.2142 285011.3748 276969.7818 325917.3993 331568.8204 320956.1948 322490.8141 299956.9966 297111.4218 L-Leucine Leucine 275463.2419 432443.6289 148695.7468 247207.5867 109572.8369 358146.0213 465008.5801 926700.7962 229327.9970 520765.0819 1099345.1230 1496419.2950 186861.8250 962119.2910 733226.9484 660971.2379 148825.0150 134259.7430 1130146.2430 248761.3683 126162.7081 194959.0297 2344683.1550 689088.9544 298511.6755 978258.4430 160515.6718 198180.9330 626477.3639 150705.7388 161134.1164 513934.7492 78308.3978 160099.8605 108494.4615 138114.9717 102697.7183 276914.2474 81626.2078 924829.9885 863929.8221 685351.6768 169787.2604 815390.1053 1002383.6320 166428.9746 103292.1974 160191.7655 808417.0224 134377.6591 164979.3100 210297.5323 307188.8639 180514.8265 176980.4157 204324.0560 663498.3604 123292.6014 91430.5385 292459.2659 314285.8292 591977.0255 243416.5086 124162.0122 152841.8463 127848.9445 1284101.9510 129326.8233 361006.8863 554855.3477 108595.9615 875267.4578 150304.6418 117519.3629 1987636.6960 796097.4762 421038.8943 482254.9443 805676.3823 200734.6613 189537.7595 97974.4907 184884.3259 447048.1683 151815.8338 1014391.9970 982867.1455 162027.1717 84431.8130 939184.4624 137101.6491 164368.3166 150469.0545 125930.0703 1356258.9480 163164.6389 251690.0321 229649.6594 890815.1127 743042.9939 166881.3618 590320.4497 90754.9422 927076.5609 95783.4231 868528.9915 350510.1144 1483043.9930 83435.2336 189524.2046 177490.7890 649542.9574 556953.7322 106322.3156 1250354.1850 1057502.0130 239564.8256 809260.8183 169066.1614 306078.5648 102484.2496 863818.1481 420481.8037 861747.3697 1128717.0900 609267.8886 191813.8607 89041.5059 271290.0414 199554.7865 153216.6777 687051.8737 153157.7944 136514.4859 186248.8112 167359.2388 292303.3369 980784.9597 287223.5218 165973.2829 218668.9198 150767.1705 91324.4974 152908.2266 259194.4337 944057.4615 70670.6862 771785.2917 441439.6620 297288.1951 307210.4151 171793.7701 278189.8792 118394.1298 147537.3091 546127.8879 346493.4455 276708.1559 778320.0163 805851.4896 151135.8330 737199.6491 138725.6092 1189975.6570 669178.0555 152248.1360 171826.2234 177176.7836 155147.0563 138387.1164 166357.9095 117757.4512 148016.1625 139034.0160 137819.6232 113587.8018 135569.7007 115629.7002 118026.9621 117704.6007 95199.1834 863590.7773 846173.3318 862002.9227 609252.6705 618265.3081 592758.3839 480736.6950 494344.2278 481530.2115 459309.0136 419859.9949 333263.2948 590730.8000 357175.2439 549323.5564 490979.2920 366596.1688 378017.6604 171942.9777 169154.1701 167967.3456 157375.7284 332763.3808 206533.5024 256732.7712 160812.7713 178920.4536 184410.2601 169828.2176 172296.2786 176652.5994 155438.1703 160036.3770 L-Lysine_R1 Lysine 76810.8289 14632.5953 30936.6541 26358.1859 31260.0602 25181.3541 14211.1045 10633.4193 31286.2341 13037.3404 10874.0814 13719.8053 38430.2999 8928.6769 28920.2830 13460.7974 17704.2890 67204.7634 15416.2456 20063.5669 19851.2177 31227.7351 25670.8575 52233.8693 16828.3133 10762.9014 21312.6765 38170.6330 14214.5916 215106.0231 29068.6221 11468.2320 20544.4117 18335.9457 51709.8915 35973.3383 23389.7657 30068.0689 30311.3904 49713.4217 20140.5686 14485.0957 41832.9302 15162.6349 13929.4594 17280.1305 26638.3382 18879.7828 14376.3433 26915.4167 59349.9931 43432.8395 29791.8666 38794.5782 89853.0921 66658.0890 14848.7174 14303.8234 52797.3536 24764.7520 50164.1392 77868.8973 18350.0733 27267.6399 54513.3732 16002.8706 27067.8345 12211.7156 49636.9442 10815.7496 21907.0352 18080.8163 15542.6659 40063.1954 22291.7243 14511.2782 193189.7141 19126.7117 10411.6195 29318.4580 37701.0215 44202.1580 88463.3753 34925.4886 80437.2899 13682.5116 11480.8732 66074.0598 12255.0752 13518.3337 34307.1439 83037.8544 11521.9996 336648.1520 16338.4996 32335.2932 41247.6301 48290.7554 28376.5357 144934.6620 18501.6907 41639.1562 19527.9525 13695.8346 44011.5910 19230.1873 19631.1287 15965.5626 16274.0824 66665.3961 192796.0553 21665.6455 15677.7680 22594.1547 9222.0739 10411.8487 17712.1134 19398.5623 23238.4400 18820.9158 24074.6401 19739.5554 54417.5617 19072.5937 25969.5588 15027.3011 20508.2391 23996.6277 21696.7352 28664.3364 20172.6335 12905.1352 37877.0757 49946.7933 31996.3277 72817.0491 21293.6735 12176.2207 18829.2199 71421.7847 11114.5757 27087.7568 70301.1943 10279.4469 47930.0551 14110.5588 16340.1923 9501.9503 16962.2894 12568.3856 20176.4733 21942.7561 58769.5578 17767.1822 23587.3808 16871.4142 15032.8245 17418.6230 26274.2090 15830.0287 19576.9153 47876.0188 18449.3806 11599.2896 16607.2624 22096.6216 19884.8353 26434.6218 19680.7370 19516.2094 18121.2319 17730.7112 16864.0600 15760.0458 18300.3891 15039.2771 17111.6325 18725.8083 20442.4613 17344.6118 19931.4369 26598.7246 24256.4542 22029.0812 20826.4416 19722.1526 20590.2629 25647.0597 20065.0873 24082.0753 19598.9327 20235.5445 23154.5948 16144.2656 18984.8080 23577.3383 25513.8054 21256.1619 21351.1650 21764.0424 26162.9220 26069.0573 23779.0705 15835.0683 28486.2432 22248.3719 26825.0809 27953.8324 20951.8123 22286.6179 26889.5509 23012.9964 20346.4765 21010.5460 L-Lysine_R2 Lysine 73706.5740 16342.7981 28769.5164 27045.0202 23784.2793 24869.8339 14183.7715 10249.6201 30981.4361 14115.7777 11401.9181 12122.7995 37475.9297 9727.3347 26369.0868 12336.9431 16674.5961 65926.2437 14059.9829 20359.4658 20336.9325 31627.3999 24863.6829 51214.1830 16677.5819 13615.7329 22103.6675 39123.4878 12480.1689 204110.2611 30314.5395 9900.4927 21184.7696 19130.3496 51044.5863 34814.8218 25323.4913 29733.4229 33219.3841 47341.2360 20890.3515 17740.7073 40430.6637 15568.1328 13267.5186 18401.5351 25106.2444 19895.1767 12753.1763 26599.7597 59236.0086 42008.0914 28537.2005 38404.3824 86321.7517 61873.6117 14588.9357 15326.4771 49470.5433 23349.4217 47190.8478 72792.6685 17363.6086 28098.0841 48413.0546 15855.9904 26804.6562 12690.8315 46322.9250 9390.8253 20129.0939 16795.5354 16952.1011 40762.9155 22150.9949 14101.4961 184023.2926 20917.9987 11375.8063 27676.6869 36841.9162 43678.3073 83330.1696 33641.0753 78232.8915 16252.5519 12193.6965 65178.4999 14355.2403 12425.6190 41373.0481 79038.9716 9946.6526 316511.2465 16533.2512 33413.7933 40465.7501 47082.3698 28691.3354 139101.8819 19175.9684 39355.9037 18676.3251 13326.1951 42360.5572 18677.1459 20041.6486 15643.8252 17662.9479 61713.8032 183470.0557 21485.8087 16269.0293 22447.0361 9449.8915 9854.8178 18456.0071 17293.7817 21960.8317 17633.5072 22382.6669 17317.7833 54168.1813 16680.1949 24904.0556 13961.1303 21181.8047 23758.7516 19987.2877 29429.9983 19421.2303 11390.0471 38937.3092 48876.9792 30839.7287 68234.4129 18712.6621 13086.7423 18125.9456 67670.0112 9884.5792 26528.4366 66035.6848 9618.8878 46098.4103 15600.8618 16937.7703 11417.9702 16945.5818 15011.5991 22010.4713 22694.2697 55384.6468 16479.7541 21999.1938 13271.0775 15363.2883 17553.1336 26778.5820 18014.9358 20368.1939 47589.8491 19137.3350 11827.8781 20735.8177 23097.2558 22386.0108 24264.4075 18696.3400 18351.9398 17396.8285 15710.4326 16207.8994 17236.6628 16181.9628 15732.5200 17251.1846 18385.3729 19601.6043 16393.9398 17788.4795 24048.0080 23862.5875 22342.5648 20955.8443 20653.1191 19575.3214 21882.3438 23744.2045 24096.1245 19827.5532 20293.9813 22546.9042 14464.3075 19065.3277 23247.3348 23047.0493 21074.0109 22063.6692 24745.7257 25913.3746 26391.3802 26602.4975 14290.8690 28987.3614 22828.5014 26477.6849 29050.3510 20673.7026 21650.9359 25364.8048 22483.4006 20110.4668 23574.2056 L-Methionine_R1 Methionine 332250.4982 430748.5719 171406.8881 523748.6648 481379.2281 359568.1207 216428.9202 196942.3380 265524.2905 136400.7631 309293.8286 244043.4541 231090.6753 269658.9005 168587.7695 292056.5704 108410.8944 160298.7239 402810.9396 342935.8351 257312.9553 282727.2406 607023.6372 196054.5877 233067.5684 294627.4751 286358.9259 694772.1248 236999.8806 167710.8912 372330.9209 107637.9527 213069.9603 132196.8713 156556.6948 306980.3020 276128.4553 345589.6457 265867.0608 340278.5929 285029.8342 253872.0534 164455.6743 353437.6967 191453.0795 200099.0276 180815.0147 399792.6493 126680.4387 271105.5026 430970.6074 771842.0897 189373.6809 182100.1511 429727.3757 423848.8567 211463.7549 332831.6903 267217.0081 321516.5506 281933.6063 272204.1459 191406.7395 287368.2810 295366.8651 481780.8043 374048.9225 232410.0131 168001.5076 246673.7099 225131.7945 255915.7348 322090.3335 253898.1777 396708.3718 125941.4565 334321.4689 129126.6634 388021.5590 282244.4353 374891.8398 244065.7122 204093.9776 374907.9994 394648.2139 370165.6148 272153.8550 264778.7281 150111.0661 430697.8097 443244.6393 416913.9642 309517.9628 301958.8341 368145.8417 277580.4291 333285.4016 327360.7132 300334.4580 394079.2611 298159.1886 329910.2358 206076.7869 293317.6195 329502.2487 385175.6351 403206.9119 435437.2966 235075.4865 548768.5859 379708.0843 206721.0009 231916.9890 249863.8184 265476.9828 299405.5874 334733.9455 270488.1396 279986.3715 250819.0850 205239.6764 302352.4760 265910.1735 216370.3160 319351.6626 318087.1601 499199.9336 209038.9022 198733.4085 422002.0332 413179.7181 268494.8832 332658.9226 308428.2906 402623.5362 384170.3236 343382.7359 239241.1463 421212.1110 324524.0330 215789.8029 270102.2449 332510.5026 121359.1344 327310.9007 330166.6680 151846.5957 204161.9901 330888.0159 210723.7185 173056.6459 357104.0840 303590.7354 474164.4833 253721.1818 235052.8515 238161.8116 396880.7685 203332.3905 359857.4460 271353.3613 236146.7236 290096.9983 291327.0239 287221.3930 352203.5555 296570.1827 307357.3884 19651.7489 253735.7941 243069.1364 241911.9394 236506.8610 234490.8524 218464.1427 74781.0919 70601.9662 70224.5468 283145.0552 277671.2909 261974.6157 255890.8762 218286.9433 237481.3707 91379.8430 96469.3963 93833.6055 260872.7755 240058.0803 258600.7052 252874.9548 234530.5854 246185.7171 L-Methionine_R2 Methionine 233930.2717 320956.2651 83318.6120 228844.5989 404761.2395 236524.5822 129076.8642 184865.1758 78462.1595 248029.1864 197702.4586 188824.5538 206377.1498 105141.9371 190698.6103 101561.2064 81094.8501 325123.4704 240650.8213 162518.4750 201512.5262 493480.9345 141140.8926 143933.8773 159111.8890 206228.2316 542810.1076 154570.5215 74152.7468 259065.1163 49199.7554 148220.5986 63629.6573 73541.1488 203241.8378 206035.8861 245045.3766 222175.7612 234995.0545 203476.6389 178961.8582 95129.6095 246871.9890 129309.9702 190311.7114 64250.3716 316024.7618 51350.1358 214672.2800 284791.7589 596323.9045 113061.5216 122824.2419 306431.2007 404035.5812 138990.1781 237281.5634 188326.2335 246524.8760 222388.6897 192620.9488 133688.3132 212628.9963 223721.2295 392543.5003 291056.5816 154959.1745 115165.4830 146704.8249 150074.1488 165814.0049 216652.0249 239408.1079 302524.3691 44313.8661 267965.5096 65485.4982 244926.5490 209350.6306 295345.5473 170287.7805 188414.9678 288330.8338 308949.1504 240040.8203 154892.3855 183454.0661 92414.0412 311159.7616 323725.7158 318172.8567 203094.3899 205750.5748 232928.5358 209180.6445 239165.1733 256284.2704 215044.5585 315240.1771 296975.0939 260493.8502 118976.8307 225051.7617 243338.1108 297431.0658 307161.2183 159358.6108 379020.7099 311853.5375 124961.9996 172508.7976 165472.8335 225600.3072 234314.8761 194309.3339 276718.3757 155051.8591 183758.0646 204565.4251 195734.0575 130479.2910 231021.2702 235408.6990 314152.8726 88577.5609 156035.8309 285836.5247 328902.7843 198249.9261 228040.2405 243790.3863 316505.1228 262661.4457 258272.3317 149709.6152 347555.7331 221978.8552 134347.3362 204485.8326 260896.1140 114741.6952 237820.5964 247401.0981 100171.8670 123570.6478 257339.2975 132476.6186 71231.2190 280010.3010 229775.9825 381066.8030 152361.0862 167922.6586 159746.0320 297022.9483 149232.0858 273427.7553 193850.0655 176937.8779 216672.7663 210555.2815 176095.6925 11590.2473 3964.2918 7676.0385 7419.4439 288890.5333 251001.6958 258153.3548 253526.1139 238359.7397 240443.4725 228288.9423 246368.0993 239437.3793 250242.6375 248849.0754 250964.7241 221186.8147 237673.2512 220172.3667 66470.1165 66025.4637 67623.8684 278901.4467 275539.7505 252944.8624 254911.7041 214592.7523 231298.0472 82239.6894 93006.8081 84228.9316 265854.4217 246742.2894 257255.6967 256257.5191 240823.3648 245432.8182 L-Phenylalanine_R1 Phenylalanine 601921.2170 893995.2136 558588.4684 641355.3374 389193.9127 494242.5342 483907.1658 1847273.0630 421781.0281 912665.3695 1077893.0460 2858885.0670 492311.7067 1555505.2920 558152.0718 685214.3264 453467.1609 588142.2378 1358084.2010 390459.0770 353105.9591 752711.9846 5239996.8050 705541.8593 602030.2733 2445254.6010 530546.3937 686422.2507 1487198.4000 750525.8632 466247.3352 1168142.3880 308240.1925 669466.5104 587959.4839 558568.0003 498059.8201 721907.2291 520561.9069 484756.7209 1211215.1110 526440.6989 877331.4198 1357308.8770 1811886.1130 436079.7563 479613.0639 629405.2678 585200.9607 311657.6895 576809.8509 797137.9731 449474.9383 313249.7851 524601.1400 538338.4804 2010895.1510 507810.9792 358360.0762 498872.7611 465796.5221 639030.7133 329689.9234 313749.9504 399952.6539 323919.8205 1010368.5170 391482.8286 378117.8339 371223.0302 310980.7922 564223.4234 567777.9599 296592.2742 2447790.5080 526883.3298 661456.0281 1355319 795452.4540 627877.7542 566944.6575 392364.5975 583781.7258 711891.3876 526166.1092 2262263.6820 2036078.8040 439875.2365 278145.7508 949747.2726 562288.3798 449717.7928 358108.7310 372893.6388 2981685.1900 460561.7552 655054.7930 569649.8444 1649123.7490 580208.2436 604274.6210 620690.2817 361189.0239 2180566.4970 301051.0988 757584.9261 752069.6794 3512052.4920 338182.1542 1028458.0550 750699.3162 738833.5239 1073216.1150 382036.0908 2710670.0580 1263644.1520 693292.3095 586439.8133 919310.2541 741590.6438 309246.6038 766047.6629 630420.7382 1148543.5590 2204363.0170 657532.0812 823262.3274 390820.3279 401092.7608 786648.1020 754796.6541 808787.4242 450669.0006 517203.0663 609335.0647 436230.2575 544867.3878 1978898.3760 1005456.2400 493552.3620 343552.3796 463074.5319 286898.6355 471247.5603 725691.9631 1476232.4400 284069.5048 1670822.8720 542360.1057 392281.6243 306018.9629 690644.7694 690484.0407 320364.4912 366792.6845 467352.4963 423526.5826 946281.9716 1508490.1850 776718.3341 327871.1404 463177.4158 533390.1832 1499514.1680 517827.1444 383537.3758 361991.2648 372020.8375 367448.7844 310173.0285 309143.7437 335723.4371 342916.2202 325797.4760 324375.5397 302351.1043 308810.2877 308476.3687 303958.4420 316206.1758 309915.9650 635833.7672 665227.6022 644933.2774 614227.0456 618009.9638 583005.7545 524957.5313 513927.7985 522062.3507 580533.5233 545707.8869 593741.0066 546627.8873 574849.1134 557730.3724 515046.2660 495079.1863 531956.6220 598538.4902 583665.2880 558594.0209 565744.0987 494341.3455 549546.0976 512907.9832 543051.6637 580338.4314 498667.7239 471807.6124 563008.8465 519539.7344 518140.3451 520873.1914 L-Phenylalanine_R2 Phenylalanine 574368.6930 848818.2345 529651.0255 608641.8022 333883.6977 463301.7893 445193.4458 1756873.3310 402155.8214 871738.6104 1031298.2370 2720781.9460 466951.3920 1497375.1240 530570.5814 654354.7837 405849.8194 540622.0934 1307720.2190 367185.2284 329425.9067 696774.6172 5093221.3710 652818.7464 558600.0801 2308673.6990 505260.0948 611258.6083 1428038.1210 701472.4192 426471.2968 1121807.6340 277202.2497 610303.7975 543916.0326 523521.2739 465459.1509 679598.4343 487307.2411 451969.9244 1168256.3720 502591.3616 815550.3523 1292718.7810 1746624.1980 401150.0752 454238.4680 587994.6655 547108.6885 289017.4549 526212.3122 708786.4179 429281.7354 276892.3077 461030.3774 499108.4867 1933712.5910 474600.1966 295047.4781 470914.0056 444100.1276 603144.1840 303164.1424 285454.5448 353919.3639 301265.9314 969179.7864 356236.8962 345032.6841 343529.5355 266957.6787 525849.9704 537927.2820 265587.4151 2374327.3960 477353.1726 623600.2562 1296395.7150 743889.7222 570623.2137 535642.9202 372480.4331 539901.1043 679898.9842 495979.8176 2177902.3600 1962998.3810 417376.8881 248272.4525 909233.0622 494168.9545 416269.2627 331202.6596 338736.9499 2861882.3420 385983.5702 613618.3960 526232.2660 1572450.1580 545894.6213 551558.2882 578903.0272 303332.0972 2094004.4830 267537.3702 716701.4931 698857.2423 3389725.8540 306069.3497 975657.4783 694459.9410 697818.6121 1038024.6820 358076.6042 2564014.7470 1217111.1800 647015.9574 556361.9948 857337.6802 711224.1914 259233.3761 727428.2646 601596.6888 1081562.7560 2125921.1510 626408.6138 766016.8370 364537.1738 381396.6502 738275.2408 700321.2721 771384.4268 413151.3467 473872.6456 578083.9406 409995.3315 506795.7703 1911299.5680 960581.9327 454811.4379 315322.1829 407175.2166 261847.6024 427377.3335 693497.9422 1421214.9990 264769.4778 1601451.7610 509389.9783 366578.2359 285982.5880 640202.2093 656242.8645 291837.0113 335895.1145 443107.6264 392734.8265 898269.3459 1449760.4020 736815.9059 299761.5926 434837.8451 502699.1956 1440810.3850 490914.1813 354438.5810 346275.3879 354031.5582 357671.8756 304685.0457 287971.2571 322638.9932 328016.5947 305894.6272 307298.6397 289487.4666 302876.9338 289847.3734 290700.0616 303566.1501 297551.3760 620357.7214 623247.6716 617526.4470 590009.8547 599402.0303 562882.4014 509323.5954 495507.9375 494806.9204 559414.3047 524150.3652 566580.7027 518863.3465 546528.8520 537917.1205 474151.2808 467657.0119 506172.2006 569375.2666 569343.2837 530001.4195 547900.3445 479700.2563 527551.2411 491610.3891 528487.8281 563660.2108 485946.5648 447727.6279 542526.9000 501252.2025 495103.5279 509998.8464 L-Proline_R1 Proline 417432.2864 539687.0376 249570.8936 495277.8166 404354.9105 440614.4256 134645.6407 413071.3515 613135.9933 296437.5944 415578.3907 287049.8380 171189.6900 205316.5157 286195.5079 402457.5260 174462.6531 266348.6409 714157.4066 392034.8371 216816.9488 615360.2248 833718.1553 394842.3056 448990.1503 371532.8979 627420.1409 408793.7322 568736.7087 519297.6787 194681.8518 1156365.6950 534284.3098 257794.3306 473894.3539 227396.7866 114121.0934 305634.0101 524985.3518 350011.4698 255633.0200 311400.6130 295526.2313 284522.9774 298286.8274 829806.1551 372263.5694 446656.2696 294874.3665 302285.6272 195043.2867 393810.6351 260637.6670 1749773.6840 751840.4430 212452.2267 301488.5510 728709.0521 503627.2168 319937.6625 502787.6115 309086.9113 333492.5604 418005.3888 208458.1394 232505.8932 607976.9286 296833.3902 257929.1995 237353.6108 166131.8759 473035.8234 405521.7024 171597.1443 400169.2378 274815.8606 342277.5697 573026.7817 490644.5337 349366.5707 234512.2015 369709.6461 265060.0561 341855.7353 441070.7701 330041.8722 190476.6651 720687.3680 357262.8550 564937.2606 622136.3853 640146.1111 166694.2318 247631.7287 681290.3636 668656.4390 1152554.2500 215877.6255 321099.2849 410339.4977 483096.3088 509291.6317 169307.8899 202247.6756 174202.9452 343807.8390 870815.3906 1301048.8180 384920.3382 1012957.0980 159941.8504 406440.2849 121048.2714 1065626.5210 314602.2987 241007.9222 308198.2037 732116.8632 453163.8284 230717.5842 241205.0530 414547.1203 642880.4219 279118.1427 286448.2439 369299.7285 452087.6720 286751.9046 240181.8869 312557.3556 343566.5150 173764.4664 207412.8628 271603.2751 448487.3367 457730.8778 1575969.5900 268284.7013 441031.7284 263033.7624 149141.5590 373977.8596 178671.5917 192874.3740 518948.2689 641307.8178 270805.4055 364706.6395 249454.4804 213017.2152 488626.8327 1208854.2350 644002.2157 259171.8789 352085.3184 185157.4372 318912.7892 479188.5298 470240.2536 671060.7480 127214.4949 747642.9489 392474.4246 418156.6145 790202.8674 734153.4231 664558.6659 682685.8379 650634.3441 596831.1362 559061.8452 617753.0421 606522.5214 588049.3594 566662.8424 523797.3485 528504.1680 560692.6956 526001.6850 513413.0066 499316.5437 1054227.0980 1160102.8530 1219211.6180 900499.4117 622126.1218 900542.4372 665816.8620 810223.4477 682479.2389 545277.0145 566721.8339 569720.1706 537073.8535 505291.3244 487528.5557 449070.0609 429689.8521 473190.0603 522968.6547 492797.6512 461829.1118 474465.3140 460067.7392 426257.3191 461477.9692 491503.5263 467090.0632 549244.4392 479339.3005 501194.0654 469470.9345 433938.5720 428949.3787 L-Proline_R2 Proline 306967.8169 457943.2736 175891.8803 414594.0265 357632.5951 424316.0493 195390.5394 319252.6823 449757.2696 331892.8461 309356.5817 213824.1924 174559.7445 234681.0148 303639.9223 363747.4614 134483.9403 273303.7182 457299.0149 357476.5332 269378.3870 428138.2065 682237.9477 272919.5323 312876.8905 315109.6577 512582.9570 385739.4463 453942.4630 399249.8286 242649.4132 160246.6574 314005.2681 217777.5416 348051.2633 193854.6269 273530.1709 217810.8353 550005.5605 369501.0176 307460.2118 244724.3495 301616.9902 206478.4857 351403.1878 457747.4392 353165.9179 378103.1039 271859.5890 268187.6175 311596.4443 383624.9065 317242.2064 698870.3697 367622.5907 268134.9340 740836.0167 274937.2121 317677.2668 448607.4301 231059.0452 274739.0703 401784.6848 226061.1461 249767.4928 503672.9829 286886.2165 411641.9986 263005.3682 143593.6504 448231.3747 393707.0524 171290.5557 356839.7912 244282.9454 323212.3205 525018.3688 437734.3493 332243.3427 213833.7415 399265.3380 259830.2250 233753.2971 466068.7179 325359.4036 262877.3898 436588.9058 219330.0346 597607.4706 610192.4459 627807.3282 182159.5639 247268.9895 634110.6796 524491.2642 649002.4447 228553.1220 311448.5676 460174.1588 404086.2745 406104.0684 170133.4168 194833.7823 177911.8150 457202.6496 994760.4565 359170.2249 339421.7019 973404.2544 439373.5670 173661.0174 165583.5421 478584.3318 256100.4979 288416.5142 387304.3068 588764.5687 235150.0806 172855.1481 299740.3699 577348.7695 229837.7094 175660.3864 334295.5059 263946.8902 131577.2688 283622.9509 339909.6222 178066.5836 201488.5975 195404.2700 286837.6502 433038.2994 1391679.7890 256463.1866 576597.3134 285896.8395 156671.4875 484450.8643 277082.5503 193590.2928 507641.0850 462535.3665 181871.9489 250323.9837 257334.1232 585298.1129 486731.1860 618052.2797 263716.7456 267580.6027 208015.8036 258702.8026 384217.7174 209052.0135 687051.3954 137988.9644 621973.4678 290067.8072 289997.1730 568763.1887 263522.5236 255340.1534 244532.8375 234450.9312 190015.3229 182143.0167 185173.2481 177141.7213 183270.7161 174863.4077 189736.5342 220133.3411 206479.7132 185935.7643 166804.8656 11801.3197 14118.0529 12356.3997 11995.2762 11529.4855 24410.2372 28406.5703 18941.5904 23341.2951 13905.8609 36647.7796 348347.7539 347050.2541 347672.0228 249527.2028 262514.0888 267681.2325 305753.2726 317025.9265 408987.3433 405210.1093 407581.5461 382342.0390 374441.8703 343790.1823 310302.0400 303894.3881 287829.9132 357235.4605 362875.7841 339899.2711 338426.3814 332981.0150 327304.9774 350868.2304 362396.2020 353915.2214 413737.4902 387965.4735 369660.7242 346886.2169 323732.9769 320536.2740 L-Serine_R1 Serine 644078.4334 791764.6883 353268.1339 746926.1179 752064.9036 793048.4620 412660.5797 404991.2950 784584.7915 257303.9265 700417.7855 635214.4904 540899.8486 501123.5615 668023.5026 679663.2295 456368.1207 738071.0399 582426.8992 772439.2878 711334.1972 568513.5452 1336282.8800 401909.6544 782272.6560 701441.1942 700902.1298 1234241.1300 451584.8222 575646.4312 909355.2991 314329.2595 481277.0403 649017.3882 616981.6641 521847.7053 496523.5516 457210.5039 644129.4843 633059.3224 732035.7801 666526.3363 640159.0324 627305.6722 927489.7428 470925.9744 421324.3904 555272.3033 759427.8247 504608.0220 644900.8552 1299300.9500 462805.8894 417637.6690 602065.0858 962811.5116 493942.5433 412839.6713 724751.6515 363081.6370 719905.3186 1053694.9350 620909.6683 1007983.2930 582794.9550 775452.2625 853336.9998 728306.9053 391794.6107 462575.2335 264705.9458 607552.2691 633652.3773 875073.4761 1090532.5960 387564.8368 505798.0222 450439.5382 524388.3724 592106.9773 577198.0555 450055.3830 1091708.6550 436108.4223 728310.6485 819908.9999 555862.8654 433726.9024 285993.2044 1607329.5540 631684.5495 527409.4212 503569.4405 830147.5887 789410.5883 510397.3491 838118.1928 628008.6020 997926.1500 604534.1738 703651.2730 709599.4674 529896.1896 892621.5965 805682.9823 626252.8168 924073.0443 315120.0516 307167.4486 652419.6101 545643.0677 416540.9248 594536.3519 309368.3587 504480.8741 641139.9562 832552.5054 342843.4269 637025.7717 449958.7278 577165.4846 751731.7719 526960.0047 564149.1455 497361.7321 732284.0272 587694.9243 413341.4127 388722.6597 748118.6033 845947.8268 575128.5949 467455.3979 560217.0053 777627.1810 551185.6785 728118.4868 557700.4025 471364.1429 852097.5462 460509.8133 481260.0330 730889.2015 447613.7737 553415.5897 726284.3237 306362.4755 648136.4311 648723.4219 412034.7733 492225.4003 1126802.2360 525404.4830 790273.6314 732485.4517 508623.1297 409108.3333 773470.5878 354184.1587 801432.1629 499515.8943 474566.2556 548423.5925 773802.0136 442444.4614 260628.2655 246795.5025 259009.5756 241790.9135 217443.8093 234202.1283 203432.5008 197562.0514 181367.5716 186146.6006 189935.4050 190145.9203 260568.2318 238238.6474 240527.7414 232370.1974 506368.2207 502575.2276 521850.1695 480892.3636 461580.2658 457024.3429 571479.7154 574157.3827 573295.4775 550149.0453 578768.8557 642865.1355 493193.3784 586446.3518 560159.2631 542031.4791 568004.9334 561820.8222 566559.8968 586333.9900 580392.0619 572582.7557 405499.5037 542157.1997 497943.5016 599951.7517 610608.2051 636405.2136 674388.3978 739523.7597 661609.2041 689381.6127 674902.0698 L-Serine_R2 Serine 585008.8016 750853.1778 332311.3911 702146.8954 709486.7474 732541.6156 369305.6807 383265.9454 719206.0086 241538.8222 635409.5723 596120.8916 514641.2903 473096.6505 607654.5470 642455.0336 422238.6718 689197.8564 550749.5417 720635.9324 681146.1779 547569.8829 1265044.3230 381701.3780 716559.2564 650250.7211 649728.6097 1148918.1210 422875.3077 538674.3301 859648.5916 281745.4809 456510.5825 600605.2000 552666.7758 489779.7229 462744.8668 426181.8615 596268.4983 596839.9078 657355.0139 600485.8150 593920.5121 603909.7034 853276.5026 441950.0522 396573.8824 515631.6239 718871.8654 477108.7640 601992.3790 1214584.5090 432142.2984 399603.1610 571451.0102 902458.7683 445956.3097 383920.4316 690002.0055 341310.7491 694464.3802 974086.8499 587567.4310 936337.2889 552411.3687 725584.6297 783284.4141 687420.6362 376304.7401 439853.3594 256860.5460 577005.0023 231837.6264 818127.5101 1032224.9230 377480.4994 488877.1525 415959.7034 503186.7738 563896.9745 541350.4632 429819.5119 1014256.4120 417934.0651 675044.8641 775615.7950 524246.4027 405815.9223 272388.0101 1504792.1320 603355.9338 514070.7122 468184.3274 771651.0295 738712.8211 491794.4519 801701.5379 595779.2972 933143.4219 587118.0744 659971.8157 647393.6451 522117.3912 832492.1050 754819.0583 596775.5405 876843.9415 282709.6748 278706.6694 618804.7582 515313.9275 396480.1748 545687.6487 287211.2678 490447.3383 600307.4560 785011.3113 321165.2899 288284.1204 417418.1880 535376.5848 678063.0618 467811.8857 528287.3136 469676.6950 684472.1896 256015.5585 387756.2787 361650.0123 693654.7654 787931.4259 525626.3279 435534.7915 233597.5815 728168.8779 540733.8652 653212.3229 521334.4947 441094.8745 380788.9420 430405.0359 455304.7302 695193.3722 421476.2257 540457.4683 688704.7078 288420.4637 599270.5963 599157.5017 393048.7338 460504.8442 1063281.4810 489923.4712 733132.8788 693941.8083 491293.8518 382282.2586 717001.9459 346174.4868 756151.0556 468461.1900 439779.5254 507747.4818 705554.1299 408113.5064 240061.7907 238444.2303 241729.9894 229665.0262 210104.6253 223538.8963 199192.9455 189501.2837 173357.5752 176581.3697 179197.3453 176650.5991 237662.6593 229960.2716 228346.1120 221865.5242 20416.5924 17763.1008 15833.6856 15966.1957 16110.3377 13396.1710 20519.5374 15627.5224 16745.2072 19120.3001 16295.2396 15995.7965 21375.4565 15445.4862 17797.6639 22217.3229 19090.9477 17512.8016 500071.1849 496385.0172 485396.1125 455510.1372 440496.6723 433461.8198 534933.6366 538036.7545 536584.5534 527691.0957 521390.0029 598808.9821 458035.4649 560341.6311 526399.0078 516099.2020 534567.1751 531072.5508 536513.4501 544898.2288 537989.5270 536379.2161 378803.6096 505812.7289 461970.1530 558943.4047 571346.6535 617094.5456 620856.3933 690343.1499 622078.8922 642884.6536 633967.6075 L-Threonine / Homoserine / Allothreonine_R1 1094190.7760 1863704.4380 599865.9338 1115527.0070 1131370.1810 955302.2055 455062.3991 605578.9684 1922402.4700 485329.8957 1215657.9810 1489040.6420 722781.2253 1035412.3710 1011881.1810 927176.7608 764082.3438 1414539.6680 1340530.4280 1429839.4210 787767.6152 977808.8275 2925142.2010 649329.4076 1313545.0130 933828.7299 1083296.4340 1775229.3470 624674.9521 880904.9389 969146.3701 470474.8167 650854.0350 883028.6150 933589.9333 840213.3776 649384.6155 791448.2654 748033.0329 1293105.0980 1154638.8960 1565028.9820 1515569.8850 867338.0501 2043105.1840 599298.5199 797346.4821 939141.8273 1090436.8500 1029406.4850 889969.2698 1967155.2840 617121.3359 549304.0249 1177868.3690 1829420.1800 1000122.2490 759077.9824 943363.7915 619998.6505 1043043.4220 1673224.5830 908987.2224 1400726.5800 779004.7233 1208838.6110 1975315.4710 976970.3983 600190.1203 549657.3299 486554.5136 964118.6812 966973.8217 1097184.4390 2476767.8990 669151.2098 812801.8905 744807.8804 1025651.1970 1100311.6960 1371952.6330 748264.6200 2236954.7990 1076138.6870 964046.1084 1033693.9970 578660.4525 634545.1582 350246.6171 2788473.4330 1152085.1320 1075294.1810 780132.7695 1125357.2570 1394108.9260 966468.9099 1614055.0340 1075075.9860 1603648.4990 1150383.2820 816093.8498 1245539.2780 1055666.7960 1080397.7550 1057672.2640 1300912.4270 1383456.4040 824385.6980 498179.4773 1133379.4530 1642473.4610 808850.2394 1047209.2230 529236.0507 725504.4047 1124034.9250 1435174.4230 1390304.9890 1010214.3390 810061.6724 769170.0677 1067529.3470 957012.1321 801923.5709 779354.6949 1121684.6790 914217.0233 656968.8727 486842.9353 1549216.1630 1269148.2560 797387.0105 766161.3681 893311.5230 1239307.0450 1179085.5120 896467.6583 584170.1370 1000966.7430 1753804.4940 715530.3014 898857.4872 947413.5149 681366.0156 896923.8183 1178030.0530 390224.2622 744735.6261 1196659.0830 479451.9918 591702.5729 1553192.0160 1047611.1420 1243985.5060 810245.4876 679714.1373 780478.0515 1020071.7280 558338.7214 1941673.9180 867224.7835 940252.7873 933111.2753 1283283.3930 771461.1913 1364743.2840 1315524.9410 1298988.8970 1245106.8590 1144566.7860 1108107.1480 1152961.8110 1124002.5740 1017800.4580 980823.2183 950858.9375 981483.4796 1268174.6710 1244572.8110 1206182.5340 1110408.6160 1269393.9080 1250676.9400 1290695.1240 1145220.4940 1134230.3180 1134420.7600 1177450.1110 1212136.2520 1206919.0530 1058693.5750 1066508.6400 1116372.9690 972857.1862 1040348.3830 963843.6067 932622.2147 953733.3937 942490.9455 1023912.0970 1017897.8590 988918.3764 975376.4747 796525.0860 935619.0483 835445.1721 979464.2226 1068642.5010 1116633.7800 1080214.9410 1173290.9490 1100971.0200 1107938.2470 1068886.1890 L-Threonine / Homoserine / Allothreonine_R2 850891.4862 1530920.8140 484198.8248 873593.2380 910339.0615 784323.3646 347218.7944 496429.6751 1548706.2790 381075.9369 941623.4766 1192558.3720 595269.2890 849044.6673 810746.5902 766970.0461 623383.4455 1106755.6420 1103055.8110 1100085.8300 632799.9185 785727.1702 2361930.8640 533594.8957 1066862.9550 723525.8377 861653.3449 1393634.5480 518145.6369 701734.8608 807959.7678 376182.2626 539898.2539 717931.0148 737780.4366 670142.0945 572745.1363 657312.1893 596492.9236 1054057.6330 931767.6670 1219317.5860 1183799.4640 701479.3462 1652012.0590 497259.6488 634200.3673 757601.7456 869996.3977 847133.8999 690322.9103 1517018.8700 480405.6188 447952.7473 948865.6865 1497632.1540 758500.5821 594139.0216 765280.7201 493998.3508 846032.3905 1293096.1390 701272.9767 1156091.5000 642866.0918 991843.9586 1597374.0980 792393.4980 489856.9639 424269.0404 407950.2011 788868.7443 759405.4955 900007.6418 2001355.5160 535547.8615 631967.0873 573725.3429 797932.5211 911386.4191 1117243.7940 590232.8130 824532.2045 869020.6925 747687.8975 796346.8065 439092.1556 513974.2730 291498.3926 2119618.8510 898673.6227 870418.8603 217516.0561 887661.2338 1063239.2490 803515.6530 1248612.6340 876060.7499 1236794.1020 938900.1375 670988.3467 1012837.1680 859314.0865 887402.5059 868236.8827 1037173.8310 1131472.2780 649131.1840 386179.1029 880499.4511 551647.0135 648136.2549 818539.5684 421246.0888 591203.4596 881207.5307 1172887.5640 1127003.8100 835437.9466 634257.0420 618405.0485 869924.7298 802731.3608 615141.3459 629772.6494 863918.7775 777854.6937 528840.6405 397794.2352 1188720.0170 982211.4069 619974.9440 625275.9319 683599.6553 1027845.0480 962708.1529 739802.1373 439625.1278 791061.7057 1421497.7510 555685.8952 732871.2451 767495.2004 553707.7321 736950.0819 970215.9873 319261.1140 571267.4963 984847.7251 377912.6376 474138.2057 1278789.3470 879503.2205 1023132.3510 654088.2237 563236.6936 630902.3385 842442.4826 471100.4110 1565123.2940 705407.2958 727352.0078 767600.7894 988950.3466 646475.8635 1049368.6090 1027979.0790 1001548.1250 968951.4403 894298.6354 884938.3987 857920.5104 842556.2899 747344.0934 729636.3419 721281.2060 739544.1288 1000199.0700 347275.8860 937705.9485 878197.0842 11099.8920 9386.9047 5677.6246 9576.5750 6796.7130 7881.4705 10417.0074 9879.3195 7938.8466 13392.2344 10453.1917 12663.5717 14689.1475 11945.0084 12127.6891 15633.8151 10462.3549 10161.2225 1030531.2230 1020339.5760 1031457.5570 908370.6419 874526.8578 876233.4578 986548.1798 990466.5968 993844.5779 861456.3708 866330.4018 916030.1304 784465.3926 859604.7829 789718.1805 763991.0679 779394.3603 755042.6120 812462.8572 809817.1171 794757.6650 757703.3668 625935.4412 726077.8064 657314.3895 326206.7693 836703.1279 927141.0116 915243.9465 962281.1736 405650.9789 910768.2361 873706.8900 L-Tyrosine_R1 Tyrosine 2060506.1240 4966073.9650 2125659.4270 2488948.7690 1584070.9860 1885172.3930 1183882.6620 1250820.9930 1378359.3180 1083803.7130 2796851.3210 2439330.2700 2520591.9770 3438330.8850 1731651.2630 2239872.1560 1774937.0460 2384407.5650 2270975.8850 1335049.3140 985422.6635 2411590.1090 5464183.1590 1492228.8240 2076112.0480 1859081.5580 1877267.9910 2410474.9880 1284175.7730 2495375.9820 1769998.1870 1927750.1500 907096.9702 1684155.3150 1765836.9380 1797726.0210 2057084.1990 2731661.0930 1639772.5040 1551070.8730 1410436.6570 2399751.1590 3896725.7490 1008541.7580 2507870.0020 1534921.4110 1192008.0210 3760182.8330 1647953.4220 1036184.1560 1910593.8390 2533462.9950 1247420.9850 952037.2069 2298291.5880 2075699.9380 1346554.0340 2079875.6320 1505407.1950 1365171.5670 1789077.9520 2704049.4460 1170704.1720 1005500.4840 1773814.1870 1566203.8710 2522991.4640 1672180.3770 1475517.9200 910284.0540 826658.5866 1343185.6740 1867962.0920 1253315.6240 2337118.5660 1633370.9570 2760309.0850 1618897.8980 2299973.8150 2458154.9650 2111872.1950 1390446.5810 2745547.6350 2800351.0220 1767031.4310 1874427.7090 1595961.8560 1756448.2560 553371.4215 2822351.0890 1865310.3040 2096633.9430 1553546.7590 1528332.2930 2664149.6410 1722519.0780 3815986.9010 1740499.9870 1850885.1660 1832118.5960 2225534.7050 1964895.7560 1384155.2850 2887180.4250 1288150.6450 2688003.7560 2170739.5320 2866914.4610 1151841.8360 3891781.8430 5615076.4590 2010195.2510 1179947.7030 1024113.8910 2121812.7440 2607074.7030 2225149.8650 1352740.3340 3543367.9550 1472415.3300 1248493.4810 1872169.0730 3070951.4890 2107809.1780 2240868.6550 1384394.7280 3239490.5730 1228772.0750 960751.0447 2789915.4220 2940864.6910 1399532.6630 1534905.2850 1809891.4550 2073387.2050 1362671.7450 2336881.1370 1589288.7440 3041282.7680 2698558.6220 1361456.8660 1617167.1380 1376939.9540 1294579.6590 2286759.0920 2563570.8620 596925.6427 1302229.5260 2044544.4090 1202444.8260 969056.6587 2194893.6140 3310778.0210 1555567.2520 931025.0858 887094.4249 1548682.2180 5062060.0660 1043928.7100 2481717.4840 1109291.0290 1777364.5110 1969243.7290 2356101.3300 1794400.0630 1301662.7470 1280194.3240 1379513.2530 1303232.6430 1115303.7470 1115561.2570 1263731.0370 1226720.6090 1184623.9250 1143674.6850 1054556.7940 1097332.5890 1294125.4230 1235614.9140 1220426.6280 1172003.8600 1968497.9670 1892310.0290 1979470.6210 1874661.1370 1860314.9450 1883084.1820 1823637.9880 1878188.0790 1856238.6840 2075487.1360 2027619.1440 2062798.9360 2096944.6500 2009526.3080 2014402.5020 1797988.4100 1779991.5540 1816180.1510 2128022.2170 2123632.4010 1995391.7530 1929398.8760 1855995.1270 1848002.4760 1843416.2240 1891528.6430 1892169.3120 2169011.0800 2024063.1200 2038885.4410 2047231.1620 1938392.5800 1977701.6800 L-Tyrosine_R2 Tyrosine 2002019.2570 4843284.9560 2081918.5250 2414337.3810 1557643.9160 1836039.9520 1152793.2800 1223776.2050 1338997.2180 1050273.7580 2716006.1380 2379306.3810 2451475.9980 3346039.7720 1697353.9350 2209780.5520 1739664.1650 2337628.7550 2232299.2810 1305173.4020 961657.6868 2371624.1490 5371340.8610 1471680.5700 2041490.1160 1803941.5160 1839350.6330 2336778.6290 1267146.6550 2424544.0510 1736936.2720 1902253.3120 886348.0610 1640556.8130 1717912.5960 1757090.1370 1995803.5110 2666394.0090 1614070.2010 1529632.1040 1375389.7370 2340588.2070 3799014.4720 983230.8324 2436674.2500 1501870.2630 1156522.4900 3676338.3400 1610905.5300 1012043.9240 1859424.3950 2460784.4850 1223156.1630 953629.3209 2232585.6320 2009657.7330 1320254.4210 2020512.8910 1469440.4280 1324591.6390 1759081.6950 2637621.3880 1136540.4440 978847.2058 1742281.0250 1517872.5030 2482600.2820 1644532.6410 1454126.4270 892879.5035 802377.0916 1313040.8730 1817580.5120 1220086.5650 2304264.9130 1593293.1800 2675996.4120 1584191.0940 2231021.4390 2394687.1950 2071399.0180 1362055.1400 2680724.2730 2736624.3000 1717001.5410 1824299.9960 1548268.3590 1721761.3940 541204.8604 2759474.6480 1817950.2930 2040895.6320 1517576.2180 1485915.4080 2592692.7670 1680540.0430 3706299.9260 1693391.2330 1795755.9200 1766590.6160 2167187.7430 1935821.8550 1344293.7670 2814032.1970 1256833.5640 2618780.1530 2143456.0310 2788133.0130 1127644.3540 3797732.1150 5490699.0640 1971999.1130 1153753.0470 1005571.8390 2077215.8620 2525029.0210 2185976.5190 1322485.3920 3459978.8060 1434948.0130 1216134.6590 1837052.3620 2982622.7290 2047854.4220 2196016.5480 1350587.2120 1530925.9330 1194491.1760 933571.0556 2716761.0200 2859307.1040 1359242.6820 1505089.0440 1774793.4530 2027886.1330 1323759.7730 2294348.0280 1563742.0730 2957213.2750 2634692.0210 1332397.5920 1590018.5340 1344649.7450 1266761.1510 2244143.8510 2513361.0950 580718.6577 1273771.4410 1993853.5990 1167175.0780 945190.6522 2166496.8260 3243793.1440 1506953.7020 919028.8500 866711.5469 1507708.3770 4937688.6950 1024680.6190 2430196.0500 1088647.6210 793466.9144 1934114.3860 2286019.7810 1753249.6740 1285420.3490 1264496.2900 1675815.9150 1267046.6260 1104673.0670 1088124.8720 1246512.2940 1203158.7390 1154964.2580 1123785.2730 1041817.2630 1081073.8070 1249554.0090 1215241.7420 1479731.8580 1153799.6350 1942939.7770 1886893.8120 1953988.3840 2570924.6650 1848295.7690 1827120.6650 2463424.3110 1824805.1660 1836463.0520 2046251.9630 1998848.6610 2028583.1470 2067507.9050 1973750.1160 1967488.8620 1771561.4990 1752836.1370 1786555.5690 2094619.2920 2066356.2730 1941737.0220 1878140.6290 1808545.1230 1802553.3850 1792795.1770 1839128.4840 1856762.0170 2106812.7940 1965961.5500 1988814.3080 1981932.2600 1883483.6370 1923932.2840 Lumichrome_R1 Lumichrome 6284.7637 10746.7712 126351.2499 116436.8731 33350.8433 39072.1551 17691.1392 6388.7203 37945.4873 9657.5337 5361.1246 30099.9264 10638.5803 98593.1087 14770.2566 42492.6839 110524.0382 16714.3949 17785.7222 27903.0918 77342.0348 66986.2364 30759.1446 59056.8011 32480.6382 16092.1047 274968.6363 8684.5919 77671.8789 8388.5461 91903.6329 113975.0861 15793.0509 11958.7890 39720.7683 8887.8584 59919.7496 79398.9153 8090.5566 37761.3533 20900.9976 69828.8928 12732.3282 164273.7308 10193.2448 23033.9464 3848.6939 90047.5646 3897.1395 11636.8397 4488.3490 3202.6990 4615.8052 21558.9642 5336.4374 11175.1429 11670.1138 4125.9951 4681.9231 3591.7917 14019.1471 18689.4075 168886.9704 37203.6123 7143.1958 15909.7295 6244.1456 8171.1462 55995.3999 20914.7446 26604.6025 4071.4029 42890.0651 4597.0791 4945.6347 39183.3850 76594.7137 8606.3428 5092.8126 6375.9940 19326.2530 7726.8698 12871.0909 8586.7756 11319.3079 6163.0691 7080.1662 48377.8918 22572.6316 79809.9525 3661.2615 21885.7258 6876.9508 31727.3957 29725.5393 4223.7046 13135.7501 22672.2361 3260.6208 63137.6247 5710.7696 46339.3826 11770.4843 56899.3891 67572.4514 3809.5980 13550.3417 12062.9355 13040.6050 6638.8004 53639.3125 5470.5954 32448.6479 11123.2423 10515.5377 117982.2795 18529.1109 5188.5819 64842.1297 40706.9670 10666.4688 5699.0802 4182.7000 8996.0272 13446.3053 9328.0573 14819.4902 61872.5794 11314.4602 7693.3091 16193.5088 11266.2169 45836.0272 17714.0204 82602.2410 42990.4532 17244.1080 14191.3423 56537.2934 4388.0042 5512.3099 50069.0849 11918.0414 6644.4858 4624.6388 29502.1330 8587.0927 29536.6870 9451.6698 51809.8425 19651.0186 1993.8245 18422.2496 12844.6206 10008.4522 33780.7781 16281.5608 17571.2190 20754.5977 24149.0484 24710.8434 26465.5222 13319.5014 12886.0991 15451.4679 19414.3654 19032.5851 21626.2363 16371.8917 12263.2616 17292.1237 22040.9967 123542.3658 112845.9638 126345.3297 109807.0780 113405.7750 109487.8931 98043.4922 105792.6595 105908.1251 20607.5680 13541.2303 17563.6412 12338.9374 16276.7839 11414.7675 75581.4634 78530.4198 73153.6924 10301.0455 11181.9631 14282.0894 10590.9755 12964.3712 16081.0361 80909.6962 82496.9286 81403.3773 17782.1519 15100.2793 14937.1457 14461.6614 11216.9939 14419.4562 Lumichrome_R2 Lumichrome 4463.7115 7095.7936 133122.4519 118935.2706 31756.6710 37140.3407 24782.3635 11646.0449 35993.6073 9927.8778 10017.8026 30810.6694 89867.6325 14810.2473 39011.2298 100985.2266 16572.6185 21827.9241 21307.1372 76174.0360 61007.2200 20583.9474 54510.7794 35613.1564 20831.8107 8226.3436 258372.5331 18093.0249 71892.6151 87860.3940 121553.4195 16138.7452 11331.3477 36928.3479 37661.8207 10730.9360 60414.1567 80342.2462 38816.5083 21389.2822 65505.9150 11582.0336 152157.3204 10215.3088 26928.0986 83369.4834 15032.5391 8156.2299 26193.4928 15353.8205 12568.5748 23393.7859 168952.5127 35126.5999 18624.8544 9199.8375 54746.8399 27587.2226 28341.1259 17665.3887 45904.8097 9310.7518 7223.1950 40946.1007 76689.9953 7063.5113 10728.1323 25282.5667 10774.6828 14079.9808 10249.6105 14842.5209 23440.8817 48971.0532 21309.4425 79223.7534 7224.4083 5990.8790 24100.6916 9900.1824 32158.6898 30467.4282 8130.6155 11548.6495 56138.8793 6148.8582 45973.3458 15197.8058 51966.1288 68764.5952 12359.7469 10925.3762 10248.9893 13146.8746 55209.3458 31356.6336 12275.6704 7320.4702 97894.9888 19892.1113 52226.7393 42353.1840 15407.1480 8101.2192 19477.1070 6631.0755 16010.2320 60055.0965 11571.4830 10047.9968 14435.3284 14373.8832 47692.1917 18947.6083 73325.1607 39657.6698 17326.0134 15576.2985 52045.9190 11486.9190 49236.6061 8109.9959 9862.3598 26176.5770 12976.5382 25238.2263 44853.9581 20465.0651 18240.7635 13835.2478 32963.4356 16215.8525 17699.4794 16551.6098 17233.5062 17232.3343 20525.0234 19200.4070 11340.0102 18001.8701 17250.5809 19731.7339 16902.6567 19621.3535 11129.0884 18210.8880 20523.0749 23534.3968 17235.7969 17714.6147 14994.2804 16646.9658 18246.5986 75290.1321 75220.4240 71827.2195 12162.0062 17939.9879 22192.6935 10197.7699 11803.8506 11076.2687 79748.7779 80369.8712 85283.1243 16806.5969 13679.0289 20111.7931 15396.1571 10074.5075 12652.0583 Malate Malic acid 7940.3379 7175.7564 3225.0890 5527.8760 4943.4338 7262.4249 4154.1598 10874.8897 8460.1322 8028.9437 7554.2719 10258.5910 3591.5378 5449.7526 4406.8869 4196.9199 4973.8724 1490.9867 10218.2443 2360.8863 8887.8071 4916.0939 3901.4439 7838.9267 10083.6772 10054.5699 13284.3029 20907.8132 7545.3856 7181.0355 7393.9134 8063.1620 10457.3412 36455.5395 4915.1882 3003.6881 5000.6044 15764.5052 3211.2698 4030.5737 4390.0957 3285.5419 4718.4376 13389.7915 10489.0552 11846.2482 12125.2982 7458.2725 9235.8136 10300.3226 5453.7531 9840.6605 7603.0344 6283.7722 9241.6372 9702.4616 10159.4285 6849.7354 6517.3572 9012.7177 8908.2317 7425.8440 7387.7120 6737.9078 6455.3300 7446.2649 6164.5120 6129.9512 651.7451 4528.2088 4029.1472 2564.5448 6609.4910 Methylpicolinate Methyl picolinate 12724.3961 14374.3214 5974.9499 11451.2300 5670.3882 10298.3745 6521.9662 12074.0084 6601.3568 7805.5183 8157.0854 4805.7711 10964.4735 4398.0113 10604.5694 7041.2946 7583.6977 74317.9788 12689.3381 7437.5711 6395.2959 5518.2345 8447.7489 8823.9659 7251.9104 280498.3782 13442.7900 9090.2900 168333.1101 65873.4207 7840.4296 8760.3778 5148.9044 5177.2700 8194.1078 2829.3351 6851.9426 3607.4844 15157.3161 9244.7212 5714.6105 7499.3672 11277.1843 6861.8130 5181.7520 4953.5958 13614.8826 10367.4978 12590.7494 5745.8966 10889.3944 11070.1456 9653.1866 9164.3712 6605.2386 5689.1125 15186.7997 159592.7819 8727.5459 11775.2112 6247.7811 10031.3685 6330.8691 2811.4262 6704.7753 5599.3284 5505.0055 6253.2331 12695.9271 7773.9993 6169.3565 8532.1085 8694.3397 12851.0136 7685.1042 5462.2736 9530.4442 4958.9510 8647.9122 10153.1588 6174.7404 7644.4503 4698.5463 8463.7127 9899.1900 294042.5465 8178.9292 10775.6056 5606.9366 11740.3427 8449.8791 4670.7301 11087.5620 3179.8054 46329.1747 6932.8745 10567.5879 5668.5531 10483.5162 8217.4849 3821.4901 12042.3490 2168.9820 3768.7113 13716.3049 7182.1504 6802.4985 16665.1126 54510.0287 14362.7882 7023.8435 22443.9190 5801.1737 8907.2485 12597.5005 8613.9524 7373.0988 6636.6384 12853.1623 5412.4989 5841.8679 5278.1383 5056.7620 7426.3667 6028.1720 7148.5315 11310.1769 10225.1895 4550.8171 44196.6598 6206.4794 7049.3218 5839.5925 19008.6921 3959.8929 13687.4071 15173.6397 8724.9512 6647.3488 7285.5876 10179.0276 8688.1127 6629.7621 4888.2362 10034.2786 11533.2055 5948.5160 8726.3511 4404.9228 5041.4190 12927.2622 6747.6668 5581.1826 5426.3485 5562.8926 3984.3872 6522.0454 5619.2326 6301.3627 10668.7220 4791.8513 12821.3634 6435.6207 6622.6114 17809.7237 9536.3602 13863.9564 10838.8251 11239.3288 7034.9824 9206.2827 11562.5501 8102.5989 11105.3123 8019.0603 8570.3460 6506.8178 11174.5990 9467.9593 9887.9948 9166.1673 12600.1582 11118.9729 9773.2249 9409.9953 11447.6188 10454.7812 7866.2067 7547.5865 8454.8776 11814.8159 10144.9635 13895.5321 10026.9365 10160.4301 13688.7641 9578.4729 10114.8569 10638.7228 13177.3094 13312.3307 15953.0829 15245.4706 12038.4732 13901.1382 12963.8784 15224.0879 16026.6769 12725.5093 11779.1772 15285.2332 13692.1310 9947.6945 11333.1448 Methylthioadenosine_R1 Methylthioadenosine 604133.8420 479908.4752 382303.2030 270458.6956 220298.6342 233340.7071 252608.1632 277217.3466 203320.5508 635726.5945 192709.3959 15782.2394 187715.3317 196343.1491 325796.1587 499846.0545 281980.3818 252664.0531 366997.6690 353804.3523 504157.0258 659100.3903 229493.4239 1260833.5310 209385.4043 417057.8196 253415.7801 424237.1806 368774.9971 277687.8018 149515.1992 280358.3960 461741.0201 386113.6943 860521.6978 286094.2041 953822.2856 207454.3075 831036.2402 469090.2859 717965.1622 259315.8452 1047747.1440 1054160.5470 366316.5657 521068.3515 418501.4798 684545.1181 338251.5652 243735.4572 1218350.1300 440331.8216 338037.9206 884881.6950 1643083.2770 231380.1466 268952.8613 730798.4123 390015.9267 203896.9712 1720320.2660 193017.6791 136440.4745 304610.7847 153674.9755 160861.8621 588624.8855 398218.2939 1203766.6970 226625.8226 261726.1834 595609.3685 337797.5206 199953.6864 197015.3016 315937.4939 312486.8549 923057.2148 410236.4570 434015.6301 209846.4715 284442.5204 349128.0156 822938.2935 1387414.6200 396358.3769 836430.1113 848472.4338 1361074.6770 395173.9332 1238397.1070 1661199.5080 264468.5392 229108.9278 529890.4866 1046269.2880 1508657.3320 306994.6018 9456.0081 926415.3145 390916.4930 1511429.1120 246652.0055 153729.6933 179931.1824 1395390.5200 409738.0865 317936.7486 1103847.2250 1494231.2320 227059.6243 305818.8061 146845.3674 766844.4990 362559.0281 20568.1510 232898.3718 312207.0014 386793.7510 336517.8302 316128.6282 373138.2227 229565.8911 211348.0639 321259.6437 227159.3126 374036.3590 245070.0202 221912.6135 206442.8023 143646.1107 213836.4815 134568.4181 18321.8354 228155.2412 1000903.4930 468784.6875 853769.4795 1103252.0920 265571.3362 216533.6839 1163809.2340 663736.3852 254047.5730 1033085.9020 391903.2650 1137200.1350 571842.4683 145762.2767 246045.8746 888664.2123 1544074.3290 227217.3612 150745.7394 433109.5335 180731.6289 225368.1828 258022.5119 317784.7393 592170.0426 181811.8329 1004946.0880 222821.2982 483225.2450 1223348.6650 36847.0970 43742.1064 67595.5552 84373.0394 84006.1345 88491.6025 22057.8345 11720.0759 28402.4760 37739.7102 61186.3730 56169.0287 11498.0474 10888.5100 28636.6577 31226.0972 279681.1169 270481.3483 286100.5976 166264.6990 173298.7409 171966.8300 136017.7538 138718.7349 128573.4551 398046.1100 403405.4267 430823.0407 422008.1316 479260.0350 478520.4108 431300.0874 394655.8569 361674.9299 332835.0465 323543.3630 327569.9441 328599.8400 325575.5818 362598.7494 347735.3355 384929.6583 408422.4751 280416.4580 251738.6732 292644.3680 275424.2525 344900.8738 329335.8830 Methylthioadenosine_R2 Methylthioadenosine 585774.5329 156572.6793 373599.8473 258760.7334 214517.5375 221901.9749 246342.9177 261208.2503 186436.4544 581014.5756 175564.8711 110899.2807 174517.1725 261195.7839 472369.1385 274225.9054 244032.8399 300640.3892 333645.9868 483993.7482 648354.1837 213770.0861 1230407.0310 201797.8075 391869.7705 246224.7434 413530.4652 351220.2827 184372.3944 112633.8289 254313.7698 446835.3928 371374.8311 840826.3434 281734.7354 927825.2576 202158.3370 812097.2129 400204.1105 676492.4330 262789.6297 1021285.4800 1007148.0690 329756.4617 510399.2972 414508.9775 660979.0819 328912.9755 238127.5628 1187551.7740 426704.6625 328193.1586 856707.3190 1606393.6780 81291.8445 251696.2063 703411.0235 376153.7574 196932.2620 1680743.8170 146756.1432 131414.5024 293719.2315 146169.5749 156089.3857 565954.0462 381001.8052 1197650.7320 217078.5785 251503.0123 445043.8875 328802.2099 189666.8799 189088.9920 267385.5345 301737.4734 899423.3832 395328.4216 424026.2011 200384.2307 274512.0743 333079.4474 802039.2597 1347271.0060 379477.5728 824353.7746 830303.6989 1330330.2110 358526.5890 1207670.7790 1631481.9660 251739.3480 219401.0946 502241.8359 1031633.5390 1467957.7260 291901.4323 134151.3696 904210.0078 386151.9699 1474283.4510 75182.5132 153810.1933 173112.4628 1362717.6710 396603.3936 286038.3367 1075561.4340 1459582.3330 199177.8405 293533.7975 116578.2739 743494.5483 235885.3327 166368.8671 226242.2244 277041.1625 383524.5274 319974.3955 302640.4148 364583.9665 163175.9205 191717.6764 263899.4660 216909.8431 356766.3482 238679.2218 199935.1288 168244.1863 184143.0076 207440.7049 115767.1914 86059.2209 199929.8387 980634.3627 457834.6264 825775.8707 1078094.8330 259231.1862 207727.5670 1140913.9120 649581.5684 121618.9582 1002499.5780 341844.4305 1109638.5590 528531.2251 112698.3701 224510.7934 867544.4445 1511442.2660 94071.2475 98008.1329 428971.5713 174135.7015 219732.6025 240882.1266 292718.8977 536513.6009 47294.7225 976903.8275 211196.2179 462220.8699 1198775.0700 54498.8782 63161.7121 66787.3910 38608.5893 263934.2265 249076.2869 267136.0945 155531.1561 148422.5921 158797.1781 123113.5092 128954.5377 114517.9723 331700.8126 388525.8260 413509.0266 336306.1264 465458.9512 459182.8434 418337.1734 372926.9054 345250.8641 316652.0630 320338.8346 325409.5901 321439.8937 312363.0150 356291.9324 338696.6406 367669.7939 399403.7272 269158.2246 242947.6449 282434.7136 276264.1611 337174.6461 318469.0299 Mevalolactone Mevalolactone 3363.1671 5129.3064 5550.1051 4853.6866 3677.1386 4919.5008 13179.7322 9742.1604 7904.7466 9479.4624 8931.9766 8401.9601 10467.2764 14133.2156 12856.1695 12985.1589 3798.3064 2422.6672 2100.5484 26455.4614 27790.1778 25386.7704 13284.0054 14044.4386 11201.3141 2295.1021 3471.1012 2698.5698 8820.7760 5468.1467 6133.7099 7137.6227 4439.9585 4355.1091 2556.0879 3810.7108 9631.0405 3375.9576 6278.3291 3692.1788 12863.7830 14870.6653 15302.5408 3596.3032 3280.8597 10944.8618 7291.3869 7121.6071 7046.0648 N-Acetylasparagine_R1 N-Acetylasparagine 122903.8752 121763.7980 45441.2095 209728.9102 409018.3501 238525.9019 38648.4247 169760.2545 180740.4008 67181.7652 466225.8450 166769.7368 77944.3235 221815.7270 55379.2655 173113.0012 176513.7367 90924.0597 157047.0845 306682.1555 250205.6044 140693.7597 604852.5299 146746.8306 203685.5609 237689.9729 180179.8986 182017.1078 354644.8243 59970.6481 280072.9415 66516.0166 93357.1524 58828.7098 343573.4527 237167.0078 77276.9038 98201.7358 485849.0253 71270.1522 125560.3479 118392.2012 387703.9801 138347.5415 193922.9701 55972.6013 184115.9090 143308.4860 69642.3014 85745.6197 226285.0870 191617.6186 71575.7938 87490.2642 285083.7717 295149.9669 60369.4551 161812.7272 217915.2768 73841.1087 117150.2283 202524.8979 174449.9057 62226.6831 63763.1656 320118.0227 153792.2342 109950.2305 196381.5719 137748.2200 78545.8761 86058.2621 139878.6383 375464.8487 329373.5250 118683.2149 241626.5257 150115.1178 109151.8342 306845.1210 65515.0986 129902.3286 257335.3390 131675.6950 275862.5074 233506.6299 61987.8618 173897.8359 44543.6312 109474.8861 374015.6693 270408.8564 56174.9591 172394.7419 212416.6930 79190.2472 248094.2284 110278.4837 127742.9724 93015.6991 286719.8960 428558.6608 109614.7252 139736.5317 340469.6506 271472.2356 164801.6894 198442.8524 116929.7023 162758.3183 106175.2098 105257.1960 88880.9738 80299.0906 166313.6100 459545.7695 223861.3588 106870.7578 265659.9526 99256.0142 163897.8859 216009.3589 145195.4607 208881.6299 213872.6210 106966.1761 246581.6675 54589.8235 77627.2225 199230.2586 133658.4448 72313.0447 233701.8879 150181.7171 265117.6150 167817.8897 62100.5220 67984.6602 153166.5751 253627.3682 48007.7868 73505.3869 173495.1711 200235.3300 229906.5481 390254.0233 40671.3543 159140.3219 333027.3587 81822.6240 110952.1904 229721.1162 158496.8210 330714.4835 247950.6835 78668.0279 95491.7042 259962.1148 51224.5442 147249.1392 64902.9988 132896.4288 294522.4364 259094.9198 209270.7759 152696.5166 157928.8550 158339.9391 162672.1850 142542.1995 147283.8042 129787.6724 123328.2763 115775.7924 122626.3744 119939.6429 125692.8765 147210.1578 141987.1999 147975.2731 143239.9064 125407.1941 119302.0130 124428.4194 101251.9177 101906.9263 97176.1895 112913.4767 115941.6715 107442.9868 198887.3419 189877.4069 209563.5229 184233.5085 202615.6199 198098.6501 188797.2732 182055.7761 186221.9285 178891.8273 164079.2593 165180.5707 158278.0550 144460.4541 161530.2276 157574.2860 171257.5979 177362.9679 200483.6114 177362.0950 200315.8645 181209.8154 184891.5737 203973.3607 N-Acetylasparagine_R2 N-Acetylasparagine 113059.8736 109533.0384 42085.6344 203550.8383 366759.9827 226436.8900 35988.3180 162613.5162 153309.7988 59555.4370 427138.8975 145527.6965 70543.8656 206676.9280 46988.6038 159326.2549 161058.5303 89121.4654 138874.2238 280724.8469 233134.5942 131679.0877 596610.8747 133260.2595 184850.9127 219073.4051 174294.7009 173116.4503 324005.2205 61930.4171 269626.2478 53997.9207 80899.4835 49957.7532 314747.7347 217062.9470 74515.3943 90078.9190 448533.8810 67436.3801 105842.8315 112524.7279 359087.6043 130101.0534 176201.9641 56523.3561 176831.5599 124996.0582 65120.5431 77137.7672 205621.4764 177982.5226 62490.1735 68070.0688 264829.3881 280386.0373 58423.9221 149023.1983 196704.4512 74988.8367 112057.0065 188671.4964 163504.0734 58304.1042 55402.0769 299779.1019 140865.1813 104553.4685 186417.1072 123874.2164 65562.6291 77801.5432 131683.3474 350374.5919 300891.0736 113333.4450 215469.2455 136015.8456 101526.6178 273914.5104 60317.0750 120328.6959 241592.6941 119449.5108 257522.8172 224137.5575 62433.2008 169063.5477 40661.8148 97062.4859 345264.8024 242787.1972 50960.4554 160582.6872 200016.7516 69871.8669 236705.2875 40901.3507 116633.4265 86355.8504 275334.7994 392332.7353 99418.9071 133055.3984 323011.0239 255998.7131 146906.9879 193139.2798 107017.3325 153584.9279 99751.8210 92915.0067 80069.0743 75285.0985 151645.2001 418628.9308 206163.1614 106148.3062 241263.3247 96867.1678 146323.8921 190567.4430 136833.9596 191824.9347 199689.3198 101203.9433 225798.8929 53700.2237 70663.0474 195348.4156 120926.1957 66439.4583 210564.6747 137177.7008 244188.2969 156410.8710 54139.4499 63890.2329 134173.4628 229991.6911 43752.6326 66521.1805 158010.4255 186592.9576 217117.5583 353207.5951 40636.8380 157624.9948 309404.7845 79499.3283 102033.4843 213600.0972 143948.7520 303596.7010 234370.9054 69094.8521 84360.4485 247100.3042 49843.2317 134598.9224 57947.0622 121274.4982 269738.7963 240181.3994 191170.5777 150875.6417 145762.7087 156151.7129 152340.6549 133941.7900 136495.5639 123789.4241 117057.5987 114161.1318 117981.7711 110979.0671 120702.8921 137764.3112 140038.2648 140336.3803 139507.7097 102974.5199 105520.5766 111332.3343 86329.2396 92930.4049 91321.3035 102295.7413 101404.3970 98436.9315 171283.7901 167788.2402 181146.0190 173043.2914 177524.9827 173807.2709 162572.6643 159346.7639 164869.6829 156471.6617 155426.8339 152017.5315 141809.8455 129128.2651 142935.9123 138338.8892 149495.9604 153489.7272 172888.4822 168844.3015 174262.5506 166148.6630 162485.5313 182501.9177 N-Acetylaspartate_R1 N-Acetylaspartic acid 144078.5640 327433.0410 161121.8948 215627.0385 175315.4515 208160.9991 240044.2307 248516.2056 161403.5362 153241.7137 196202.8341 246736.1872 178076.8037 324447.3228 330890.8433 217123.2032 234643.6896 172127.5312 174375.8902 303758.9144 168932.3242 160712.9353 328722.8070 68145.4596 317906.7468 243209.3144 298810.6230 294976.1813 373081.8836 334184.8186 275226.4156 133439.6995 96044.0227 160206.2841 77746.5478 262088.5915 68272.1317 323817.8950 52718.2716 246648.7293 263468.0017 232432.2011 90040.9672 236807.6840 124278.3592 203568.2882 152999.3954 53364.7458 206528.5573 198856.2921 78767.3070 313666.7614 238442.3179 116271.2007 115783.3589 293607.1143 335997.2508 127162.2198 134568.6800 166943.6211 97355.2447 195079.0733 250715.8132 157982.5305 186536.9053 225162.0945 154155.2794 128784.0024 78623.8806 341545.5263 235888.8267 315809.7336 198718.2383 239262.9723 376847.3811 231404.8022 144902.0579 108943.0577 202589.9569 106339.8861 226178.3501 130428.1239 121693.6888 111123.6027 80820.5853 263577.8465 323144.2113 91610.4192 77962.7395 226393.8100 113155.2669 107230.4717 246493.8018 168739.4255 201743.0888 51508.8119 125836.3602 163277.8035 219830.8858 103156.7355 129061.6374 133742.9521 141281.6328 370051.5448 226680.1689 288074.7644 159666.7050 251202.9880 121549.3391 103260.9568 142865.1875 150103.5173 136525.8191 77695.8543 477669.6695 193148.5284 374582.5188 167623.1287 123494.0517 330823.8774 178715.9649 297917.9162 173423.8295 328204.2361 361200.1057 337106.5241 118896.4590 177803.1843 190346.7041 256242.0278 267472.1513 164383.9874 231165.4332 204078.4018 219661.5129 85035.3466 89850.8485 328206.4832 88131.9318 136930.7914 235142.4685 56575.1648 123301.4175 259802.8159 227829.0379 129630.9179 66495.6086 404451.0191 340329.3379 215451.8710 136262.6654 74422.9335 190328.7787 221499.2928 159342.8097 329016.1483 130054.8645 398527.1726 336364.5592 233578.7526 164885.3639 105905.8274 214314.1318 146369.5154 123771.3166 168164.3141 173009.1581 159100.4507 170133.2560 141729.8676 145672.2544 161012.4112 155872.6620 142626.6044 135908.5635 138960.5608 146820.4285 179968.8657 177033.9637 162283.2138 158882.1290 169845.6936 175134.2436 172291.2259 166704.6464 170579.1692 167596.8592 188075.7562 182891.7041 189537.0073 129827.8024 128605.8815 151343.1817 125945.8394 149138.2266 135706.5295 133418.8621 130466.7159 130438.3493 138799.3511 136469.1296 152826.6018 145500.8134 123649.7270 155132.1783 145238.1349 186096.5477 192210.0945 193932.7960 199996.2146 200496.5675 191009.0274 196284.2890 198382.7845 N-Acetylaspartate_R2 N-Acetylaspartic acid 95552.9537 226435.1373 106938.4304 142180.4574 121761.0610 141641.4806 160913.0563 171851.2920 113262.4924 98072.6462 127018.0301 177975.1621 122725.5639 221870.2166 233177.0172 157935.1836 165539.1092 114099.6886 124304.7728 198849.5454 117651.1513 114549.1321 230507.5598 51153.8610 223575.4218 149964.2556 190838.6248 198348.3852 262678.3271 219290.2003 195258.1113 97765.3461 64278.5036 112852.9607 50867.5082 187050.8835 50852.4670 228131.2979 37719.9101 168420.0241 182285.1127 147404.6276 58164.3606 171150.6374 89941.4563 137601.6877 99025.8187 36015.2861 147135.5784 139928.6776 47597.9764 203273.9454 156698.6086 84259.4337 87442.1638 200931.9411 221012.7029 81639.3963 97075.8756 107095.9587 69338.6753 129936.9273 156006.6399 113607.1730 132866.5727 154008.6586 108945.9277 92352.6866 51704.7552 220102.3159 163245.5777 222491.8466 129912.0928 164305.7280 266083.7083 164779.4022 92683.9042 72610.2366 135776.7489 80461.9894 149563.3211 85112.7696 83170.1292 81092.7828 53235.0471 167386.9650 206209.0986 59881.8332 53633.3841 147347.2576 72032.2333 76108.5230 159957.4680 108787.4558 127159.6089 37623.2977 84447.6836 114573.6142 150672.2687 72408.4878 87688.6814 96625.9186 99091.6244 249407.9386 153941.2557 206933.7756 110870.1404 167656.3034 79035.9360 65280.8840 91145.4376 105113.4716 95272.5706 48138.6375 334139.8014 123063.1351 264343.5084 117987.7317 85998.7322 220771.4415 123333.6443 211896.3656 121493.2361 210884.9489 254996.9996 226084.1789 80235.7712 111023.5410 130503.2732 164757.2581 170965.3989 110167.1234 161356.4478 128923.7355 154192.0287 62137.2970 62912.2425 209671.9441 56027.5724 96091.5859 157552.3394 40206.3489 83893.4317 181319.2394 162986.5553 93259.6913 45174.1987 276034.6598 244363.5903 147331.7485 90963.1273 52062.7629 130844.8761 154154.9392 114227.3287 230484.4824 89555.8515 272654.0038 238091.0345 168541.4381 120202.5476 66538.4268 148073.6317 92164.5935 90627.3709 117560.9937 117048.9466 114138.6330 114035.8988 92963.5264 101689.4470 103778.2243 100654.3190 89073.4493 85285.7771 92845.3249 95377.5404 124087.0992 127128.6268 109373.0912 103624.8632 121604.9453 124088.2986 121032.2010 111594.5497 107421.1169 112897.5111 132008.2235 127862.2106 135616.1618 92076.5604 89966.7583 106944.2511 90105.3087 100242.7188 95435.9683 93879.5216 93400.6022 90469.7627 91647.5608 91028.0401 97787.0706 94680.8491 79404.1066 102068.3855 95010.6705 125020.5107 128724.4974 137296.3747 140645.8766 141113.5207 131500.1426 132472.7729 136992.9443 N-Acetylcysteine N-Acetylcysteine 12687.6165 3410.7137 10448.3208 12761.9941 27825.3841 7412.3424 13115.8217 26933.3361 11717.9743 6950.2884 9628.1984 8761.7949 26172.8947 22686.5254 13369.2021 20301.7264 6202.2839 9869.0389 5749.0609 5826.0493 27163.8560 7811.9634 11846.5668 9082.7790 16374.2824 32492.9049 9665.6691 7415.4300 4367.6411 9642.6761 8893.4217 7119.6385 7958.1198 15880.9141 17629.2189 24617.1463 30726.6489 14457.4662 7731.8096 41091.5698 12118.5521 8498.4210 36439.1414 4688.2221 9025.0381 15809.6130 10052.8120 10851.0092 81705.6066 8646.0004 11894.2215 9494.1031 7509.0875 11526.2904 10189.0634 12176.1040 7018.0713 16503.1240 13138.5114 12814.7780 7051.7497 22298.0821 10174.3032 13163.1138 15185.3468 16952.9769 31747.7895 7127.1244 11505.7220 22119.8089 9405.8856 8202.9425 13220.6345 20046.3583 20369.4240 14370.0251 20028.1454 14182.4693 11937.1040 27927.0802 17540.3442 4363.7390 25442.4532 6979.5966 38514.3190 27399.7515 9331.6915 16399.5235 24800.2220 16298.7100 5285.8149 8125.4550 13682.5019 7444.9543 6947.4410 19404.9916 15261.1163 11200.6341 12769.2839 5662.3106 48113.1510 8548.0298 17549.4504 18895.4506 5509.7637 21143.8025 4929.9495 11521.9456 9807.0182 12759.6902 21777.2147 16284.6503 10625.4260 9047.5725 7515.0553 7873.4899 23431.1773 10784.9440 14034.2780 14921.6938 27191.1129 19759.8940 21420.2116 22268.9978 18094.2996 32633.4854 19484.0058 23739.5032 23346.1592 15370.8862 47031.3123 47804.6183 51687.1658 43197.7778 49236.6183 42457.6163 45110.1967 46589.4345 47543.6615 15113.2828 11809.6455 14027.1018 16122.0096 10296.0972 11929.0850 6110.0215 9886.9510 10819.1110 10948.1089 10236.5057 15655.6636 7313.9439 17754.0805 11528.0980 9205.9916 8840.6437 9891.9645 N-Acetylglutamate_R1 N-Acetylglutamic acid 118828.2994 310235.0684 162272.9834 196827.4177 135728.9127 179158.8127 178561.5569 210159.3370 146510.6323 91556.1111 254270.2995 199199.1617 149220.7892 350350.1761 145763.7495 179868.3654 146999.4420 109781.6402 168044.7163 240414.5959 163763.8629 150035.0835 383342.2459 50388.2194 434506.1732 206788.7542 300869.0829 258736.5334 368294.3434 185802.0333 256876.8171 97372.6456 60491.6011 93943.2091 71175.1525 199036.4164 75748.2522 210714.3657 95772.0912 183951.8439 174587.8779 141396.0728 109759.7507 127986.0149 126000.8642 160429.7558 127969.2967 66054.6536 133754.1988 115835.0027 75929.9946 266636.9204 136814.8379 88800.1560 146243.1663 204705.4020 189368.2476 109092.3884 117645.4970 161656.7862 66602.2168 140616.6407 155103.9453 86726.1324 126508.8901 217736.8069 128966.2888 103324.8992 42136.6546 369980.8252 154865.8094 233591.7842 226423.2119 223860.0380 288513.9348 155927.3755 234721.5434 68944.7690 191221.1551 123201.8628 225077.6273 152439.5360 93779.4831 125724.8780 143575.7526 222464.2149 200231.1820 58135.0034 42878.8508 233246.8156 150307.9081 120546.4324 213552.9032 125599.5797 143687.1882 44103.1017 220115.4481 161585.0199 190859.4833 75596.4984 139217.0006 98152.6095 100981.5166 268289.6099 222604.0153 209552.9752 86360.8221 265506.6631 87171.2881 97242.2552 168414.2722 157394.3119 91311.4205 80188.4100 310086.2468 258390.1470 512254.5687 122322.8965 146048.3825 164909.2909 149115.4344 145680.5041 400976.6048 225136.9118 272786.0976 207339.1482 138304.3055 130654.6081 125198.2305 211120.1895 129938.6124 121257.1255 133028.1500 203181.6615 154766.5010 88085.9922 57105.9461 192172.7792 92280.4783 118637.8027 177549.4929 42934.1630 125623.6132 139690.8184 164414.3806 145285.5643 41709.5621 243193.3172 310619.4301 221933.0034 129819.4151 63016.9256 441037.4537 223152.9264 157393.4098 228939.2037 102962.6014 337388.3181 183446.7048 176458.0603 112094.2460 90252.2401 124090.0060 314834.7237 89419.7430 165477.9407 166004.2260 173600.4095 164410.1340 153168.4699 153341.5564 169647.3627 161630.8236 160605.5696 163251.8039 152156.7538 159080.4938 183159.0085 189244.4013 175979.4802 185805.2927 190351.5068 188586.3492 188976.5123 205149.9642 207230.9587 197698.8780 201612.2886 208389.0406 203564.4835 102205.2173 102678.9788 123137.9341 101321.5542 125773.3214 118382.0677 105615.4599 108664.7495 109077.3400 121121.0133 119602.7383 130521.2608 125847.7660 102625.6954 135938.4442 124204.0272 156345.1256 151607.1183 152263.9333 156025.9888 170787.4089 159545.0292 161967.3560 178108.8071 N-Acetylglutamate_R2 N-Acetylglutamic acid 87847.1037 236030.7593 122571.7163 157617.4867 97611.7621 135601.3036 133778.0475 159899.5600 112824.4437 67739.9070 190277.6292 148484.2277 117876.1593 271827.1137 107730.8133 135275.5609 105732.4461 82758.5267 127216.4261 187006.6434 123294.5077 112271.6160 299096.0390 37988.1629 315576.6732 156377.8735 227074.6181 200768.0430 277403.1972 142711.0229 194544.0151 73810.5251 46183.4987 67841.1825 51143.6895 154983.5498 55209.7845 155349.7034 73956.5184 138265.0045 133078.7977 105612.5081 83702.8652 103306.9851 96645.1347 120753.2977 97804.8490 46768.4668 102411.3969 86763.0268 56757.0229 207987.1167 105728.0213 63113.6906 106300.4417 155450.8848 142535.2646 82440.9132 85744.0202 124401.9278 49756.8446 106144.2245 119347.3011 64061.7772 87327.4589 164294.4404 96647.8243 77655.2117 32015.9765 278222.0135 113139.8845 179773.8216 175557.6230 176293.9026 228225.5129 117341.7817 177380.4718 53683.3255 148297.4726 92875.6319 167245.4619 116875.8801 71724.0220 92866.4917 110494.3465 168254.0898 149526.7274 43890.3395 31476.3553 180913.9691 116183.8450 88227.6530 158063.3174 95712.9596 111110.2184 33268.1283 165898.7456 119082.6192 142784.6835 58099.9154 106739.3333 73775.1759 73885.3386 208018.8062 171146.1155 160363.4783 65462.6715 199029.8461 66696.1239 73974.0148 126026.4989 117181.0170 65816.2175 57678.5346 239951.6324 196456.9484 373905.3463 94328.1654 112089.3189 127437.5244 107944.1008 108962.4459 299781.2910 173275.2756 206184.1443 160484.4973 105383.5388 96380.3796 95041.7542 159453.7067 98615.2414 87857.5926 102668.6889 153140.6481 116873.6294 67560.7663 43556.6008 147773.7424 70748.9163 90249.7467 135876.2720 31072.5968 94091.5100 110857.4562 125360.3393 108838.2016 30663.3394 186119.5288 235634.4178 168197.1539 101581.1277 50400.4368 331703.7812 167396.9913 120072.1033 174982.6240 78355.2263 260331.7130 139207.7180 129623.3479 83518.0692 68576.9109 94169.3527 242695.6142 68725.9195 122986.1016 123674.4301 127296.3349 123718.1022 115439.5487 116082.7919 128068.2420 121153.3520 121889.8746 122633.8964 117241.4569 122896.8039 140846.1924 142457.1412 136163.7166 140934.5896 143134.1869 139805.9733 136940.4985 153117.2256 153916.5148 146716.8577 151995.5594 158289.2027 153579.5272 79824.1967 78696.6246 92922.6309 76725.8938 95625.3995 90265.7405 80932.6275 82054.8037 82207.5859 91344.7988 93307.7300 99662.8982 94433.4047 80144.4309 103322.7001 93269.4895 120848.7443 116092.6992 115080.2800 116877.3491 127941.9122 121793.8758 127256.6543 137422.7858 N-Acetylmethionine_R1 N-Acetylmethionine 157313.8695 115862.8488 44414.1431 177171.3946 63520.1007 112061.4643 63779.2253 46042.2762 157246.6894 35543.8615 59324.8785 23962.4228 169191.2435 6025.2437 10680.3327 31212.6513 116992.8472 143324.8984 73955.8524 50014.2087 44098.4040 51388.5288 77010.1947 32341.4194 83110.0791 125180.1566 133173.5895 348517.9465 83938.6815 77974.9470 70754.4239 32779.2555 42081.2327 35013.3839 28714.3249 11757.2800 44574.5471 28709.7377 113112.0600 45681.1770 202185.3769 23156.1209 45271.2048 53499.6291 45342.2962 44207.5345 23738.9916 70601.8820 87090.9013 30730.3253 27731.5923 337477.2964 61841.8663 43315.1696 35073.5925 22686.4594 34726.5741 60972.1465 15534.1058 89373.1822 35847.6815 20351.3427 58552.3255 58430.8345 35546.4204 52160.9529 29255.3000 14698.8048 66959.1293 155226.1424 52715.5911 41254.4327 201604.9697 66893.8334 17890.3768 72401.1171 51298.9168 71471.8553 374708.7861 29813.7815 59736.4458 15212.6090 88351.2346 25899.6002 17545.3403 123748.5435 60011.3894 89398.4860 13190.4483 98232.9420 53136.2267 35799.3426 135336.7849 59325.6520 35108.9647 104051.4557 25702.2024 143674.3502 51999.8140 31459.5496 19210.1669 105808.7834 47809.3736 72719.3201 69542.5594 86742.3067 50997.4678 140204.5062 16629.2626 149037.2203 20880.0764 50926.4209 16939.4742 54772.8706 82641.4206 61601.6275 92105.8706 37896.8728 161539.3181 20510.5016 25648.1838 33591.2192 31662.9195 49710.8800 27572.1744 123679.3181 139059.4272 42355.4457 50816.4884 73168.5238 16441.3744 76460.9944 174002.3304 13764.9111 26123.9049 152314.3160 40849.2709 55011.8592 18726.0500 49350.3480 140713.5852 115653.8614 224080.2391 81693.6439 80374.8821 84596.9949 18933.0689 80898.8582 10287.7591 50643.6537 232832.0455 43823.7913 35180.9239 38605.1749 40237.4850 32729.8625 38860.1936 45372.4828 82642.5145 16280.8068 33085.1975 15605.5236 33770.2316 14508.0683 111355.0023 55060.9644 53801.4331 54035.1220 65351.4063 52308.1360 43016.7687 48100.7862 50313.8215 46804.3340 40222.1257 46644.2663 44767.4524 57565.8125 47037.0165 46289.4634 40433.5307 17802.3723 19175.2745 17529.4608 12310.6560 16124.8415 12137.3093 13212.3702 14958.4044 17328.9359 68051.8681 53388.0212 59276.5739 52750.5242 59930.1839 56743.1831 48914.1945 68346.7551 44426.8698 64872.2842 62551.5479 54997.0285 61029.2818 57892.7090 55762.7018 55850.9414 53573.3494 56391.5656 61663.4806 49782.7054 59965.8118 57011.5310 49603.3494 53085.2070 N-Acetylmethionine_R2 N-Acetylmethionine 138157.3929 92272.9108 36393.1038 152420.3198 49106.8234 116263.0855 49986.2418 36639.1391 129369.4581 34683.5743 49645.0209 19206.1187 159254.9571 11321.4533 19711.1056 102020.5694 117839.4532 60477.2984 36052.3730 35304.9999 40323.8584 50143.7657 16654.0310 77828.9486 107086.9499 108086.6413 329455.5263 70882.3346 68253.9348 66600.9760 36465.1359 39531.3527 24115.0184 19791.1801 33029.2297 19569.3648 99556.0817 33538.0670 170512.7439 18892.0295 31339.5873 33998.1705 39854.7941 31327.8609 19207.0908 64624.1525 37191.7155 15412.4407 25831.5572 325062.4401 46250.4140 43620.1878 31928.9352 14192.1402 38439.5648 62569.3789 9630.4991 79889.9937 20635.9351 44157.7686 45769.9678 20516.3745 32682.0249 7384.1434 13374.7176 54068.5393 132509.3038 23512.9253 26674.2228 174915.7487 60382.6270 7769.8127 56943.0303 50193.7505 63254.0840 331095.4515 25424.4252 61964.1432 73509.8350 11350.7603 18408.6876 108886.2198 45555.0495 72392.9129 10842.0043 83230.1743 45794.7077 28885.3171 122000.2183 53314.2904 25653.2604 93041.8969 12305.9731 123101.5579 46802.1468 17910.8239 2027.8311 117262.5388 34777.0232 50653.6786 60920.3535 74925.0977 30697.5526 144476.3044 9586.5346 129385.6029 16315.7019 44581.7404 8114.4897 58483.3151 63285.0013 47875.8227 88831.7872 12980.1277 147784.7604 14824.1187 18999.4973 28870.0529 25039.0831 55239.5266 13583.4860 103461.9133 128643.4273 21326.3682 38530.8357 61702.8231 66501.4178 154270.6948 34457.0547 21007.3049 126737.6364 39944.4977 50326.6250 16609.8274 38467.1665 118628.5956 94011.3261 201419.1825 75522.6295 54418.6719 72947.1667 10793.2286 71286.0739 42703.4717 200639.7924 21690.0788 27304.1779 33878.3072 33114.8023 20706.7227 28837.6510 31437.6138 68180.9231 10000.1246 26987.0150 18429.5343 22383.8058 106025.0162 42101.0772 44173.8474 39545.1354 46281.0192 32401.4110 35782.8269 33943.0326 39797.5302 36859.4201 35812.5488 42248.7427 36345.2445 43529.3305 40585.7815 32622.1973 32862.0265 34549.3580 27295.3075 21870.8922 35087.1628 29645.1712 31054.6322 36582.5424 29657.8344 33898.1366 58577.1058 53248.6714 58334.1720 52356.9070 56833.0672 62942.1980 51409.9869 52154.1481 46404.4193 60981.7661 56261.0065 58928.8717 61798.4365 55245.0821 54081.6154 55124.1163 58804.7859 58698.1462 58794.1266 51872.4044 59000.1584 54047.7551 50213.6815 52256.7681 N-Acetylneuraminate_R1 N-Acetylneuraminic acid 1401701.1000 1703305.9570 1408977.0080 1941860.1690 1255038.7720 1707019.0500 1928309.2940 2104030.2490 1208474.2670 1716382.0030 1202776.3410 1084815.1580 1493636.4220 1607866.3260 1964756.1550 1802286.1790 1553622.6010 1543511.4800 1106095.6430 2039049.1730 2176647.8050 1988636.1940 1760069.5940 1029702.8050 1424382.5870 2361207.6530 1259347.1420 1634359.1960 1959983.3990 2067169.3950 1756829.3600 1434493.2830 1371649.1830 1497740.4510 1378795.0930 1755137.2030 1560685.6080 2088153.8760 1130288.4190 1784488.3940 1693920.0470 1321859.1320 1511320.6730 2129249.8900 949226.9806 1944830.4610 1765024.7450 1143497.0690 1434857.8950 1593483.8930 1756975.6470 1839120.2630 1761938.3320 1233222.8950 1697811.9800 2008217.3170 2055251.5140 2662554.4580 1295784.3580 1231615.8460 1684934.6430 1524291.6230 1630237.2210 1383023.8600 1057576.3800 1335407.0010 1334679.8220 1199228.9920 1366438.9720 2280298.2640 1344382.2760 1944561.2380 1440503.3470 1720256.2050 1694445.0630 2025965.1490 1669381.8180 1526900.6150 2213805.2600 1348438.7290 1032338.1250 1780847.5410 1238250.1870 1051073.6320 1594516.0910 2517066.6240 1969142.4060 1673765.3040 1754830.0230 1733161.8030 1969760.7130 1782814.1750 1765500.0680 1532854.0590 2067751.2590 1173771.5610 1366362.8120 1591799.8600 1467696.5890 1220654.6490 1756169.0720 1607634.6240 1501433.4710 1845043.9410 1670429.8390 1753392.6130 1672969.0070 1237447.4200 1759618.2130 1851752.8780 1259870.3610 1357886.3120 1138065.9530 1200531.3550 2496915.1470 1180583.3740 1528888.3180 2191817.8610 1981152.2780 1751444.3890 1768653.7660 1523918.1610 1528342.8040 1828364.7270 2238554.9450 2084087.0840 2129275.5020 1527976.2180 1533524.9270 1687172.6640 2112179.5370 1377275.3150 1627617.1560 1293540.9120 1412194.5050 1547249.5660 1217308.0950 1846457.9080 1839877.1190 1639586.6490 1560272.0600 1147702.2620 2153204.9170 2497643.1280 2443419.0510 1372984.8700 1598386.2050 2455924.9720 1592309.9860 1956222.6850 2293961.3790 1443018.2420 1549567.4330 1303720.0290 2056791.8120 2103866.1750 1174981.4480 2307944.6940 1674084.2470 1511354.7450 988498.6708 1744176.0350 1918685.4920 1354375.9210 1844076.5100 1444880.9640 1469035.4720 1489761.9420 1567762.6130 1330769.0470 1290072.4280 1478020.9720 1412029.0470 1345377.6480 1319856.0070 1212993.7380 1311110.6490 1531080.9960 1497372.6040 1451697.9830 1389131.0580 1752435.3970 1764275.8290 1799448.3900 1758981.3300 1819469.7160 1803567.8140 1834327.2670 1820238.5270 1844769.8790 1456677.3770 1423249.5410 1632484.5070 1306891.7190 1761505.6770 1626147.6840 1520979.1840 1460221.9910 1520285.7650 1690362.0600 1706596.9300 1715358.8900 1703938.4250 1458227.8550 1775563.4590 1673594.8070 1804953.6840 1978167.6410 1933032.5580 1765417.8170 1860382.9680 1866751.9960 1755446.7780 1774312.4540 N-Acetylneuraminate_R2 N-Acetylneuraminic acid 543313.4974 665865.3851 600326.3012 829068.3238 530129.6345 715836.3265 770607.7148 961174.1114 459097.2618 749943.3088 490695.3863 503280.2933 621514.9245 703881.7059 870151.0798 732633.9985 640030.4791 644607.6926 461788.9192 799215.2110 882609.5535 785110.3463 887256.3889 433389.5536 566486.5068 1118945.6890 491360.4957 697743.8939 919211.6189 866801.7695 803398.0044 622649.9952 596941.9564 633551.7674 540584.8076 706235.5012 661675.1005 901857.7158 466456.3430 828652.8958 783347.1889 530815.3541 590831.7919 1115256.0300 388820.1942 791636.8894 707424.9647 432277.0354 580336.1018 654417.0420 706278.3943 771009.8640 731976.5697 495721.2809 764246.2347 913987.4759 876473.0365 1232938.5880 540943.0315 517438.8062 667493.1396 597223.0923 670067.6854 697341.1677 438452.6417 527997.4153 549769.0815 458317.9898 524751.2768 1012206.2860 514131.8774 853066.4211 603057.4164 794493.0949 758420.0276 893269.3376 674313.7234 753495.2235 1012571.8940 524714.1505 399370.6743 714632.9273 485233.5819 448114.8490 612069.6608 1197420.5370 915766.5463 657528.5553 684644.0220 678018.0544 791852.1222 811445.2731 725959.4528 612436.6793 1041379.1970 476915.3035 536597.2554 662538.4929 639174.0086 479403.6182 741302.8251 661212.7397 595573.9748 893352.7692 763472.0833 743107.1028 693484.9578 618787.5327 667610.2341 772756.7325 483982.1784 601626.6631 464329.6219 451797.6226 1259572.9980 475413.7778 628537.1749 923889.5286 816287.0357 704809.3383 779345.5473 678569.3550 618552.5290 734282.1654 1066770.4260 858845.8298 861442.1629 669610.4645 628713.8021 692567.4702 860109.7043 518495.0234 697895.7696 529509.1492 583299.9470 650264.6510 473317.6178 892890.8252 731381.5846 637720.2805 645414.3815 435631.1337 899050.0810 1045937.3800 1010464.0820 593213.0090 636489.6440 1166438.3800 642439.5724 831625.1330 533327.0180 597604.8618 639631.9593 548547.5981 974052.2343 894327.6120 461160.9240 970888.1480 816155.0358 591043.0264 439658.8047 718439.4624 782251.9020 578859.2720 757618.6412 676270.2290 653684.0354 649802.0487 691489.8118 589045.5636 559542.3408 605032.0105 585879.4352 566979.1739 554509.6089 504503.7427 543681.4796 645391.3042 634870.6896 612176.9984 606174.2116 16874.4167 3245.7796 13305.9773 11197.2026 7387.4204 9168.2413 11929.7450 787935.3106 781229.7972 770526.9929 730926.4822 757974.3180 737129.4795 777794.8788 775049.2808 782176.0645 585684.7564 588971.8816 660533.7364 526917.0674 714841.0202 627617.2725 602342.2083 581891.2010 595308.7513 659282.1668 651498.1395 681845.8662 667092.3500 561908.5011 678293.6004 637697.1760 738016.7047 767756.0409 773935.0513 716133.2055 751719.9203 743649.2977 729014.6844 731931.8377 N-Acetylphenylalanine N-Acetylphenylalanine 61045.5628 27333.2798 29560.3914 34987.9037 24024.7098 39967.1065 15486.2789 73627.4833 28613.9850 41201.5507 50234.1908 15134.5190 69212.4190 8700.4925 89777.9771 24110.2704 33376.0808 27149.1621 134246.5302 38382.0516 43768.9393 16361.4242 32690.5754 63787.4217 45546.5493 75406.6996 16846.1282 51697.2524 52765.7072 36809.9201 57542.4647 45998.4012 30592.9863 12516.6871 63156.3427 16785.9691 42720.2788 37067.4479 53194.0471 46064.6784 40589.8548 27745.3750 22391.8648 18199.0637 16815.5336 3801.0812 28343.0428 22782.8223 23141.9287 11904.8596 20905.8385 61117.8058 43285.8529 71681.1183 9819.3360 44918.7568 35263.6760 20669.7955 18676.0812 80730.8295 9577.0073 53369.3906 24800.7837 31996.0952 23223.3690 36250.1599 12049.4374 27656.4762 32713.1925 30320.7448 14025.5199 40977.3879 34400.0772 30189.2690 59814.4993 25432.0724 18104.8679 16289.1655 40984.3458 34760.2281 12548.2152 18579.7595 10042.3515 8227.1501 68242.2596 81549.6841 32160.6713 27864.6348 22808.0944 47603.7065 12992.1662 6127.6812 23783.4490 31210.4040 13516.5041 35153.2060 18780.3887 52171.4289 24436.0156 49356.3000 6797.6488 65358.6669 3834.8310 22072.9474 29968.6510 42305.6158 3310.2409 70246.1181 21111.4795 12558.7877 30042.2317 120479.4678 14329.0429 58045.1387 12415.9026 45482.4025 59984.4721 36146.4903 40801.7274 53675.8820 40659.2556 47347.5052 11699.1547 18761.5319 17589.4044 36232.8225 33840.1113 4242.4437 27224.3285 33438.7162 8435.6415 11573.3331 36709.1603 42669.8091 16525.9346 58843.0161 39176.9711 24474.8630 41578.9371 4464.5286 26345.3226 34846.7098 58370.1931 15406.9909 73712.1658 102343.0735 21742.5233 29490.3528 27390.5137 4086.3810 23677.5573 16696.0719 19444.3039 42673.0814 51105.7552 14041.7024 45361.2216 180839.3008 61326.5643 10010.7476 10151.4932 32966.6236 10680.2316 34301.6240 41065.8558 67989.8724 59255.8981 59514.1242 63803.6781 54714.3831 51723.3305 56327.6775 55750.1900 49359.6419 48680.7830 43362.4230 46647.8837 56462.1433 38096.0966 54901.3850 48094.2104 70608.2217 68496.3720 75531.6292 27628.0396 1314.4421 82464.0345 63618.0060 69060.6664 46475.5761 40576.5168 27153.4132 37986.9335 33337.5639 35522.8674 44233.6172 35891.9049 31015.0129 24908.9356 31898.4782 33477.3156 38065.2169 31222.5319 24198.3233 29002.7566 26623.8671 31155.4443 26305.6749 41853.3017 42008.0299 40856.6297 38864.6267 37953.2277 32358.4378 N-Acetylproline_R1 N-Acetyl-proline 329546.2449 104577.4831 171892.8502 328332.5643 58135.8841 245918.2675 425440.1603 154950.5687 192444.9955 129922.0535 181433.6800 169945.8223 56047.2081 161235.0613 171666.2270 148769.6073 125413.3325 276345.7158 218673.0985 113706.4441 103979.2017 207273.7106 188172.3954 214525.7886 210722.9286 97920.5201 221817.4639 158589.1005 116147.2864 167896.3955 144423.3708 88505.2625 92065.3182 112465.3096 122452.9577 166355.5572 177788.1097 103095.6615 101204.6623 49376.4040 106369.6880 97380.1175 174845.3238 321076.1921 64576.3149 97357.5744 164929.7626 255836.5211 82574.8360 256746.9242 144666.5914 56314.5035 93024.2318 218231.3752 113147.0392 66641.5938 199657.7465 91063.9780 74789.9905 87871.6776 44534.5911 195012.7948 246857.1428 213861.5834 120894.9755 252764.7371 135717.9242 51833.3160 115231.1287 93873.7642 74800.6623 191833.8060 74377.2471 73400.4943 55962.7833 198921.8052 59317.8062 192166.1762 210123.5995 110396.9080 261002.5227 50002.7395 329579.8841 117155.7460 77022.3797 209346.7852 182608.1026 202908.2113 172623.4433 168731.4401 322647.1397 40805.1594 146879.4465 144906.0606 163154.0583 54784.6862 767416.1820 35059.5932 119163.4764 52091.8035 98092.9009 57190.1199 177907.7851 198074.1090 72150.6701 225559.7436 100206.5295 150543.1204 261679.9894 298193.9744 131505.2864 180542.3301 68722.4420 166426.8863 143267.8193 108567.6732 41846.1528 65908.1504 219635.5954 102754.8978 90909.7991 124148.8334 89440.7752 245220.4620 201810.7013 352653.1702 77567.5934 204266.7253 169678.7167 144760.6817 63807.7298 84771.7526 127950.6552 130937.0503 134053.3577 89536.3768 201496.8385 120679.3544 71285.5971 667370.0328 199066.2577 18413.4132 121055.7919 61084.2773 456476.9859 230594.5748 232253.7986 221384.1085 230625.7153 213623.3158 191313.5504 204820.1651 223152.8981 212783.4473 179044.2109 204762.7365 182626.3245 238520.5394 219492.9425 233813.3275 183888.7025 164170.2248 167101.6893 151927.1083 171465.4899 140527.5471 146965.7762 139547.3556 173139.5985 168250.8323 141318.4147 136197.5997 161652.5856 154484.0344 152838.6148 173135.7527 135699.5500 172309.2069 145752.9693 171333.0843 155715.9223 155951.2119 157257.3411 142291.0781 159671.9003 131044.7144 141370.6642 160806.4560 148033.6580 155068.4160 167343.7553 140715.9390 142958.8463 134348.8118 N-Acetylproline_R2 N-Acetyl-proline 350576.5404 46952.1691 71495.3000 255607.7567 26586.2345 185271.7610 316982.1818 48248.6273 122815.1202 156698.7221 81419.2793 214975.3572 134805.8895 140228.1611 133638.1352 150239.7310 83169.1413 270535.4783 54353.7237 132861.7455 141194.9847 168696.1427 62411.1395 110703.5082 78798.3984 118013.5056 86747.0535 78568.5168 112743.7240 76414.0217 62788.2188 62588.3161 47649.3144 95761.9009 75199.6518 61073.8388 67534.6659 67162.1843 26459.7664 117522.7150 49222.7646 51666.2831 167696.1412 122497.2049 114659.2777 35629.6351 174787.0641 100045.3702 32518.3638 33324.7752 133121.0493 113824.4922 33097.7223 121387.3577 49358.3971 35378.4202 141363.7146 160377.6440 142250.5352 56070.8880 155036.7929 46931.5633 45789.4729 62124.4460 33049.9290 90835.0226 27729.2489 144296.3427 67104.3007 114158.5124 57219.2240 164583.6149 59542.5025 166386.2134 41256.4282 32851.0723 92817.4063 77032.0064 48060.2919 192919.7494 77899.3657 152306.1389 235471.4391 62565.6709 51643.7592 43242.1899 479889.4866 25155.8547 59630.6311 67965.2932 84776.0930 83494.2603 70713.3754 46450.9317 109307.0438 85161.9044 122054.0112 100543.5090 72724.8127 40012.8426 117005.2227 100227.9969 26739.4712 59257.3184 24559.4603 48550.6640 145844.6558 40126.1412 31276.0183 41439.4380 61690.0244 57554.3945 85102.4704 119341.7075 235496.3556 34092.2375 217349.5247 86134.5813 34723.7565 74579.1647 64571.6720 135857.1650 94674.1257 65568.4278 122957.5312 50908.3465 67957.8724 222015.6446 45790.9423 67759.2968 46810.5758 38337.2410 332622.8748 84541.2877 78852.8465 91536.7277 63854.4858 74145.4790 69907.5136 72400.8563 74755.5304 85429.0692 76761.2281 63202.0459 75369.7014 73463.3293 77174.1325 64954.5251 63149.6592 62229.9472 72731.5328 66315.5014 70320.8495 78783.4501 83748.4777 83048.1399 80916.8079 86851.7003 87511.7187 81077.1024 83283.4434 71762.9123 83826.5098 74779.9007 76076.9881 83039.5489 74040.4582 82213.8996 80799.8947 87011.9914 88294.1642 85725.9137 83447.4017 80900.2677 70556.3400 70507.7073 71066.2494 N-Acetylputrescine_R1 N-Acetylputrescine 956054.2739 1155586.8040 584933.2841 1357559.3660 554484.2852 912139.1036 619292.4984 1267827.7140 540342.1257 619883.4990 469268.6401 673369.6264 556297.2446 801401.6444 1266043.4500 939565.6341 568465.8886 685028.7785 682120.7983 904492.9336 959785.2359 992583.1133 1851461.5900 722586.9270 856471.1364 829876.3109 582429.6875 1118109.2330 1055560.0370 1700245.4810 961016.4994 590385.6841 546340.5817 584749.1630 509510.2221 788369.5435 568733.5133 745634.5817 498043.1676 1473649.5100 997285.0411 659662.5097 645816.4599 1046329.3740 587084.3325 1020702.6610 581364.6764 677446.4753 706112.7433 733818.9979 755330.4506 1233952.2570 684395.9963 641861.5160 825931.2864 1153465.5510 989075.7458 766278.8850 886869.9487 597084.1411 635966.3586 719507.1991 1040433.7340 717905.8171 460918.6940 715540.2390 948400.7335 796627.1143 581704.9914 739646.8505 599165.9490 1065151.7070 1001716.7040 584169.6648 1600966.0370 696842.0999 558773.2819 690820.4648 919253.0674 601237.2921 986928.6650 728930.3764 630205.8852 523466.5488 572285.0662 892114.9981 932725.3595 594206.6378 727399.6963 1357375.3860 1061261.3890 753329.5136 691492.8110 514890.4931 1301919.8220 717816.5677 608151.6877 697760.3354 668218.6323 783898.4219 1190077.7740 830993.3422 533992.6036 1209957.9700 530592.1470 1323830.1820 1121798.1650 1447836.8040 541418.0092 985850.7111 554982.3663 666705.8048 287405.6012 536759.2524 1420544.2930 428074.2811 920189.6678 951808.6369 1158333.3630 706386.6447 670187.3364 846436.3535 1014147.4380 766842.5070 894899.2194 1081731.5300 1090790.9330 535452.5968 588851.1159 858495.2765 762426.1123 401891.8013 748470.3049 566034.3363 738251.4203 772087.1386 825587.7746 924387.1769 587531.0837 853065.9243 588107.4124 695593.4897 596231.4848 1139087.1140 834115.2654 669833.6344 776853.1528 997034.3498 741007.6284 796786.2914 1178841.8160 768391.0550 1101407.5520 721746.4577 959401.8050 730834.1430 644606.9959 1629285.5730 982809.4410 1328928.7100 877198.5593 474251.1219 776729.4762 896459.4808 625955.1705 766437.1744 758325.5845 726511.3031 700670.8105 628104.2099 617992.3172 598646.0097 568569.0349 518163.3377 542418.5537 518102.5890 530024.6964 705442.4085 654364.5286 598467.8339 545468.7375 914407.2068 890282.6898 905497.7215 727755.5538 732161.0364 725785.2344 809372.4347 799751.6570 783669.9053 947596.1749 948614.7630 981284.5682 880487.9806 892052.0126 863711.4212 780313.7932 785289.3733 736420.8574 832686.1690 822861.4827 785980.7165 743918.2791 693796.4065 723321.8346 725574.3189 804606.3736 848884.9361 929473.2916 885079.8941 895045.9745 841319.8026 819597.4049 743755.0561 N-Acetylputrescine_R2 N-Acetylputrescine 929149.1120 1128904.1090 567898.0556 1318958.4020 541034.8388 888737.9698 599579.3306 1232557.9780 530206.6904 604169.5097 453570.2990 656756.6455 540963.9984 780127.5906 1240437.1000 924177.5886 546329.2878 665471.4115 665744.2721 875850.4354 938456.2384 967709.6238 1810442.5880 704823.2895 836384.8396 808585.1933 563723.7905 1097859.9280 1033118.2700 1652765.7690 932226.5365 574935.5698 534789.3535 565105.7092 490958.5937 766108.1570 551363.2248 724229.2988 483207.1847 1440150.4070 977616.8701 642448.1231 624677.0946 1021720.4290 575336.0252 993543.9148 567721.1376 658828.2161 688945.1783 714812.8266 729497.9533 1196792.9510 663487.1443 626621.9956 804259.9702 1121509.2100 963071.7600 744918.3472 862308.1330 577937.4179 621133.4888 694669.1343 1012702.8310 698751.4717 445703.1360 693583.7262 923477.3998 770142.6195 564948.5979 717062.2075 584117.6304 1039342.8540 972459.5054 564050.0885 1561486.8680 681503.9607 540420.4337 670984.8678 895398.7362 587022.7583 959146.6824 705471.9350 608758.5313 514054.3101 555832.0573 866186.8138 911835.1680 578944.9911 707576.1227 1317753.3270 1030570.9790 732491.3590 671620.6339 496169.6845 1267196.6110 333589.5573 593458.5649 681510.8148 650685.1863 761908.8452 1153885.8810 809853.8378 516816.1679 1177397.2190 510971.3599 1289684.6250 1093731.4000 1406634.1900 534053.9603 957899.2360 540224.9049 651984.4731 279070.0128 520948.8138 1397699.0980 414645.7570 897647.0057 931515.8269 1123979.7790 686839.8268 649703.2099 829181.5512 981669.8566 742447.3247 872455.6125 1053825.3570 1056011.0610 519052.0256 569957.6267 839788.1532 740112.9023 392227.6897 725044.5756 550290.7474 718692.4426 747113.6375 800240.8372 897106.3626 571116.4770 829215.2395 572204.9964 677069.0785 577444.0411 1107873.3090 815491.3629 655603.1683 757001.6793 965606.3738 715231.5687 772444.9192 1146038.8870 750190.7262 1066739.7680 703045.9064 946354.1289 706985.3026 627640.5166 1581407.5710 960708.6672 1297152.2790 855506.9412 459341.1011 755626.4055 872917.5564 608930.2789 747386.2395 747349.0895 715572.2523 684391.0259 609688.8693 599365.0424 583288.5818 549992.3841 505211.3899 526857.0275 505203.2987 518505.9293 684221.9330 637927.3901 581295.9702 528631.4998 892259.3352 869739.6198 890158.9403 704549.3668 711618.4000 709115.0266 784161.2430 778192.9371 760206.1772 924124.9279 928214.6507 958493.3202 858893.0469 874945.3193 840069.2482 762735.4732 766224.1392 717172.8500 809849.0658 786768.2799 763611.2504 722059.3661 674731.9290 701894.1020 705184.8697 779728.7685 825978.4409 899906.9658 863010.7344 866381.4950 813539.3839 793713.8799 716499.4466 N-Acetylserine_R1 N-Acetylserine 99235.3717 280651.4636 155948.4614 190043.6122 160143.9340 155485.7090 195725.9635 192058.2332 150817.4961 72465.6010 205639.1650 183280.8209 114084.3666 276793.2374 147175.5832 153837.7366 159477.8611 113946.2093 177674.9529 301138.9990 135302.5458 166293.6165 104999.3159 44941.7724 400827.9766 260169.6943 270531.8788 224749.8614 353037.2353 158669.5091 230702.0270 86548.3780 59094.1216 102753.7347 53911.2145 161745.5417 81059.5017 223783.3117 174385.6489 204506.2161 179925.0680 155723.3617 127338.4864 71243.2942 87321.3458 143422.8513 154003.5509 108710.7138 100191.3311 92729.9661 108405.4708 264407.5551 128460.2002 90351.1935 132816.7580 170087.3612 195353.5226 121217.8308 148643.2520 153429.1974 57932.3833 159212.2641 187804.9180 107385.8055 110069.9733 199010.7286 137121.1548 120597.5036 60362.7852 384327.8743 146791.0155 245761.9554 212237.2389 137713.8397 284579.4484 140290.6766 180319.9829 85221.0088 209319.6450 102492.0124 204194.4050 159806.5574 106767.8417 142765.2746 175935.8049 290222.4794 189998.8707 77159.7385 58146.9088 294726.0400 152754.9099 128476.5873 233438.5562 137886.1320 179543.0192 50281.8932 204916.5812 125462.0363 210385.5217 87342.0290 123865.6673 85375.4604 91393.6310 206474.8277 131265.3067 226057.3630 85682.1674 361203.3889 109924.4915 104557.2766 174078.5116 165954.4464 95339.5960 69609.7017 246997.8613 280721.7695 398771.9148 109216.4237 111457.4733 164544.6007 130186.7716 111944.4790 377908.3787 226838.7808 254615.4675 195621.4199 141287.4113 137363.7335 77571.3772 173231.2980 161585.9237 107993.3599 98600.2155 182899.4447 123003.4311 112094.2747 66785.4816 198743.2476 78165.8823 128947.7214 178914.1075 63675.5581 143657.7366 122367.9907 180656.6653 128282.8501 54575.5924 251439.0574 286421.2107 202590.7475 146106.2589 95266.2188 402936.9724 146191.6893 169280.9627 164558.1614 105449.6860 306315.2749 176556.0883 126447.0441 104473.1202 117480.6325 125531.0857 286399.7152 76234.4467 193311.7683 194341.5238 197861.3360 183083.5850 163198.5858 158921.8070 180516.0619 162088.1046 167442.1556 176444.2937 149725.1929 162675.6141 182982.1384 200408.9965 168923.2795 169188.8324 227325.1776 217772.9440 222845.8992 217964.1921 208374.7867 191250.4150 212826.0136 222902.2994 215245.9810 137356.6071 85943.6765 143442.6288 80694.3454 147964.6407 146016.8750 99473.9927 112560.1199 114505.6163 138549.5971 144116.9875 157754.8143 140627.3126 127116.8904 158009.8794 136512.3299 173836.7086 175731.8411 156608.2922 167205.9697 178858.0100 160804.4687 159933.3168 167601.0147 N-Acetylserine_R2 N-Acetylserine 251767.8888 134697.6763 163685.7397 109472.4885 131127.6522 208891.4407 116877.4416 209794.8398 151973.7188 96247.3342 245299.7726 121526.4020 168237.7467 123430.1718 366104.7136 152324.9435 320809.0366 204790.5318 223962.6370 286624.5192 237241.8050 214085.4035 47448.0409 98459.6018 65012.2329 159828.7715 327403.6038 105557.9527 117964.2748 195917.5593 136846.1115 131274.8730 113329.3860 79852.3735 92429.5991 232565.7688 99829.7343 150324.3382 161939.4908 105210.0323 112427.9068 138222.8485 268601.7416 161865.6676 113160.7718 112377.9171 339256.7525 117872.6400 207201.3005 210610.1576 209154.7571 248041.9635 136605.3078 204301.8140 185178.3107 158790.3964 137401.8512 180022.0991 62067.1692 220943.0191 124774.1375 244487.2741 163873.4801 148061.1947 182374.5120 91761.5626 86519.6417 176703.3986 161406.7539 172331.7073 90606.4587 215040.0244 85241.9517 127768.1090 75307.0742 75948.6596 507213.9789 213742.9074 476016.6766 98236.7514 116002.4168 290919.5388 198491.3874 235960.2232 280692.7159 109828.2237 104599.5564 208362.0627 151545.1340 162870.2953 175818.6713 93322.2416 142312.3634 139752.7108 135027.0375 354006.8815 216971.0423 195398.0116 129846.4991 313163.2472 160380.7726 129683.8907 259006.7091 153318.4185 247083.9605 89106.2664 266436.3048 93390.2343 146529.0688 167191.7377 136412.4962 124446.0417 199930.3520 148662.6885 153202.3678 159453.5945 163626.9335 126578.3509 225722.8796 188006.2082 204277.3344 181505.0668 262800.2648 176807.3627 238263.9584 183679.1529 116813.8739 110177.5693 136369.6113 141524.3533 109842.7809 124211.7421 133085.2913 N-Acetyltryptophan_R1 N-Acetyl-tryptophan 77729.7580 32040.5304 34799.3922 112023.2115 162182.5519 9711.2686 73330.3109 55971.8808 152188.6628 107112.4386 126474.0790 34546.0258 84157.1556 91100.7301 88449.2509 121857.8320 30770.6210 107327.8314 261195.8894 209168.5114 92591.9635 202164.0341 52588.7142 99012.5272 116857.9544 118974.8821 107899.5322 55410.1807 45533.3078 159817.3333 124300.6981 17878.7735 223506.2352 47858.9466 89659.0942 24750.4193 122071.9120 71817.5590 68235.5624 70301.3141 102114.3081 102747.9193 88600.4449 121139.3957 49162.6667 6836.4264 63889.4583 116515.1768 32541.7099 186328.9062 135375.8333 54093.2245 73822.3313 76615.1688 81587.9464 118415.0642 75097.5472 108604.9371 38434.5041 28659.0565 87364.1398 31508.8290 89716.3528 124663.2845 48801.9710 62397.1986 22474.2763 77707.9421 147056.5405 186112.7197 45627.0169 146256.2401 42017.5364 106766.0638 58019.0493 79488.7169 57443.8295 22209.0923 141634.9214 57754.4634 40686.2364 55602.4630 77967.3298 30190.5589 80636.7575 100852.3045 43908.1639 143512.4580 26854.6032 165237.5536 91394.4786 72858.3493 119595.1732 110255.3286 16046.4946 101565.3768 148989.8319 50840.2534 48819.4601 71151.5112 205061.5782 60180.1561 54090.7798 197227.5468 118774.8592 167421.5067 9745.0066 154266.4075 57442.5831 96828.3480 26636.4768 53779.4100 19961.5408 53444.3143 41614.2595 102078.8345 123892.8036 101263.5923 55806.6735 15242.2246 164062.5753 118586.1030 73247.4031 73925.6860 52345.2713 65287.9716 51318.4028 37196.6718 80335.6183 31930.0968 14015.8554 33129.3519 125882.9469 34647.5931 70019.1071 54897.4719 38001.4399 41433.4142 53912.8571 38884.3377 106819.8801 109039.0518 207683.1167 100120.7888 86042.3029 175346.7859 23168.4884 92070.4898 16211.6252 69566.4828 152138.7809 104953.5417 81637.7397 56097.1567 94358.2296 25203.8773 75138.8551 266203.0906 109170.9397 30694.0320 31290.8192 79107.8209 104118.2582 15715.5832 34877.1821 49438.7815 49581.7107 69355.2348 61415.3158 53410.0169 57292.9348 60116.7186 64797.9651 58839.8159 57791.7894 44654.1860 56672.3170 56195.1130 61439.5068 48158.3929 60424.1122 27221.3946 35404.1847 28694.7055 22203.3385 24000.4888 28839.9264 28974.2470 29864.3986 29897.2812 96993.3046 91023.1887 97387.6000 96224.1443 82856.8283 93186.6236 90736.6699 85448.2021 80043.6177 93967.2183 91597.7932 81087.0452 83636.5998 84418.9959 90296.0518 71091.4043 69783.3712 82990.9003 96956.2159 86912.4516 89194.3525 94057.4719 72668.9737 89573.5976 N-Acetyltryptophan_R2 N-Acetyl-tryptophan 20739.8964 160399.4652 79767.8157 6941.0858 159280.5561 98998.5616 119395.7365 79759.8331 98230.0789 124420.2068 6797.4696 102914.2513 254521.3079 211210.7502 195971.5752 12772.8767 101988.7334 119890.4887 103606.3979 123084.3599 15396.6223 170462.9015 141957.4257 20404.5896 222322.1165 85832.0941 120976.1876 66790.5133 12776.2393 110125.8815 103501.9172 91949.8723 119392.5358 50622.3552 67025.6490 130969.0851 2783.4469 181749.9566 131484.5886 84652.4645 82578.0186 116843.6333 8602.1825 116013.5607 8083.8722 133510.7506 177831.6905 155153.3579 16665.7263 114513.9629 20080.4677 77531.1323 59539.8733 147286.6020 33995.6697 81978.1066 148532.6936 12667.0039 168078.4578 85266.1554 107196.8359 108844.8171 145792.8101 49022.3013 86252.0562 197290.7439 196017.6127 123660.0179 162939.6607 8451.7253 151567.3224 104652.5468 63862.5686 116766.8324 141471.8339 164200.1887 133906.9889 66826.6645 83719.4485 6540.3982 12287.0387 135585.9058 53146.6608 69093.3671 54959.8535 121928.8800 203252.2531 174779.7827 27286.3918 95699.4915 148665.2741 130612.0503 80475.1720 23264.2508 276967.8344 102076.1131 9741.7136 112491.5600 14207.3463 59500.5944 62022.7602 32898.8104 30400.9682 94148.5947 90104.1187 85709.8457 92885.3669 93755.4867 78515.8020 82944.6869 76963.1438 89734.3439 83799.6445 84058.8450 79563.0977 91748.7839 86893.8798 92570.9319 90660.5829 84950.8445 85628.9867 N-Alpha-Acetyllysine_R1 N(2)-Acetyllysine 422733.8899 271473.1823 340847.4113 602008.2669 922338.6484 810267.3335 303674.1180 807330.8069 259583.5175 172355.4455 844341.4295 269225.9114 186694.7187 782173.4485 221123.9701 610556.6958 400149.6554 288330.4325 289203.1638 1000749.4040 612638.8143 337271.7556 744819.1143 234592.2603 484662.8731 690183.8196 761325.8812 594014.5427 880375.4697 534703.3928 778542.8262 293896.2233 212033.5513 200013.2242 739977.0904 978347.1037 182732.5742 369538.9492 498375.4983 520659.7192 428347.4730 251093.6232 942631.4690 285672.6329 188183.7830 388354.0748 471962.7885 194162.8390 324220.0251 258530.6304 718229.9970 678858.9242 259996.3341 302921.7940 904118.7081 888438.4021 370870.3174 959066.8716 667041.4038 220269.6940 534424.4471 847979.6521 696166.5050 177800.7988 157551.0374 875772.5695 245070.1747 232871.1390 639992.8307 1019924.8820 228649.8982 300421.5474 596098.8135 1114379.6020 1009772.9350 849394.9960 1151299.0790 330013.8436 454485.7187 422775.5363 466135.7916 635300.8388 711056.8770 356148.6178 572882.4780 793428.6178 366678.8215 819045.6674 238555.7755 320484.7487 999541.9263 792668.9192 217844.4620 380202.1913 1113331.5990 155056.8684 908106.9607 307882.3626 301111.8511 263323.1873 1007117.7290 633979.4178 297605.3287 404413.9148 1003773.4390 556100.6208 277849.1462 363178.5508 386677.3830 889403.5927 587329.5545 328253.2864 139445.8512 416710.3179 903719.8026 836563.5102 477577.8168 343170.6734 595607.2651 318474.4295 333854.4367 522543.1831 391466.4582 694612.1192 1103381.3960 321642.5386 559516.4261 236032.9028 245714.3479 665351.1297 619708.5185 201337.9618 664123.4951 604054.7978 531888.1719 624892.0372 178349.5450 325429.6294 354111.4368 716429.6697 182816.5529 155963.6104 382798.1554 955303.5095 750796.9918 497704.1311 238273.9972 605995.5118 730102.5398 597470.2699 430617.2826 196943.7882 443869.8255 798236.9204 595441.2915 263741.7632 221992.8911 976454.3611 308499.9881 343505.8488 274755.0771 593036.5527 756529.8678 895461.1749 426046.6398 528408.7812 534039.5321 544333.3994 511560.4915 468225.2381 437155.9394 518569.9511 500008.8316 484871.8336 456298.9113 424035.2879 418222.5499 560642.5570 498929.7820 505599.3640 452666.0694 516669.7195 503430.8103 530542.9898 543426.9612 553364.4166 543753.9564 506913.2413 516281.6933 487640.4105 449900.3732 455266.3742 480439.7256 451106.8531 452211.3345 439580.1936 434499.8114 451329.9817 420349.4499 519032.2831 519134.5549 507594.2555 484632.8685 431741.2042 466573.7506 470982.4006 550174.5756 564428.2730 598796.6149 568767.3849 563687.4749 538700.6165 549718.0177 482323.1451 N-Alpha-Acetyllysine_R2 N(2)-Acetyllysine 406083.6379 267453.5059 334293.9609 582996.7913 901073.4550 778820.5701 281827.6280 778226.6551 247151.8972 163555.6164 824285.0917 264827.7420 173946.4617 744675.3628 208708.5374 832262.3136 386751.0867 284938.0962 281982.4327 1363259.8270 588802.2890 331570.8850 728792.3739 226504.6742 466009.4696 665846.1581 732560.4656 578472.1115 841453.3981 513150.0122 742738.5984 279938.2509 199931.5053 195526.7257 716541.9612 938734.2530 177510.4798 349789.4377 471958.4521 511858.4199 417253.6017 234213.8697 910541.5194 269626.8245 174496.7175 371955.5416 457460.2109 192211.7020 307415.9390 242270.7265 697878.5328 658618.8170 243498.1737 297032.0885 864907.9162 854885.5205 347011.6571 920135.2436 647850.6396 214202.1200 524523.3354 822209.4624 682135.6853 172164.0061 155134.8999 850027.5691 236081.7360 217413.7269 623649.9314 979949.8076 216670.5267 297887.0343 563455.3306 1073571.0420 978985.1148 806456.2518 1096112.4140 310638.1896 435591.7791 416056.5819 448826.0705 607794.7445 673149.0498 349907.2074 676763.4893 773562.0040 349187.5042 791320.9739 226901.5867 310765.0814 963335.7135 756325.3999 200492.1505 364250.6650 1074400.7240 145004.8716 873519.6625 301675.4097 289215.9248 255870.2141 977437.3378 607459.1433 286179.1911 390278.6965 955378.6704 544495.5736 266907.8615 360972.6459 368891.6519 865018.9539 568331.5807 319471.0506 134293.2442 393376.5505 856037.0518 812176.1678 467327.1044 333777.6093 580267.6212 299567.9071 318521.4416 509192.5430 383487.1283 663386.3407 1069435.4310 298356.9877 553687.5312 221849.1623 231077.8474 647412.6323 601823.1506 188674.9628 641979.6859 586070.9135 513206.2288 592204.4596 165312.0984 325465.1410 348529.3661 678341.6208 169246.1762 148674.5982 371614.8181 1109880.8950 731328.4053 480295.9029 228087.3134 906909.3271 691677.5785 573877.0221 415040.2466 193527.9264 421280.0204 779785.5018 563174.2906 256459.0909 207109.5550 926141.3691 297432.3228 337135.7493 273089.2556 556431.4284 728919.1625 847669.8096 415231.3980 526991.3389 518055.5896 526626.5893 490122.1199 448459.8914 417669.3565 502351.0597 481249.2925 466683.8322 440710.0007 409919.0520 403378.4016 539819.9198 492474.5436 492877.7780 437220.6939 507297.8897 485455.1783 516797.8332 511379.2386 537677.1286 525326.3569 500183.0878 483126.6996 478787.3217 441473.7886 448143.0552 470492.7909 440531.7862 439690.4646 427106.5552 411463.8248 427364.2824 409332.6950 505325.5199 500326.0571 494635.4140 468162.4591 417614.5758 454949.4629 455799.2395 537308.4505 540869.0194 572246.3978 539529.4961 532686.9139 524330.5524 516634.3980 474029.6812 Nicotinamide Niacinamide 28172.5178 90793.3624 33962.0976 206792.8487 64149.2975 52541.4287 40716.2213 33313.5566 48435.5225 92154.5532 27315.1887 20004.8385 140950.2386 60616.0361 62879.8160 52027.6773 53847.9950 60003.4329 31429.8505 76908.5158 20467.2534 63624.3950 57047.3712 61027.4702 40363.3156 51171.5439 59955.6792 31299.0578 51373.5451 37588.5436 20466.1283 25565.6509 53793.4235 53592.3075 86554.7967 44655.2841 49876.6167 48799.7875 34917.9842 55551.8328 65681.3071 55126.1690 94086.1855 53225.5600 39081.9990 68482.9410 28897.5451 36563.4711 80801.5417 51570.6120 79876.8681 41292.7939 30844.2380 28971.0271 92110.4972 19721.4783 45093.0339 68965.7456 66077.8093 41652.0027 72993.2707 78570.7098 37034.0543 26713.1838 25582.1533 29772.6551 55965.8274 58173.0379 91031.4259 60210.1788 43021.2023 68935.4035 79113.3238 20317.9706 36664.4075 40412.6018 51593.6993 32706.7617 34413.2951 17387.4605 85293.2901 57219.4551 126392.0895 72874.6690 21189.5532 43167.5578 92499.7421 114689.6829 40051.8165 31833.3128 77875.1977 84891.6609 33715.8938 26951.5427 168687.4788 82939.6702 49021.2151 31235.5700 52428.7688 96339.6198 38672.8303 104901.2891 54772.0031 26980.0975 26553.8156 80645.9588 28758.3904 86432.0771 50278.0279 107152.4475 96800.4435 19968.8871 7726.1431 35000.3113 43650.1077 37043.3007 37963.3256 40980.8059 61585.3514 34926.2666 26207.9645 46095.4192 59091.3028 83740.7703 43784.9118 26190.5595 54532.0298 44424.8961 15437.5423 54735.8868 60913.2258 41598.2017 30891.4002 37312.5740 55469.0172 79058.5328 33349.5182 93976.7587 33857.0709 44449.1582 26486.3889 76799.0427 22257.2031 46899.6375 49841.0593 29781.4736 30271.0944 68621.8752 35780.6104 37091.0103 38562.1383 21309.4500 69997.5104 28698.7158 18227.8618 33375.3547 18529.2812 72369.8610 41305.5843 62218.7698 35491.1193 59255.9319 49584.5957 59286.6824 45876.2713 72010.1647 75460.1081 72698.3590 77349.7903 81716.1724 69624.7963 63604.6447 58126.4765 65123.5784 51925.4624 51431.2899 47538.3317 55894.9102 55355.6222 47443.3826 47854.7488 45714.2248 41808.4649 63228.9789 58975.8737 57725.5212 56682.4344 45709.1856 50924.7446 54403.2462 46952.6290 54811.4630 45746.2631 43263.0241 55817.5976 48571.4385 43528.3512 48328.9857 Nicotine-1-N-oxide 33369.7228 252531.0466 262479.9500 220837.3058 223351.6872 171451.0682 171653.7050 185484.4739 178984.8960 180392.4736 182562.5003 174477.7705 164370.3042 179681.7921 152336.8588 135396.5411 151450.6137 1126080.1530 1108996.5580 1119384.6600 780631.3285 820603.8086 838045.3188 813042.7624 805154.5721 834032.0223 Nicotinic acid_R1 Nicotinic acid 29073.6775 7236.6311 16919.7915 4105.8253 6879.8295 5822.3561 5324.1772 26591.6797 12054.7690 20193.8312 8580.6827 9436.0827 130948.3574 3129.7044 1989.3847 16232.0497 14791.4389 5109.2773 7069.4049 4803.8902 3122.3315 7875.8358 4158.4312 5250.8990 5364.5536 5727.1692 19332.4711 6073.3579 20543.4637 17270.9590 6132.6224 3931.9776 14186.6844 8533.4298 18281.9629 25908.9238 11383.1133 5552.6717 9676.8819 5734.9917 10169.3499 5224.3680 10049.2926 2329.4296 4568.2359 189797.9934 181659.3603 174838.7943 166010.4906 148245.0876 149843.0709 169127.5108 166035.7888 153605.6036 149645.2023 140048.3607 144606.6199 148533.2479 135206.2496 149020.6751 130073.6643 6183.2518 4218.8158 3193.5505 1967.3900 4923.9388 3395.3141 4193.9112 4163.9376 3548.2735 3597.4521 6283.4708 2815.8087 Nicotinic acid_R2 Nicotinic acid 25839.7386 10294.8479 17599.7093 25565.8448 11024.3650 16927.3497 125828.3912 14333.0283 14024.3149 4545.2300 18860.5946 17295.5470 14113.4767 12194.0868 6167.5232 17785.8316 23634.9961 13232.2707 3655.5361 5436.6431 8060.3426 183445.2117 177960.5978 174517.3250 159838.5441 175851.9759 143640.1207 163962.9423 160312.7913 147452.3042 145371.6740 135392.7726 140415.2054 141663.5234 132892.0079 143281 125650.1681 2528.5612 N-Methylglutamate_R1 N-Methyl-glutamic acid 50409.8045 211810.9875 22164.9559 135356.8677 11773.0179 21394.9804 731535.8021 8678.1418 29684.4177 18611.1014 10741.1132 16971.4662 69565.3564 77847.1135 46199.0780 287658.0049 43808.9588 799985.6146 26907.2897 120037.2698 89236.5283 41764.0401 694159.9301 57390.4649 21149.0636 84418.6351 16036.8943 15242.7657 81152.6354 13570.9921 16699.6415 199221.1296 154978.9133 501927.1794 386125.3681 69400.4842 34487.8599 108331.8373 59510.5008 29109.5631 451059.1896 15044.8877 12105.2393 138469.4453 57092.4968 137896.8343 64936.9141 13054.9488 17815.1626 24654.1684 651102.5539 29437.3124 1339759.4710 17476.0392 16104.1017 12412.8751 23950.5783 248263.0424 42114.4446 56943.6684 24461.2956 11812.7146 9553.6720 30403.1837 20517.8984 249976.8973 91354.5492 42172.9240 37697.9862 222976.9443 28479.1180 53909.6163 103131.8997 26095.1472 268465.1861 40713.2123 32797.7317 142694.2477 12074.1754 20207.6261 42171.1235 102124.9563 35631.7010 30386.6548 55226.0603 1122278.6880 228556.4608 15348.3363 131929.5049 11459.6166 27721.4557 19542.6406 54699.9800 121201.5984 19827.4775 14182.0695 15317.0457 470344.8498 37135.1564 64737.4279 23721.6938 4205.1704 14415.1892 11737.1291 43318.8626 17665.6220 191625.8974 34065.7388 80439.9776 154219.9115 26982.3299 172729.7364 10473.3607 173348.8160 28061.5225 61341.7533 30698.8931 44288.3124 1241068.4730 21653.3813 53483.9133 127761.3787 65793.5477 44144.9076 41170.4242 26762.0302 6715.6503 21795.2906 40299.5218 7802.5745 1824243.2520 42301.8535 52552.3084 12966.5495 29779.3996 83499.1345 29082.3377 130768.8456 121671.7549 127171.0127 125006.4179 114165.6669 93401.6713 92522.4249 118387.8333 78783.0875 84446.3608 69703.7086 77621.9436 118830.4995 111509.2156 100880.2564 81164.4202 51867.3446 46479.6086 82158.0319 57189.0612 45152.5397 44058.5182 60637.0047 61695.1438 49714.6223 108265.6954 111363.3671 123565.9096 109738.2749 123499.7607 103802.7159 96254.2443 96315.4706 103287.9919 98034.0601 95525.8010 88960.1440 88539.6083 74795.0524 91755.1292 85968.4292 85689.2082 108483.6796 140986.6219 126496.2648 116916.6521 112526.5181 95109.4594 99080.8369 N-Methylglutamate_R2 N-Methyl-glutamic acid 24708.0064 25239.5716 186195.2873 30065.6526 123436.5350 20791.9509 26763.8209 623217.1753 34782.8412 26932.1381 25324.7936 65591.6455 60714.9259 251654.9321 54803.0840 690299.2523 22716.4275 121962.6689 23757.2442 80183.5783 37877.4684 591657.4891 61073.1814 32319.2010 55206.4728 22590.9380 22481.3372 48142.1218 30109.4779 27899.7083 181626.1154 132971.5603 434045.2590 341001.7428 29523.3086 108916.9976 53682.5375 16637.3178 28007.5324 396491.8495 18552.6816 120697.1491 59979.8810 130822.0580 64866.9448 14481.7428 23559.0191 565764.7773 1144433.6980 25447.8759 26466.0525 9448.6300 190583.8661 51186.0844 18911.1839 24957.7431 35040.1502 25896.1135 221757.6560 76573.4686 39963.4114 179569.0328 16469.5730 17332.7557 48917.2907 85569.1380 29404.7213 222684.8042 40602.6539 24607.3385 118747.1867 22769.4697 12230.2042 39068.7983 89972.8763 34153.5693 38848.8736 997661.2000 218072.6847 21087.3773 132577.4586 21263.6099 45488.7166 27822.2641 53820.4782 106024.7553 401598.7643 24654.5938 65881.7366 41817.0757 24423.4982 48165.2034 21947.6553 170601.6647 37074.1443 63866.1770 144940.2818 17537.0016 154050.0980 21985.7609 151174.5404 29284.2317 56497.1439 23427.2871 18844.2609 28467.2454 1056463.5140 35133.8120 25607.3310 37491.6858 34526.7567 34373.3722 33802.0203 28547.5208 18426.4759 44821.3583 1555025.2170 49677.6753 54973.1640 18099.4364 23022.3202 75844.9476 29259.8443 114604.5191 125571.9275 124786.9416 118107.7639 93442.4393 90574.8455 91045.1326 89020.1538 75587.5261 70843.3175 71749.7501 108697.5370 103515.9357 88851.2446 55568.6849 51285.8869 64027.8707 44872.9533 44734.5620 45632.4458 46797.4182 49393.2064 111927.7142 104129.2057 112528.4568 99322.6061 107038.5061 111389.7912 97679.3489 88523.0702 89223.8219 87746.1797 91010.6975 84122.5728 79760.4075 69788.5772 78771.8167 82333.2178 86591.8205 97796.2864 111386.5643 102667.0420 103551.3802 100872.4484 93556.0129 95920.6542 N-Methyltryptamine_R1 N-Methyltryptamine 183022.3286 82970.5232 167044.1640 61279.7100 16629.6881 69338.2009 115216.1292 110866.1892 29486.4895 383961.5069 67965.9350 25035.8122 88615.6138 75109.5509 131698.0241 49830.5076 39088.7848 101115.8647 101228.0609 352691.7542 129514.8435 130307.9434 79698.7998 626069.2271 42048.3285 28046.1123 188932.8641 105449.0584 44887.2029 36366.8429 83525.3527 86641.5244 16458.9055 122171.8292 321799.3606 86035.6453 196643.9748 125171.9276 109638.0149 193830.7075 137892.8342 65386.2049 19803.7799 166312.9768 140585.4287 141894.7501 376850.5162 166893.7304 117084.5905 39269.8403 219583.1175 40555.0634 34725.7490 437056.6521 62260.6224 66735.8406 103146.3760 71388.9647 36386.2957 99763.5629 22041.0959 99787.2287 83425.4720 18953.8501 13208.1017 24493.8864 65153.3605 74785.1396 99179.4574 146966.6290 81043.7386 28458.8871 93689.1709 167038.1679 163241.0635 65335.3672 82463.0761 99570.4643 90862.3970 90304.4602 84536.2692 200357.3199 308988.1171 36312.7658 14405.2597 363294.7740 615119.4007 398391.1570 31647.4167 46802.1186 197495.0512 9928.5178 119585.3213 34845.1385 22342.1094 348315.7135 39511.9085 188624.7730 216962.6656 93765.1738 62284.7020 38546.4270 56085.6786 37450.5108 159852.7103 61440.7154 68591.9453 56127.5734 64232.9178 83938.2027 103388.8885 117040.6366 32400.2456 123792.9531 9176.7731 5798.1021 68697.9300 43714.4201 169607.2046 28145.0804 96437.3117 232778.6887 18862.1944 60137.7618 655432.5011 31220.5541 177278.8815 90394.4492 118561.3810 30947.2878 72433.2281 124456.6388 199859.1520 35105.7077 123022.8780 40351.5024 46437.2011 85216.7644 25692.6844 75638.6461 156425.3198 45667.8428 177516.6921 257185.0099 206850.1340 251825.6536 250969.3095 233805.8763 228748.2326 204877.6926 204487.9613 213653.5635 212258.2680 187299.1096 187165.0503 218715.9749 226342.1918 204617.2658 226336.2144 184946.5728 203659.8792 149726.5224 170803.1980 137624.5036 166831.5121 165769.1143 166555.5566 147802.6672 135706.4304 84558.2059 95063.0583 104906.6886 107143.0773 88041.1223 115079.1161 114101.7152 123543.6689 106913.3304 111719.2218 71312.3252 101910.3604 76339.1053 111326.3292 114380.2310 106859.2583 103689.7424 108193.9498 83847.6909 120561.7892 129785.6313 132715.5647 110693.3872 N-Methyltryptamine_R2 N-Methyltryptamine 190504.3340 81268.4745 157902.1717 69173.5318 83619.1631 46482.4296 133272.7604 81875.9156 388565.3935 25553.6135 118396.6672 87835.8281 127628.5864 120772.6932 100079.2366 350664.1548 152148.4182 112334.7848 81654.3220 587901.5460 34758.5209 190071.4192 133018.0706 43006.0965 35627.1715 80109.8614 83438.0989 309594.1890 84403.5193 188614.5729 110675.1722 99831.3446 183490.4748 127290.2359 66060.3705 24465.4311 154879.2964 129128.3006 139734.3747 58215.9089 377726.5568 175460.7458 115004.4938 10989.9662 304184.2539 39446.7631 40162.9028 453633.3173 60778.9263 84305.4720 95406.7248 28147.2212 12264.2525 33284.4923 96436.1000 18837.1732 97550.1560 80822.9553 52137.1025 32031.7309 71118.8937 87429.8385 143665.5440 98218.3018 18587.2828 89289.7494 157465.4063 162816.0629 66815.9787 99154.9527 99801.8136 81893.8446 68996.4284 187379.3903 293114.0178 36877.5315 325706.5166 603686.4944 394676.9825 31098.0018 72402.1691 182584.4868 7683.0069 128192.8533 30184.3497 342549.1005 53823.8982 179527.3052 226005.6176 89191.2668 198904.9364 49323.8484 66163.8997 48709.2278 50449.4627 32870.5462 71955.3437 46580.8249 56978.8122 79389.8891 117139.1714 123986.0117 113607.5226 117852.9475 4270.8563 68531.6009 68956.0525 159943.8398 28831.2297 101524.6236 238029.3509 63105.5443 633834.2765 114075.4952 174298.5330 105582.9830 79333.8100 109827.4744 30511.5193 68638.2799 127062.3798 233481.9841 48749.9451 33439.0904 137119.7215 40299.1267 49607.3533 63789.4157 113515.6651 110297.7272 12168.5433 71355.6723 153976.0092 35473.9594 184463.7163 274481.5944 240086.7511 264893.7673 262314.5471 223195.3441 224589.8820 208047.0124 198200.9812 206971.4678 209813.3123 182259.0089 195321.5993 221265.3764 226944.1781 197408.2420 222269.3580 208246.2186 195235.9303 205471.4057 166218.7646 173991.6702 162961.4885 162654.8352 170684.4859 151779.8201 116538.7709 113254.9517 107460.5124 120402.1722 109722.4947 109741.5281 103505.5199 115115.6047 115265.8837 98137.7149 93759.6274 103830.1130 103231.4878 112120.0974 109835.7898 99205.1418 106264.6838 108935.4912 103627.7702 105927.0975 N_N_N-Trimethyllysine_R1 N-6-Trimethyllysine 363668.6957 545566.1755 411399.2102 400852.5023 437081.3618 491814.0115 256183.1359 249887.7849 349149.2958 358816.0095 306223.2324 196749.4638 511234.0912 631131.6011 413629.5459 640765.9166 395862.9034 547092.9278 276416.6270 589346.4916 587358.8983 731074.5054 383357.8154 317894.6380 406348.2777 333716.4621 336708.2027 632431.9383 286028.9556 509001.8382 627647.2030 334007.9150 541576.0155 534705.1935 375738.0233 567308.1306 503989.2572 383204.9769 318848.0697 829916.3721 852879.4605 250956.0523 494228.1976 604915.5487 473110.8780 622278.8986 567124.4555 358285.8872 388152.9989 575778.8709 613227.9854 714434.3996 554232.0768 574247.6599 644792.7080 575548.7548 1411422.2250 400196.4449 640222.6564 313146.1524 1709836.4820 324015.1113 632004.3366 549552.4950 632099.4973 476172.9565 672952.9967 1098324.8900 333770.2561 325800.4882 485805.3733 612237.5579 584186.1464 590295.9399 1090597.7430 359020.5387 691692.1218 224138.8318 395280.5419 366871.8403 1238699.7830 394182.7700 556271.6461 483635.2238 300850.1705 586342.6861 295078.2183 414281.7477 570219.0788 368533.7388 776314.8120 597254.0744 329244.5749 723904.1927 394336.1616 609060.8768 398466.0139 573405.2913 320349.8240 588573.9945 594613.6674 515576.8322 561185.2581 250396.1015 495522.3864 742937.0776 608647.0397 150627.4896 485663.8371 630968.1491 421526.8631 223219.6394 59265.2691 923475.9129 371838.5637 354594.2265 446758.5483 824474.8976 377726.0548 438307.3095 816030.8306 279886.1732 513601.1293 351664.8342 398668.5399 350844.8454 363270.8542 487226.7811 311611.0209 386608.7072 507057.1960 1676496.0070 491688.1442 352053.1483 431019.8944 548861.1752 431781.6046 277653.6435 467512.3915 450200.9368 268314.6623 642644.0936 832244.8738 377536.4738 559070.8823 266147.9281 542012.8867 427996.4633 370402.9498 387531.6362 380972.3245 536766.1549 549219.3636 329980.4317 511761.9900 296651.7273 524159.3430 508379.7909 310486.0855 598501.9527 1074434.9820 587038.5090 445404.5555 613993.1874 467618.8482 855831.4329 821543.4452 915779.6798 814248.3930 725644.3818 657103.3958 676162.8954 606643.7493 583451.8698 556423.1183 580863.2346 529893.2466 818326.6772 812829.7816 711242.0327 686556.2466 823013.3466 742043.6053 810520.9873 690407.4650 716488.7038 711445.3972 793127.3331 784161.7473 773004.1691 505084.8307 536740.0779 573544.9025 477132.7836 526859.8505 543912.2353 466320.4929 521443.4108 430570.3800 475013.4631 475554.0140 487946.1893 431043.7783 386075.9731 424780.5051 431369.1698 648880.7217 646045.8774 590592.5332 578972.0981 613933.1356 478779.9566 669418.0853 465666.7498 N_N_N-Trimethyllysine_R2 N-6-Trimethyllysine 356245.7973 541960.0224 401410.5845 390018.7443 428215.3934 484176.6130 261129.4697 251717.3385 340754.4673 348782.5806 295213.6657 192263.1714 500033.8114 617507.4561 414751.7131 629241.6227 389146.5098 535996.6066 276219.6105 577476.2293 575680.2417 723754.2522 375584.0871 311602.6133 407488.4891 330045.0079 330938.8486 622505.5279 287897.4750 500409.0306 624823.3269 327154.9494 528223.6262 514022.7397 376888.8915 553825.2465 491211.8890 376927.9479 309546.0300 812841.1661 814639.2834 256141.6151 483392.9621 596994.1575 450244.2264 608466.4009 550032.2598 352721.7085 377810.0132 565572.2780 598109.7388 710782.3317 542807.3838 564851.8504 635973.1191 564479.8916 670972.2598 393375.7220 632579.1507 309345.0455 1680879.4680 321513.0070 620573.0917 537227.8832 624264.2600 467074.1865 659376.7278 1076660.5410 332580.0685 323226.9256 485645.1131 598852.3404 575307.3485 580181.8616 1069204.8210 350305.5334 682712.3097 229235.5639 394975.2430 361959.2758 1204634.2220 390496.2858 550950.7276 469627.8943 293305.6456 578772.6920 289342.0212 409321.9437 566452.0436 364571.9800 755686.3499 584900.7230 331064.2227 707700.1180 385612.8477 601965.6044 394391.7090 560463.3529 317608.8796 561279.1680 589768.5097 503329.1856 546278.2189 245129.4488 495310.2993 727235.2291 599860.9825 147283.2524 484468.6483 614490.3087 423480.8861 219111.9996 59697.6634 903004.4541 365196.6037 341136.5909 442349.8178 810214.8890 373062.3753 431519.5458 796533.4409 275057.3073 504717.6908 348308.7371 391742.8262 344099.5929 354614.4717 482070.4513 304123.0247 377239.1192 493966.8711 1647380.7540 482829.5372 348282.5188 420947.4282 520003.4333 425121.6759 274741.8947 458829.3495 439402.2335 264202.0865 631686.0444 817949.8809 368937.1732 555677.9016 265168.1821 535525.9698 423624.6909 361475.0846 375924.4063 378934.2861 522414.7899 538550.5369 324336.5461 502234.8350 293531.2109 510931.9073 510668.3695 306917.0158 584111.4273 1064472.5550 559999.0998 440273.8350 599164.3173 462801.3570 840422.0956 815357.3399 895224.5996 794668.2696 718155.8743 643379.0054 656993.5033 595192.3524 573224.0072 546985.2803 565890.9113 523306.2107 800125.5609 800684.2426 695495.6076 673998.5588 6454.7553 2778.4795 2808.6795 13929.2190 5832.3269 4135.3496 11853.1709 3600.0085 4298.0883 11980.9133 6183.5020 3754.0581 9338.9617 4922.8089 13830.2714 5087.2413 827447.8148 733921.5228 798319.0600 673868.1734 703806.0030 694999.9152 778938.7015 785482.1099 758619.9940 492841.7885 526639.4662 563636.2425 469400.8822 515601.3769 532675.1456 458669.4851 511811.4279 419462.1802 467030.4652 464308.3583 474407.5863 437296.6893 376548.2377 416620.6545 425845.3200 631989.7109 633147.3835 582199.6858 568333.6532 610678.2018 476793.1939 647218.0422 459545.1686 Norcotinine Norcotinine 1828.4502 1186.3290 1466.0524 689.8127 976.3939 561.4550 462.6098 6448.1511 1379.6646 490.4366 600.8055 432.2218 7973.3472 2548.6913 6902.4589 3693.5682 1381.4130 5391.4613 6550.9536 3042.3750 5385.3482 3636.6188 7458.2277 1292.9856 3838.0800 5144.7014 3405.5356 7197.5670 40402.3234 39810.5788 41997.8169 36778.2611 36697.5019 34524.0661 28049.9745 34374.4951 30689.0490 O-Acetylcarnitine CAR 2:0 1680691.9790 11189391.8100 5407242.3470 7004189.0040 8188664.9170 13168629.7200 38995506.9900 450335.7657 1559746.9520 9041808.7440 3935468.4130 1403797.0600 12644561.9000 17161624.1000 8392131.7780 492641.4243 6632187.0260 19556460.2900 5424908.8910 1374429.2320 10636132.5700 852932.5477 38876778.0500 8392166.4420 4322940.5230 12513408.0800 1386748.3170 10598664.5300 1063442.0440 1069947.3230 1705385.7280 30668368.7200 1013303.0970 10427654.1900 8590906.4050 3425867.0520 1672036.4490 4407267.2710 7965941.8260 3477033.2150 3605249.8960 5124936.9360 7661757.1460 1864685.5370 13931649.0900 2073227.2220 5074442.0710 422697.2865 12639358.6000 11235460.4900 4250086.0730 10849746.3400 14022710.8800 7964749.3860 914712.5023 2553127.4930 1228265.2430 15628125.7900 800952.3432 6089744.2590 24973161.3800 25121086.7700 18844923.3200 9854938.6990 11079391.5200 12455970.4900 9040341.4640 843980.6894 150515.3482 6971365.0460 8647787.6160 12224085.5000 4610050.0740 3119873.3510 17198552.9800 17089843.5100 11926462.3900 1980300.9160 19399227.1500 5181817.1870 14094181.7700 3463450.0010 4726677.8500 9158728.1330 1915745.1920 12989397.0500 4554521.7660 167504.9861 1183344.8620 2316554.8710 3894692.8110 923686.7038 17663162.8400 1911210.1910 37799784.7400 10306351.2900 1611688.3130 4786011.0250 8581709.1650 4178631.2780 929405.9122 2336815.0130 1431797.1570 496240.0089 2792890.2570 1961387.8840 3743419.2440 2344547.6940 4761359.3410 2135951.3620 8592270.3750 1945727.2020 4974003.4910 1458317.6000 4955957.8920 3710655.6760 4776270.2590 6271896.9800 399402.4433 1405025.2670 887262.7121 11235901.2800 6676106.3720 33010592.5900 12440027.1100 1368618.2480 271984.8633 19864091.1500 3140487.8890 19105224.8200 4792016.6830 20351144.0200 4273663.7540 19209443.8400 5214301.0130 14857063.3000 617711.4901 4031633.1450 8730120.9580 12240984.5200 16156447.9300 10476464.7200 802469.1931 2878208.8810 14612472.0700 7136597.8990 2370185.2580 7078431.2190 12108076.4300 94442209.3000 2476879.3310 1533021.0180 6996715.9190 8053643.6120 9266952.1260 9943862.6860 375580.3947 4956499.8430 4543503.0050 18635937.0600 5904989.8340 17428133.1900 2303697.9470 10663583.0500 13157785.8000 12226148.6600 12235887.8000 11674609.5200 12779089.8500 10018469.7800 9583131.3320 10451124.1800 10379037.9400 10363031 10133014.1500 9705689.2470 9782961.5470 10426335.5500 9300091.3120 9414556.4300 8408167.0240 37337.5145 38424.1253 40009.0070 36483.5607 33642.8971 46201.3878 25415.0922 27289.8573 21783.0900 10258291.2400 10197416.5600 10513020.5900 9856544.5630 10168779.3000 10509134.2300 8878546.1780 8460644.2310 7738345.1870 10010140.0900 10239103.8700 9403847.4610 9701238.4770 8748395.1830 9541800.2900 8402664.0020 8881854.5770 10155084.8000 8986306.5020 8264053.3270 8461089.8420 8584348.4130 7813475.3840 8318438.7790 Octopamine_R1 Octopamine 7062.8647 31067.1276 17032.0664 21555.7393 14287.5741 27873.2264 11898.8859 29579.5743 16375.4080 19178.2503 25729.3617 19391.8680 13704.5689 25269.7590 12498.6244 25321.7461 12419.5870 15256.1187 23858.2093 13752.5970 13926.8461 22318.5736 24383.6685 8176.4475 20661.0656 27023.5405 19945.4835 13511.5515 42521.3035 14241.0342 23661.9430 14506.2353 8182.0666 10977.6908 9007.8315 15769.3492 14068.3460 26636.2664 8381.4149 36133.0640 33782.2821 15482.0436 5446.7170 18992.7574 7822.7131 9080.3386 13949.7904 5177.2081 21362.6528 18363.3939 17030.9307 28513.9379 17105.0608 25751.0916 32474.3053 25420.3186 25660.5580 11085.5084 15125.9165 13084.5017 25233.1079 15366.7425 18050.4731 18448.4365 10791.8123 12277.0624 23725.3342 6393.7764 8346.9520 20222.7885 11003.3772 44913.6329 7215.7626 13261.1328 38862.0459 14514.1643 13203.2122 5843.3117 28411.3238 10819.8100 8530.8803 13059.6395 10431.8161 16596.8600 12500.4163 40605.3475 29592.0890 14572.2275 13245.9083 21305.9857 8711.5537 22699.6619 10690.1594 12028.1669 15709.4161 13748.0610 13943.6811 19135.5141 18890.6097 20780.0773 22213.0018 26965.3949 7979.0387 28488.1351 12011.4879 37232.8116 23963.0709 35748.0413 8784.0786 10242.2810 19787.5456 24921.1189 15183.2187 9263.7098 54189.3451 19824.2607 25637.8272 30136.4131 11935.6229 15607.8288 17842.4555 37548.8153 21634.9153 19352.4247 28900.4317 33814.8599 9437.2632 8572.0378 12324.2235 18068.8429 9595.2345 10723.2207 11047.8206 12839.2033 15438.7712 9492.8478 12587.8860 32490.9574 17819.3778 10390.2296 14520.4725 9743.6473 13408.0403 20742.5398 8739.9439 22332.0689 13822.4697 16397.9382 28208.3885 12624.3252 9815.3329 20989.9662 18308.7805 10445.3960 13855.5082 18284.4423 16353.8785 38529.3491 31938.7089 41454.9930 16624.2940 5037.1725 19988.5183 19649.7283 9265.2373 24371.6899 25674.2012 25040.3074 20283.3653 17609.2197 16303.7559 9805.9340 21323.4814 11265.7322 10750.1531 8552.2465 15741.5158 22827.3364 6860.6215 19846.9034 15372.0329 54405.4242 46441.8821 49401.5889 42050.2788 38839.0402 50170.4901 48768.3238 47533.1684 49592.9632 7937.0529 7729.5707 19245.0076 15005.5591 6165.0065 14428.9911 13723.5890 3590.1719 6933.1914 15079.9467 14844.8956 11289.7810 4824.3261 9013.1930 5583.3883 4558.0410 5164.9172 4038.1319 6810.5273 11357.1898 7568.6625 12318.5326 10550.2939 11789.5751 Octopamine_R2 Octopamine 15777.7911 24167.8446 11129.5609 23987.4721 24596.2661 12660.4610 16319.8573 14684.4384 21760.9766 18531.5361 25985.7102 12420.3512 13186.6905 33484.1050 6776.7610 17368.4916 15803.2400 11895.3031 17577.9410 14054.5287 17350.5323 16790.0383 10629.0775 8174.2539 17410.6452 25442.0614 15831.1739 29092.9066 15554.2676 8134.4763 12151.6349 12437.2906 10192.8083 19112.6822 23691.5980 8293.6053 14504.9457 9323.5619 10258.0235 17739.1040 32748.5335 5926.6522 6243.2947 29790.6636 22883.8667 8101.6764 21823.9205 14582.7460 37010.3552 17280.2255 20213.6610 13216.9899 13416.2039 15923.3301 10692.5830 15099.0227 23709.2475 25458.4676 15525.2252 23553.2049 22459.8901 13806.6509 7790.0366 45542.4608 24038.2709 18217.8247 24049.5585 19608.6319 19209.4099 27507.3043 5445.8531 9297.9762 15140.3475 16224.2489 9003.3746 25466.0596 17432.0644 14443.6886 20241.7323 15911.4217 12248.4381 25020.9709 19984.9030 35103.0085 15606.7113 10376.4329 11336.6130 10087.3283 7371.1813 7986.9847 15170.2699 11642.6487 10052.4912 20143.0478 14756.2565 24804.4961 10811.7122 14743.1054 18482.6155 15282.6435 14000.3327 17686.3359 20430.0395 15276.9570 13421.7028 14794.4867 11356.4687 13388.1403 13956.4050 8343.0840 14175.2175 12111.8836 9793.7810 13237.1708 15434.6655 11836.2819 14171.1150 12925.3791 8964.3234 Ophthalmate Ophthalmic acid 2299.1331 462.0015 5897.2721 9209.1374 6488.7732 3301.6827 16982.6262 1505.9984 11318.3424 4046.3062 54835.3958 7588.9363 7308.2695 49738.9911 89703.2346 11282.9114 4024.3216 2157.7636 30158.6066 10610.7110 5876.5702 1968.2933 18207.2591 60509.7741 15449.2673 15150.5137 6156.7437 10327.1482 10020.0012 7894.8065 11510.4355 2693.1528 8950.2515 7906.6549 36611.0570 24499.4978 7448.7707 10162.9729 12219.6490 11966.3824 6838.2891 10201.4832 Ornithine Ornithine 3653.2624 3608.0743 451.4256 523.3620 993.4453 1596.2335 5087.0786 2333.8598 818.3173 606.1294 764.8483 1579.6690 6041.0033 3478.6331 1646.8508 1124.7807 1028.3341 5096.7202 2982.6559 1783.5145 757.5532 2148.4420 1267.4881 1324.2702 1243.3019 8110.9258 1784.4865 374.0849 2023.8900 1728.7408 1238.1272 5118.0161 710.0070 1096.2252 4038.5612 4033.1765 7047.8688 6392.6587 3417.2312 3292.7243 9601.3568 2487.9957 1481.7675 1768.8401 818.5029 7170.6534 1893.7088 346.1206 2540.0687 1357.0362 1805.5044 622.6710 1071.2116 1699.8941 7474.4307 10898.8420 3872.2282 2248.5023 485.0374 4311.5551 207.6677 2532.5895 1569.2041 762.5740 533.4042 1371.8811 2285.9227 1310.9867 2356.2187 1780.8313 2378.8111 3819.9525 919.4940 1982.5401 895.3636 479.5159 1299.5178 630.6152 446.1937 4284.7068 974.4560 3824.1352 1045.0803 1857.5721 1204.1902 356.7165 417.1504 1456.4375 1377.8371 471.3767 450.3179 997.0181 Orotate Orotic acid 9349.8514 10905.2341 6799.5743 4425.8779 13634.9309 6328.3094 9100.8626 7415.1127 9598.6128 7442.3354 7196.8752 11694.8380 4776.6056 6234.8082 9096.5080 10384.7372 8762.1832 6721.2664 12642.9819 6068.0746 7958.8339 10193.3796 8706.1999 14690.3299 7826.1273 11210.3337 6076.7540 4798.1980 8036.8668 7008.3906 5459.4201 6582.0916 10813.6236 12450.6020 11436.5448 10414.9815 11858.8834 8873.8655 6712.8514 10706.1848 14596.5374 8519.8948 7787.5083 8235.6455 13014.3564 12568.6721 6619.0481 10693.7327 9475.1226 7041.1085 14461.5536 4273.9246 7524.1719 12799.9992 15951.2035 8945.8212 7729.1163 7231.1803 11940.0423 7085.4252 14259.2971 7769.7443 5151.5718 9785.3157 14984.2172 7417.3962 17682.5796 12927.3930 12602.2681 5862.7253 14078.6780 10057.6529 6605.4219 5519.3888 8112.9931 8674.2124 7010.7841 10081.6819 7342.2943 9024.2273 8614.3884 9148.9149 11538.6197 21215.9840 9189.7538 10129.5508 7933.6906 10034.9665 15529.3070 6518.0054 7735.5604 13357.0230 6846.3914 9969.4064 7965.4591 18940.5597 11020.7333 11844.1861 9510.3296 11105.0882 6306.1464 11216.8119 12839.0490 7027.7128 4821.2210 10629.6053 14981.8829 4745.2632 10317.5925 7327.7183 8375.4689 10627.5826 12058.0318 11642.8930 7965.2139 6009.8098 6944.5885 11024.1965 7195.7956 6146.7012 9669.0996 8873.2971 6767.5956 5917.5407 9352.3041 5266.6224 7174.4297 8116.6885 6607.6352 6309.5889 9387.7477 11418.1590 8471.9805 6646.0217 5415.1630 9602.5278 12808.7468 8060.5833 9571.6928 13520.4835 7058.2656 20074.6961 11264.0199 6823.2643 13092.9937 12523.8981 17159.7766 6247.3957 8424.8060 4024.7611 7040.1391 13361.3802 7783.0666 8039.9459 7030.9570 5099.5550 9726.3096 4860.5017 6945.6520 9936.6863 18846.7486 9381.2422 7203.1858 5636.0722 16706.0402 10456.6689 9485.5138 8747.0200 9112.5981 7168.4960 7352.9414 6699.6595 6061.8899 6207.8124 6158.8966 6136.1012 6211.6073 7540.4857 6430.1797 5214.2188 4657.3936 8082.7878 8990.6547 8685.2775 4830.9424 6419.1308 4930.9699 2930.8884 4840.3507 5118.9034 12752.3061 13106.1266 12740.2205 11777.0761 10645.3554 11246.1030 9063.3899 10333.6566 8607.0303 7308.4377 7409.4835 7427.7710 8066.3436 7953.8872 8547.2852 7022.9451 7505.3661 7982.7553 8734.6627 9363.9188 7912.1550 7098.5043 5173.8335 6495.2228 Pantothenate_R1 Pantothenic acid 1414965.8750 1381237.9780 3748258.8220 1550911.8400 637590.3787 2676246.7560 3670300.5940 1219091.7200 923647.8901 6508781.1860 1819111.5430 1377092.1570 1594275.3770 633650.7913 1431133.3960 2360985.0470 1126432.3290 2004740.9810 1653442.7050 1290689.1460 932287.2368 927054.1311 1553759.8990 2307333.7770 1203169.3730 1793692.4300 1218315.5050 835019.0485 1379157.9310 1106921.4280 2377973.5520 5125774.2830 900545.7798 1682971.9340 1754825.5120 1415780.8980 953704.3795 2124171.2690 1595280.7760 1069332.0240 1581510.3140 1186395.0570 925748.9977 1079947.6900 563733.3195 1742316.1180 2688629.4230 842246.8005 1254925.2030 873208.1179 1534741.2380 793620.7971 1057412.2530 2993858.2150 1569531.8470 1384959.3090 3967250.4600 1239214.2640 1242793.8900 1278191.7360 1602779.9400 1235354.0430 892490.1050 636823.9536 1144065.7880 804683.7991 1739889.0450 924136.1189 1135130.6870 4767922.0830 1023347.5010 1968346.7490 714487.8728 671957.1776 2003496.5200 1017276.3500 1173124.2380 1057953.3050 1184423.2260 676338.1871 1243064.9120 1022446.5340 1662920.5880 2876531.4040 1197380.4370 2011001.7430 957769.7741 1233004.2930 1522364.9070 1425655.8070 1458039.0810 1406530.7320 2343417.5540 895148.5200 6348733.7600 1106248.8890 1841021.2260 1291902.2250 735565.9582 5944344.4120 1078426.0650 1802324.8510 1567827.1120 1857756.7580 694002.9007 1230024.2170 986184.3318 5785735.9330 1644372.2160 1351001.0840 1391620.7240 1524741.8820 2436357.9550 593049.3858 1375501.1930 1683204.7780 1157970.1750 1314880.0580 1410160.8220 1664217.1550 612845.5912 2483350.2480 1073617.6990 1012281.7040 1997143.4920 2530961.7020 1330273.9020 879406.6014 1977873.5260 1195286.8860 1202641.0450 880292.2203 753498.3844 1273945.0710 822084.7226 2324931.4660 1687424.9970 996608.4317 2328886.2980 1736610.8380 2180306.2740 1048332.8020 1228194.0190 1681957.1890 1313614.9250 1924957.1860 1620102.9520 1895762.1330 1252748.5130 755377.7511 1782490.8150 1169927.7590 991381.1897 805101.9423 843993.3759 1437399.9920 1321758.8950 4387638.3200 1522778.1360 1669344.5690 550532.0959 840861.7645 1743929.8350 1262414.3580 1706767.9590 1116818.3750 1217074.4720 1207435.9150 1192653.7490 1123866.3320 1008008.1230 1154719.3570 1106604.4930 1017983.6190 935705.4076 926182.3045 918771.8550 1095863.2850 1031505.0840 1005761.8480 861835.3524 750568.3308 818618.0163 877096.9427 781836.5991 844278.4412 848689.1431 711855.2311 718049.1773 705766.0593 1669227.2790 1613629.1650 1816026.1500 1724588.2550 1744595.5500 1882305.4360 1466216.8760 1679790.9060 1510844.1140 1824361.0270 1855786.9870 1742426.0310 1735898.2810 1437633.1440 1655118.4200 1468270.2760 1521513.7240 1733664.7550 1784259.0750 1662538.0720 1681174.6590 1576978.5570 1594508.4440 1474330.3800 Pantothenate_R2 Pantothenic acid 1280462.5220 1230286.9230 3336763.5630 1406753.5920 575896.6946 2421422.2220 3310448.2150 1133491.7320 845085.2913 5930511.0660 1558492.9510 1227590.1940 1448011.0580 571093.5862 1302261.8840 2128123.7200 992931.9667 1798803.0490 1507529.4140 1150091.2410 847424.2149 853828.6833 1401174.1210 2128397.9140 1083248.4160 1623925.2460 1083562.6070 764659.6159 1239561.7580 989173.8476 2142618.9830 4674118.4200 797703.1322 1510416.4160 1548164.3770 1276997.4130 804406.7698 1876987.9970 1387424.1470 501195.4124 1419143.3430 1059941.8060 815920.5080 989519.5321 509542.5898 1549454.6020 2432167.5150 776050.3953 1116333.1230 780348.6635 1344934.7890 733762.9007 936779.5764 2721454.2090 1414790.9440 1238032.7520 3590206.3160 1121608.6490 1099099.1610 1156964.6780 1433422.7730 1090162.7260 793588.9968 576456.5489 1002176.2630 694175.1053 1589160.2370 821560.2084 1012789.5650 4299118.6500 911901.4192 1778894.2570 643208.1337 560853.5492 1830562.4560 923923.2263 1057436.8540 935565.0514 1118695.3400 605582.1513 1101912.5370 911482.4168 1508548.8320 2548716.0670 1086940.3500 1785068.0610 868607.6447 1080962.2750 1385226.9010 1312575.0830 1312968.8070 1263756.1940 2139817.4520 758868.4109 5674199.0690 995901.6502 1674886.2350 1163889.1260 642684.7134 5350232.4210 936015.8834 1604556.9580 1398992.2330 1664929.7320 617545.9023 1143148.3380 883036.8131 5259949.9270 1525487.3840 1223033.8530 1227988.5520 1387804.0680 2142792.2720 530267.9723 1268661.8550 1454088.7080 1038061.6950 1189558.8430 1264736.3110 1522795.3970 542229.4818 2251528.8310 934058.7139 893903.1729 1775134.8390 2305767.1350 1193493.0610 777706.5784 834334.3383 1060243.1850 1089436.3300 792756.4040 693287.2404 1132785.1870 711106.2041 2105161.2070 1550909.6250 889299.9447 2041821.5240 1543265.6480 1977164.1220 964277.1536 1077597.9870 1522404.4140 1184920.9710 1752027.8020 1456411.9510 1711935.6060 1079919.8410 679689.3815 1597051.2760 1045016.1830 922989.2385 711304.1995 782846.2542 1360359 1180355.6750 3979651.9580 1371486.2790 1518424.5810 488837.9489 770448.0268 1534543.8670 1108400.1360 1530603.7570 1016659.4730 1092841.4470 1087890.2570 1070003.5580 977982.4644 894681.3833 1040049.4220 1005482.7570 919233.4942 846291.6931 845247.8337 834697.1411 984262.4898 920245.4674 910481.3573 778493.8098 711201.3949 755759.2984 797602.3489 719502.1266 762911.9102 774967.7351 652888.8415 651681.9702 670809.2659 1499141.2940 1435214.2320 1635229.0800 1551869.7930 1581063.2320 1697393.6420 1329998.9820 1503232.3040 1376754.8120 1659198.1780 1648590.4580 1555297.8180 1574585.3620 1299495.6060 1471955.6070 1303548.9940 1361264.6320 1556229.6770 1608455.3750 1479761.3820 1533786.4640 1440942.6350 1436897.0930 1386879.3910 Paraxanthine Paraxanthine 44615.3062 3998861.3070 134164.3290 1494491.5420 351674.4075 77345.7066 223832.5075 114737.5145 14051207.1100 2856055.5100 304014.2381 585618.9148 865878.1148 2893015.9990 2398918.4250 1651186.2910 1710110.9820 6226957.9720 1442924.7200 5670932.3690 4023647.9590 2082057.6860 3196616.5330 1130409.5650 4592904.9730 453157.1413 1062094.8330 572753.8760 2358534.1020 1267442.9260 4248854.8030 707914.9040 2841700.8800 876920.4962 1886615.8910 2349417.5270 2121003.3540 1023080.7240 374364.9044 811717.6154 926325.2943 10353659.8600 160216.0914 12498.5635 111760.2794 5098209.4500 254344.5184 857145.9168 4270987.9420 560981.8653 4163130.5160 10006090.7900 4665504.9220 1372400.9010 2404067.7210 1409911.6310 2324465.0050 273176.0318 5381807.5010 1944258.1530 2769770.7570 957606.2636 2846737.0620 882757.9195 909677.1372 19628.3445 4153122.7300 1731893.9850 1047998.5320 441701.1115 2024921.3570 1202857.4280 907423.1626 3047830.4780 1878153.3670 7620436.1560 6083210.8270 52776.2525 1330931.9790 373956.6813 466634.0012 216453.7709 1127649.9130 4158671.5890 3912443.7260 4442174.6140 1310860.4130 122971.1697 330542.0369 2794873.1640 6194209.4680 239811.1897 786487.1986 2875769.7430 663916.8645 364440.7168 3484721.0170 2116058.5760 3179402.9090 4184589.4800 8531665.8090 1531597.1220 1670892.0460 8634992.2000 2286775.1790 6107218.3120 2839219.9690 288311.4826 5215419.7700 2689050.7940 974072.0654 902384.7111 3070108.2500 2559869.1310 2234259.6730 459083.6643 2477615.1080 882090.8661 1276445.7160 376192.6408 2662582.1000 9524.2400 1542121.8780 1975815.2010 4893043.2990 1860649.3820 1515079.0620 210775.2290 6519615.6690 3957529.3340 1097012.4320 2790580.5220 319932.2210 1369360.8170 686180.0361 2286576.9860 1182694.3180 47348.8178 7474726.6090 11904401.6700 1525804.5960 2550118.3140 867885.1208 3636142.7900 1862269.9380 3704279.6040 2869075.6250 77647.1887 1153493.7720 1099212.7600 776195.6285 144851.6380 2054951.8850 1384243.4680 4821988.1210 4880091.9620 4653314.2790 5125224.0910 4069646.6500 3882698.8490 4101124.4690 4078778.1280 4220509.7720 4250227.2780 4092761.5800 4154264.5970 4865774.3570 4345379.2630 3633799.0290 3343146.0100 8837906.7030 8664804.7530 8890687.7030 7739163.7080 7886139.3140 6994838.2020 7284517.2580 7372705.6920 7738834.7800 2184305.2750 2126173.0240 2249590.1470 2036202.0120 2185567.8600 2097101.0550 1887288.8100 1892638.1110 1796990.3370 2232460.7200 2294408.3860 2228378.5130 2313821.8770 2072992.3570 2237734.6500 2133628.4590 2225358.6070 2437643.5060 2303163.0750 2156039.4620 2241847.8920 2036267.9740 1938669.1930 1878592.8830 Paraxanthine / Theobromine /Theophylline 50582.3067 4057412.6060 143684.5975 1543543.8720 363019.7955 77986.3486 241372.5811 137673.7114 14415027.6300 2949971.3190 316338.9696 603087.6511 882778.8652 2958108.4330 2455589.2700 1691476.2730 1748732.2260 6369863.1940 1475662.1220 5863174.2610 4119166.5030 2130127.8750 3270581.2370 1153785.6340 4702993.1180 461192.0380 1095817.8520 587991.2492 2417555.3410 1301447.4300 366997.6696 4337830.0890 730275.5887 2904855.5900 900418.5203 1928062.1020 2424527.9720 2186753.6360 1053962.6500 387356.5063 835134.9235 961739.7804 10625029.5800 168157.7115 732199.9898 123644.2849 5250295.4890 449681.3448 267149.0729 890213.8195 4398275.2570 573959.9502 4286001.6330 10226416.3600 4779098.8700 1422214.2520 2458750.7350 1441991.1420 2373266.6070 286699.3755 5514647.5450 1997056.2110 2849525.2470 979040.5627 2917788.9680 914574.1056 935046.6895 181915.8229 384304.8972 4260084.5450 1777047.6700 1068350.5390 454811.3585 2075818.1140 1228671.3560 945964.7978 3121400.6740 1912495.8590 7838269.0220 6237480.1800 53610.6191 1376612.7650 280025.2948 384945.4953 480620.0014 228246.6624 416677.1695 1160860.2800 4268058.7010 3999335.4050 4547757.3410 1353835.5850 130997.8191 340347.5962 2875011.0430 6375137.6190 243732.3132 813371.7650 2966395.4430 680986.1214 370070.3277 3577557.9980 436965.8233 2183052.7290 3259496.5290 4270203.8250 8783338.8020 1569200.0050 1716906.6570 8899424.1690 2347872.4260 215814.6647 6295846.0520 2911104.8220 303088.6266 5341574.1130 2742873.8350 992393.4300 498710.6763 925941.8619 3151179.3660 2638099.2130 2301813.6550 471521.9276 2560378.4440 910524.9261 1316391.1760 390820.9542 2737805.6330 157527.9974 1581365.2670 2034638.5810 5015575.8980 1923947.6330 1562853.5180 220331.2502 222727.2606 6705346.5460 4065106.2770 1134982.2680 2862847.3150 322064.8290 1401221.5060 690558.0289 2333154.3610 1210006.0770 384718.0689 7680135.1460 102769.7703 12237437 1561006.1520 2622325.4020 888817.9497 3720527.7040 1925240.5120 3789020.0350 2980776.2130 86151.2410 1194238.3170 1116698.1650 808178.0791 156504.1176 2111162.8040 1408774.6270 4897930.9650 4976960.6960 4737806.7090 5222621.4090 4158240.7660 3970452.1080 4227745.6070 4164048.9170 4305341.2430 4364473.9970 4192054.0820 4270685.4930 4984136.7420 4453483.0560 3738896.5020 3446010.6450 8974407.5040 8854761.7530 9059700.3960 7928815.7380 8080193.7720 7151710.8950 7465708.4270 7537476.6190 7953516.6480 2231844.1470 2173199.2220 2303069.1900 2082241.1250 2238712.9930 2148861.5100 1926034.1860 1936788.8010 1838855.3680 2294971.4800 2359449.2370 2293138.8680 2375072.6500 2128946.3710 2292104.0670 2199154.7890 2284232.4010 2505776.3350 2379577.9370 2219114.1930 2311423.5160 2090692.2120 2002868.9880 1933849.9850 Phenol_R1 Phenol 129046.8287 66151.3120 226178.2857 225823.8192 151555.9678 117506.8400 239347.7018 568950.3447 198225.0033 321972.5434 105418.2074 72198.6437 89906.1538 100304.2628 113482.0380 267058.3458 34919.5171 235653.5681 210743.4018 326943.8756 281686.8985 55026.9341 150890.6829 267441.4619 181157.6308 192896.4818 149992.3982 159410.0005 556132.7205 121867.7176 150501.3375 233586.8357 199147.8591 121829.3133 182422.7488 105980.0509 144428.4375 272847.2651 57473.2187 232116.2041 135494.3794 173157.8902 74354.4993 445058.2942 296742.0794 81059.7138 138797.5925 180934.5123 322394.8139 325784.7724 102570.7309 168183.1770 160354.7723 722128.5133 95401.0925 280701.7477 76155.0153 100706.6006 179189.7729 205060.6582 106464.0910 120712.6155 219673.4797 170957.3835 165614.5400 132036.7365 91313.2555 83793.9530 163100.3203 179411.7089 204010.1987 313941.5953 266915.5145 211020.7744 192845.2242 123160.7239 74443.0112 169557.9261 166642.7969 82990.3986 71137.5295 118210.3553 135901.6431 114209.4709 326957.8896 206300.6247 152536.3850 201813.7824 85022.8442 380971.7869 306814.5816 90898.2255 209483.4980 274045.7081 211926.1930 321211.4692 452117.1774 330043.1318 150789.1717 121552.5719 106747.4630 229337.9149 75280.9812 162510.5183 219492.6747 188915.6367 24995.7853 376042.7826 60283.9764 229520.7508 67435.3994 84115.0153 92348.6899 261184.7676 392771.9023 102694.1212 183773.5627 177677.1733 103295.0241 210710.1548 626848.1835 280595.4600 163363.7685 367822.1633 86028.1876 128862.3254 94961.9048 174694.4816 156252.2038 299282.3213 82040.6494 47409.7262 202113.8593 92895.8387 311609.9082 291565.6033 83256.3428 158235.8002 101372.3946 172430.4578 187821.3777 332246.3861 326999.7161 56072.4937 123025.8975 177897.1650 93497.8714 167028.3661 46520.7295 43268.6280 119545.6580 159832.7270 164646.7284 128023.0959 270345.7843 67889.3282 156117.2115 394502.7329 197727.7058 366538.3027 35737.2077 128244.7084 281245.1579 104085.5921 417305.1021 282355.7245 303722.2665 272963.2968 292691.5065 252205.7384 251418.7498 267342.4664 274436.1721 233601.0736 236214.6590 201258.5991 220490.9128 264790.7341 257105.4924 234405.9569 202745.3312 338462.2491 328240.9342 337806.2255 304047.4230 334670.9882 269899.1994 275686.2318 265746.5056 287068.7538 229730.5799 223892.1247 244918.9666 225649.6757 233031.7254 228780.1721 221806.0174 213978.0270 208383.2845 230381.1959 219305.0420 217606.1976 198073.7582 190219.4185 200207.7918 178009.7133 183627.7404 193854.1747 237071.2165 199346.2452 224995.2436 204935.9824 206971.0400 199429.0726 Phenol_R2 Phenol 125316.4462 64428.2515 212116.3611 218262.1937 147921.8826 113862.2056 222463.1602 548611.8524 190097.6649 310717.5145 101629.6980 69739.9685 84024.3834 94284.1300 112145.5498 261331.8455 33085.3234 231247.6366 199529.3310 305055.0855 264307.4431 54863.9426 138840.6873 261271.5821 173529.3370 189369.7577 148968.4587 149966.8027 536108.6418 111136.5319 143476.9373 225547.5849 192675.1950 117525.3962 170240.9696 107024.4012 140149.3779 264705.7575 52713.6108 216414.5759 134919.6144 166161.2236 69442.4952 430144.5953 285247.9202 78843.9774 126552.9737 173387.3649 309640.1946 315860.9037 90366.8767 162464.9397 148637.1314 724096.7549 93149.0631 271629.9896 59495.3735 95046.9690 167922.6359 194767.4989 103357.9697 117374.3359 214584.3318 170386.5233 163265.0225 123039.6701 80939.2952 72353.9163 158758.2564 175289.5143 192220.2512 299881.8101 265240.9527 201291.6287 180444.8638 115425.0858 72661.1657 164972.9712 157806.7627 73721.7180 66408.6889 114820.7821 130249.1527 107180.9246 306986.1868 199552.6704 145578.5496 195505.0615 82062.0413 368295.1559 294540.5897 83806.5449 202739.8251 265200.6841 200548.9665 317388.2962 434307.1490 322352.1379 145647.2531 111694.7236 100423.4774 221736.3502 63070.0608 155136.5135 208968.4031 182878.5124 26070.7895 356188.7721 54772.7763 224988.2607 64857.3599 83538.2331 89811.0693 253805.0612 385193.0711 99291.0436 172070.8906 172270.2415 102059.8553 211274.4139 601275.1024 265922.5554 155290.9798 358072.9997 82893.8174 111894.4839 92436.2965 174534.4987 152311.1694 297857.4261 72334.8026 47505.8132 189814.7123 89117.7090 294896.1296 285830.9466 81437.0409 152947.1206 92843.0777 164137.0712 182893.9569 327217.9760 311744.3928 58231.4901 118455.0597 172836.1593 83856.7472 162188.2365 42470.4018 43411.5778 114141.9421 156086.2894 158447.9978 119974.0128 252401.8865 61910.1596 149253.9380 380930.9263 185491.9792 354481.0500 31740.6289 113072.5389 277783.6445 97890.4268 404424.3853 279042.4126 296417.4091 271244.5511 285510.1380 248195.8666 240213.8785 266403.9555 264539.3483 227585.9365 226405.8106 194537.7229 218854.7021 261264.9611 249847.7023 231506.8924 197141.2151 328655.9960 323028.2076 321305.7950 296701.5778 323243.8567 260096.8500 263801.6389 249707.8226 277305.3215 216777.3394 220135.1129 230114.4826 214664.6100 232465.0331 220856.9921 210905.8998 201302.2393 197465.1878 215615.5105 210194.7920 206642.5194 192425.0499 180084.8447 192005.1028 175097.9280 173885.4065 185754.1972 226826.0506 185027.2596 210940.4412 198530.1114 199051.3133 187582.1944 Phenylacetylglutamine_R1 alpha-N-Phenylacetylglutamine 27798712.1200 20057038.9500 22374469.0500 29680339.8000 19905151.3000 18459298.0200 18657567.8900 20930889.8400 22261545.3900 23882753.2000 18920772.5200 21317622.5100 31902141.2600 10936801.8100 32980471 28654470.0300 27491989.2200 17257482.4400 30237536.7600 27350813.7300 29000261.0300 12109143.7500 19489359.8100 16365539.6100 22976193.9000 45966028.5600 12472303.1600 41820061.8700 33839436.6000 32407959.1000 22379552.7700 18277179.9700 22767806.8200 17372319.4000 20117828.7200 19661263.2600 23051088.5800 23672686.7400 19287856.5800 56623861.3400 23224318.5300 16801671.0600 17368911.3100 18019294.9600 7114607.3270 16573439.9700 20779783.2600 15615619.6400 16421863.6000 13528450.8300 19948714.7700 42111582.5800 26836424.0400 27712565.1600 15659009 27642580.4000 27510349.4300 24815806.6900 15476145.1000 27403426.5000 27787843.5000 27137745.0900 33749002.8600 17064260.7000 14925501.0100 19105801.2100 18725250.7000 26619717.6800 23425014.2400 33880041.1200 16531355.6500 34140971.5700 34287861.7400 22995200.9600 19152421.9800 19911097.3200 20302744.7500 12501352.5800 34613653.5800 17728633.7900 10918381.6000 11090467.3600 17640790.8300 14011036.9600 30135702.7600 44300957.9000 21222674.1500 25239514.9700 15483323.6400 32432997.4300 20040259.7200 14796296.6100 33443180.2100 21340325.1800 19268033.9700 15687963.4300 11530379.3600 30700342.3500 24285839.4000 17938853.1100 12288665.5100 38975510.8400 10057865.1000 37002388.7200 24369691.1600 31997032.2300 6199459.0780 38383596.1700 11814959.0700 25902416.2900 16073922.4500 40457992.4100 10219025.8200 24925859.0100 20712294.6800 19431028.3900 27007301.4500 33122506.3100 23440562.3200 24756867.7100 24987262.3400 23061659.1100 7486411.9930 12651384.6100 25208609.7900 26569963.7600 21523121.7000 7785476.5180 21836632.2500 24050935.7600 16094639.4100 17988277.7300 24277172.9900 15091818.9800 13826491.3400 29651001.0100 18985888.9500 21414161.7700 7654900.0890 7769343.5340 27995481.3000 15869432.2100 36699404.9900 32641391.3100 34160891.4900 27512970.3100 17009853.8500 31305033.1000 7730243.5520 16345690.7200 26858749.1900 17977535.8100 8383378.0870 16899421.2700 28544797.2700 20193684.9700 24017097.9800 24754094.6200 17722569.6500 24632425.6300 17778665.8200 19572408.0400 16456053.5300 27626098.2500 27632787.5900 32603545.2400 30271619.1000 31216351.2400 30538551.7000 25359165.4400 24962402.5600 24484315.0700 22784261.8600 24418394.5800 26444040.4900 23881854.2900 25987929.7900 24060124.4600 24213068.3200 24186170.9300 23687200.2500 27431660.7100 27075917.5400 27341557.2700 21594176.5100 21747697.8900 20334231.6800 21428690.4400 21000724.9600 20162976.7700 27702577.6200 26382478.9400 26734319.6600 26823756.2800 28398972.4700 26481774.2200 23035920.8100 21049379.5100 20953046.4500 23364918.7100 23020221.7400 22203084.7000 21539376.3600 20672022.7400 23745224.7900 22126591.1500 24113856.9800 24659468.3800 21515047.0500 21763549.1000 22809752.6600 23471375.9000 22007034.0200 21803074.6300 Phenylacetylglutamine_R2 alpha-N-Phenylacetylglutamine 25310022.1100 18477179.4600 20693047.5400 27496291.3500 17971140.2900 16829599.1700 17171188.5700 9125990.1270 20039739.8800 21365640.2000 17505568.4000 19543007.8400 29095188.5400 10018945.1200 30393998.1700 26437522.6100 24877982.1800 15672918.7500 27828056.7900 24814353.9600 26245836.0100 11119810.0100 17992653.8200 14818139.3100 20821038.4500 41539485.7900 11418667.0300 38499343.2500 31116987.2200 29416721.2100 20018016.7000 16586800.8700 20527696.0600 15855599.8500 18265520.2500 17761654.0500 20745423.0400 20545931.4300 17732643.4500 52543370.8300 21140826.3400 15267908.0200 15723598.8600 16520508.0700 6416000.5140 15042736.3000 18799206.8300 14126774.7400 14928642.5000 12197540.4300 18104162.2500 38223681.3100 24635842 25188017.8100 14072530.1600 12368834.8200 25224834.9800 9784048.1780 14312793.4500 25399745.7800 25278056.9600 25000985.2200 30317613.5400 15568923.0200 13350084.2100 17318024.4100 17080183.0100 24217591.8300 21544046.4700 30387041.3000 14931206.7100 31122258.0200 31376608.7700 20872735.7600 17675168.2100 18554729.3600 18521469.7400 11401658.1700 31205851.4900 16131473.1500 9880234.9530 10078940.6200 15963379.7400 12860052.8300 27396504.7100 41454003.1600 9993942.0190 23319762 14167734.9500 29402915.1000 18425731.4200 13271324.1500 30618344.4100 19405905.6900 18001767.0300 14159705.2000 10481820.1400 28034625.2700 22378241.0200 16307177.8600 11191782.9900 35585426.3700 9101529.4850 33469912.2200 21887622.0700 29436182.1100 5562458.4380 35261295.4000 10749109.0400 23485628.2900 14639952.4800 36734253.4700 9204504.6710 22505015.8500 19126688.7000 17834333.9000 24567262.8800 30115309.5600 10721224.4800 22843728.1500 22655525.3800 21227656.7300 6675643.8210 11496692.6500 23354228.9800 24287616.7400 19158956.7200 7143538.4870 10019931.3100 21676019.4500 14493479.0400 16284235.4000 21539676.8100 13786985.8400 12774573.1800 26683929.7800 17101029.4000 19710348.1300 7023896.0270 6763774.9840 25643431.9300 14336871.2500 33211932.3500 29791597.2000 31116992.9100 27524540.7100 15655989.4200 28628076.9600 6867566.0960 15021934.2800 23964484.7300 16299140.8200 7457575.7720 15384335.0500 26183517.3600 18373948.8800 21786663.1100 22245005.6100 15830568.9300 22643433.2500 16217427.9200 18099662.9500 14250616.0200 25433190.0800 25503321.3200 29840778.8300 27532105.7200 28516077.8800 27950682.4300 23114656.1200 22775098.3600 10839872.2900 10816303.5400 22220529.5000 24066550.4300 21737111.2500 23678722.4800 21632655.9600 21513600.7600 21942390.8400 21605665.8400 25191821.7600 24792479.3200 25182214.5600 19636255.4700 20145361.9300 9138025.9810 19477518.9700 19064152.3700 18494502.3200 25300378.8500 24006254.8600 24416121.9300 24424957.7400 25804755.5000 24066193.4300 20878057.4800 19006631.9000 18963506.0600 21220995.2300 20857788.6600 20240702.9900 19819110.8900 9595399.8120 21633067.4800 20176624.2100 22008851.3600 22531714.7200 19155961.7100 19458003.0400 20409095.6900 21275894.9200 20030708.6700 19796042.4700 Phenylethanolamine 2-Hydroxyphenethylamine 78792.5099 190904.2099 89785.4005 146394.2495 80967.3113 80111.2567 70877.3607 49561.2547 126836.9496 8925.2914 84405.3393 23819.0518 83710.3987 106865.8411 112436.8348 47902.1228 59455.1929 112190.8047 111959.2541 96557.7981 115075.7964 171325.4680 71677.2765 113658.8892 107536.6689 50593.3984 103386.5399 193071.0303 85172.2611 95660.0817 116177.7670 30793.5514 49993.0397 63138.0088 56038.0074 62700.3254 73922.2921 108619.4190 106533.6714 99068.3317 88262.8978 93978.9768 124745.4138 123998.0189 40661.4715 92337.3524 38421.5898 76959.0793 77181.0664 63714.5820 94811.3301 140103.8317 86012.8103 46984.6485 152389.2899 127447.3893 133563.6185 67754.4088 97480.5935 93335.1064 21330.5818 89257.0974 38607.1482 71271.9560 81273.7682 125263.3126 78878.4317 68933.8625 82901.5831 130800.5279 113592.9437 110254.7479 99132.6510 113054.9027 123101.2921 62993.9409 85891.4728 38321.4936 111904.4562 122196.5609 85944.2443 104087.0514 90011.4729 115640.5939 85694.8975 43614.4199 50716.8520 63705.7993 33114.4687 111555.0021 113325.3845 119522.3578 102404.3571 77655.5047 92402.4237 73302.2740 110278.6106 107037.1990 71518.4364 80339.0840 127413.3849 97330.9964 57032.9486 79597.1635 118631.1636 138978.6463 141567.2806 75915.8368 38162.8089 143667.4537 105304.8406 94088.0252 16226.5425 51599.9700 136798.7604 71029.4657 123212.3392 97162.6112 216597.1183 46385.6686 64193.5680 80220.6563 139029.1558 96467.1510 37469.2535 112220.6531 132905.5359 72104.3715 57214.8416 106116.7285 96763.3185 23182.5328 102890.5200 79989.9407 88009.7989 108345.5432 142589.6164 52558.8501 82832.1786 63516.5037 84798.3792 36509.4260 33835.6913 82470.0298 106377.7514 100486.1121 53425.7318 85392.1662 123723.9729 67261.6615 101787.9256 93611.7863 144380.5533 83573.6423 115387.8930 68358.1668 85742.8700 182472.3172 63537.5571 115818.0645 104667.6899 32474.4124 115468.6607 25518.9437 67755.0498 75017.2244 127026.5098 120322.8305 110639.3027 87375.7870 82269.2419 101678.3262 84636.7600 85937.5330 88824.9710 57856.0215 89328.4502 94694.6987 85273.6164 103805.6779 91604.9947 112190.5590 103337.2311 113506.7573 110034.3073 112158.4338 94152.7893 95892.2137 95648.6404 103043.0872 103804.8710 93810.2664 114333.7272 99675.8087 106561.3405 82948.3941 102888.9988 102141.7488 92034.2793 110181.9977 97622.7015 96101.1165 102184.0703 80349.1675 75570.0223 76630.4077 82289.8458 105225.2033 127570.4288 76597.6792 111078.4617 108256.4989 106417.5335 110264.4693 Phenylglycine Phenylglycine 15584.4398 55590.1494 62830.1007 61422.1615 53792.0278 71739.9901 39309.2258 37019.9403 42150.5996 41303.9077 49491.5475 40413.9693 37050.5935 52165.6759 38418.7141 50076.9738 41597.2857 37086.5686 67841.8613 63609.0369 76930.7628 50388.0879 61887.2111 58902.2981 45315.1723 47168.4103 72836.7626 14040.3113 Pipecolate Pipecolic acid 211528.1663 38508.9642 91870.1568 69796.2481 542499.8629 84307.8930 120178.6306 47746.2463 55783.9781 1127729.2390 91615.1381 91827.5324 172354.4721 70968.8188 122669.5074 90771.4812 246806.6175 772117.4562 250359.9267 343865.8810 128750.1276 299553.3207 148571.5938 1423156.8870 65137.0785 1115785.1620 78344.1305 132097.1692 502701.5523 85693.1210 126331.2988 271999.6481 146424.9077 78563.2639 151530.6044 46469.2563 82265.5981 148021.0759 2827996.4240 196932.2995 815404.7208 313729.7356 367614.3929 90209.7249 95655.1918 147932.1833 150310.0470 44405.3744 76247.1122 326335.7378 152156.3328 139408.9349 274376.8478 312728.2170 114839.8934 164949.0614 125789.9385 71967.1702 123897.4470 158302.8382 710975.4489 128200.7263 4587075.6990 779001.8109 103090.3722 127206.4586 275359.6315 42855.2492 333584.9067 81463.5192 81925.5196 155739.7602 262267.1878 43165.1173 73548.5431 95905.3733 313081.7342 101035.9884 154243.0676 163980.5427 748431.6130 56631.4520 55830.4243 132565.4069 120613.2115 1126143.5760 46403.6887 474466.5679 105817.3880 138070.3273 73813.4137 120605.8908 165380.0356 133884.1661 121835.9892 318074.7469 143600.0175 78693.6847 87938.9270 405183.2265 836316.5197 231625.7520 92256.7899 197752.9059 43930.7597 135746.6271 80676.2573 430298.1883 222190.7019 142122.4908 160998.8114 183647.6210 29879.2917 210923.0064 197298.0938 87349.1078 121746.9401 149140.2185 168112.6560 35259.5430 89601.3850 161655.7763 139359.9340 76527.9079 68140.4239 236782.8539 166016.9224 101417.2092 414740.1191 152470.0426 45201.2050 81762.3822 277891.0716 79458.7427 51774.5306 157281.5460 368671.0140 44083.1752 393847.7501 130384.0819 140910.7919 287515.4791 1358523.0590 110900.0582 234483.2142 234997.6173 119651.8365 95509.4141 89542.9325 426932.3172 162860.2021 212410.3672 146766.9139 139514.3464 114210.2635 79303.0781 57300.3677 1310996.4710 233263.1122 107481.6664 56101.7910 51435.3499 136581.6993 54815.7053 165924.4133 536077.8733 518590.0809 492388.8675 484817.6371 424792.6332 354306.1155 411790.5603 384085.6507 379711.7631 382285.8356 362507.3297 379546.8110 477830.0594 444098.3519 409548.2686 372007.7868 202628.1803 228357.5121 242036.1007 167658.3949 191033.4025 177776.5023 150506.2586 176800.4041 156200.1945 389812.8009 379147.8860 394499.1960 378772.7116 378382.6418 363321.2095 323720.0220 310214.5866 307129.9864 329411.9574 334400.1517 289062.5710 314257.0108 298382.3014 294445.7080 305226.0858 309241.7052 322903.9718 361899.3213 342086.9252 344358.8310 330252.5250 308935.5076 273150.5180 Pro-Gly_R1 Pro-Gly 971978.3629 976541.1216 450055.7218 1150453.1260 1090808.5810 606659.2916 630302.0431 1157952.4310 752460.1889 801787.2474 1312412.3470 289223.9838 586389.2083 921908.9722 571788.5047 1056807.3370 663963.2883 751695.0229 996452.2139 843922.5779 1166734.6940 840561.3904 1629746.2190 582645.5979 805935.7058 577014.6988 1233224.7540 984946.8915 852711.0502 715552.4851 689022.5501 269400.4982 669180.8458 343381.2823 1036140.5150 543765.7043 693859.9829 943751.8887 410636.7856 476994.5716 1257728.6320 703328.6320 791992.9894 854331.8131 617019.1205 649781.1592 748339.4237 463790.5795 540912.4390 1068189.7270 805996.3125 1326082.5600 713086.7134 499684.4087 1050619.8970 1003850.1710 1034710.8570 2257864.0720 1195808.8420 793041.1155 990757.5412 561891.0156 1727403.4800 847210.2984 757431.5672 2376986.5740 786557.6083 2088897.8690 774595.5413 1577928.4000 698520.6634 542258.6542 1467150.5920 1021508.5750 760822.4795 1042885.0940 897540.9774 711705.8046 1648225.6150 553804.4816 853463.3333 711386.8942 551005.1101 1316806.6570 985283.0137 761684.7889 739212.1996 931472.4700 516903.8773 1726455.6910 1965653.8890 906708.4540 690545.7962 647251.8408 1548612.4640 1187595.0750 1043958.0970 564978.2677 1184122.2180 940113.1565 1981975.6560 867800.5577 801369.7893 2211667.8210 905363.4820 976518.3008 1300106.0260 697454.5913 724518.0725 1114526.8420 1116472.4630 451611.4300 352441.0807 379120.3871 1403782.5490 1250708.9130 869633.3458 393566.2175 991773.4487 1090399.3790 684763.4187 1458103.0900 1607803.6510 1433300.5080 949092.8162 864001.5513 946878.0225 588898.5331 764456.6825 1858840.4000 1653298.1100 367028.4936 1069354.1510 561761.3047 1405650.0010 1176909.7540 657766.2933 669490.3292 1135567.9790 1347743.2240 578676.8839 1151123.8720 682079.3609 631788.5092 929093.6424 684702.5329 522077.5214 516605.2561 1100367.7580 907342.1809 920664.9444 538457.8877 1732998.6750 2286424.5260 778767.2053 1171266.1240 844676.5074 2726295.5250 759108.6248 1508468.3140 725589.7705 924256.7648 1091307.7830 682273.1441 867143.0202 77281.5424 88626.9176 105706.0853 79864.6734 66886.9265 68315.6017 67336.5608 68973.5954 61684.5617 51247.1795 52616.4717 50414.0751 84883.5946 64039.9421 66566.4590 66450.2317 115636.7913 126173.0088 122689.7059 117005.4700 144968.2802 126755.2220 141908.7193 157309.7735 149597.3244 707649.6103 711532.2865 729977.8564 711002.5643 754737.9752 710116.5166 634211.8511 695917.2816 692509.1782 820179.7455 827776.3587 905547.4246 872856.7962 683591.1396 807670.9308 782546.9825 908563.4455 959859.4070 980139.2943 939262.0389 956848.7640 948538.7025 923370.2066 873435.2735 Pro-Gly_R2 Pro-Gly 918399.5081 889546.4552 566302.7945 1481288.8550 1022342.0070 743961.6871 790486.7474 1110230.3810 863883.2131 466406.1630 1144998.5690 440597.0214 667197.2929 1011395.2840 668403.7656 1057184.8200 726212.5146 664708.8840 943691.1844 855058.2144 1233910.7190 845822.4435 1599430.6220 522121.9022 849942.0643 698771.0576 1092887.9390 1079068.6530 742542.1201 662355.4052 821994.1501 368717.1679 761691.7591 447396.5749 918664.6436 481004.4357 645300.4403 844022.1953 565135.6039 645875.2203 1129350.7820 607565.6757 697935.4062 922794.1198 575531.4843 752098.9805 827175.7425 538499.6876 727057.8676 959906.6291 932872.3616 1227308.8910 626613.2075 578803.0172 1013627.7450 1138523.6060 1214848.3740 2179948.4420 1319631.0820 715549.4609 792184.7611 719838.5074 1666752.3350 887371.4900 1038399.2970 2167263.7810 1012311.4940 2035391.0450 882738.8323 1545831.4430 642405.9089 659845.8026 1527421.1730 944614.4121 870427.0102 1087929.2300 978771.2858 712153.6692 1589487.7920 557604.5535 772599.4539 842999.8635 539024.7180 1451693.8610 861792.1036 809839.0354 456290.6350 1132329.8530 617790.5124 1473000.5410 1918950.8290 902998.9190 627403.0884 743134.1993 1676330.2150 1181360.4680 910615.4340 537067.9239 1266727.9300 807981.2636 1864428.3890 998422.6051 890498.0745 2269154.0700 825725.4166 1034161.8230 1464425.6410 670805.5446 825591.6534 1181575.2950 1007132.1520 671178.1579 380950.9189 466318.7934 1353942.8690 1146960.9530 897198.2165 404112.4410 903833.5706 1115185.8890 804328.0529 1562468.7250 1421434.3010 1434162.2220 1099118.7070 795486.9415 869749.6300 805001.9545 810328.4714 1658287.3110 1484167.7910 321380.7153 978537.8981 739044.0236 1247781.5160 1008995.0530 551376.2693 783613.3177 1017923.5100 1213590.9790 503720.1276 1169306.1300 654458.0669 683726.8338 1090819.3070 723336.5245 351061.7111 597073.5563 1171885.6270 823611.4704 801832.8789 655911.5440 1572357.9100 2078374.6780 1173245.6300 1197930.5680 788321.0912 2860296.2380 918565.0784 1417457.2170 845312.4551 962730.7398 996187.3772 554694.6104 1004166.5390 185294.9314 102945.4447 99384.7314 92265.3598 128710.7175 113710.1615 116356.0105 110096.4614 285686.9059 281073.1659 291875.8440 233568.9486 467928.4698 307560.2081 313164.7883 296729.8591 290384.0629 804356.4586 807229.0342 872329.2156 762134.6015 829794.8592 776756.8126 752114.3803 782117.1657 765849.0201 954904.4271 930271.2126 967621.2047 931845.7015 753889.4285 876194.2863 819806.2949 993443.9016 1002843.6360 1067357.6550 1008007.5380 1022647.0460 1010615.6520 1007344.9370 950182.8023 Pterin_R1 Pterin 166148.1164 110716.3045 147976.4051 125573.3845 83919.4170 162536.8855 39020.4618 209676.3986 168937.0656 131150.7008 90426.1991 56381.4666 82451.7960 83810.1412 117121.9110 219516.0616 93539.4441 114815.4755 169279.0013 104161.7260 221410.1065 190067.7229 92207.5791 142456.3099 99052.4060 70124.6179 209425.5114 111979.5919 177107.2411 144229.4390 164862.3053 81926.2807 47750.2992 96928.0901 93581.7378 64743.1688 96587.4340 56095.6487 99351.7025 132743.1720 206118.1417 118403.0185 126680.0663 302757.9776 83446.0438 137182.0481 175757.6668 108304.3681 179314.7109 112210.1149 130781.4019 117849.1536 109213.7958 106645.8759 145087.0310 136196.3086 64442.3989 166922.7089 189073.6093 62349.5984 169946.6379 101768.5023 69311.7586 103803.4625 59869.3874 69231.3626 133873.0480 144709.2873 108124.7591 188395.0867 109232.9531 272884.9556 172798.8617 78683.8849 64667.4611 103464.2564 168037.5471 99658.4943 142814.3927 119846.8066 131823.2485 175239.9417 136077.7786 70089.1324 116194.6616 70357.0469 249328.3075 142777.9048 66805.0261 177858.9388 193049.1438 134312.2291 91692.8177 188058.1511 130340.9243 89981.2549 114830.4119 97173.8385 35430.4929 95289.6881 51928.3234 148557.6447 146971.5004 31284.0425 83097.0545 269967.6854 143544.6174 243637.3279 132806.4549 221575.3235 249120.3232 116264.8141 53243.8988 57394.9678 89865.3518 88359.8819 100836.6867 218483.4509 341470.9540 53410.3912 91118.5568 93698.8421 173768.9227 215525.0503 108174.8640 109968.4236 323905.6843 111301.2052 78668.6310 103382.6186 181154.4351 185483.9959 134976.8667 80567.1313 62124.5336 139236.5500 53126.2785 241624.6853 116923.7577 91453.7403 97057.3465 82683.6583 155972.7038 110165.2481 235425.8951 113584.5011 65977.4168 400779.3544 129570.5242 106531.7418 105076.2303 157345.2646 150141.8432 73561.3249 213654.6718 40133.8585 115351.4731 98628.7167 61466.0475 201431.5521 43323.1695 120515.0951 168901.0076 126014.4329 77567.2253 93187.1052 90858.3614 103323.6904 94743.3982 79109.8181 76706.6764 82722.7921 85099.3991 94398.8380 85497.3916 77689.8601 84816.7638 88466.8155 86378.6430 82180.8903 79284.6685 98999.3481 93973.7797 105650.7461 105843.2689 110073.5099 130857.5183 106233.6631 102975.4783 103525.8655 123368.2909 109847.0543 156043.4037 147516.1802 150924.0151 156221.4065 157773.2702 140351.7582 138119.3255 171448.7871 164670.7529 156218.3697 167986.0895 140451.3977 154199.4096 148841.5939 155993.5795 176712.6081 140561.6677 125192.4408 129488.5241 132469.0939 129781.9471 116565.0048 Pterin_R2 Pterin 192600.5824 96797.0265 178571.7230 128685.7573 93254.5074 147806.5976 35108.5660 221124.8753 172028.4476 163812.7845 89930.2061 58734.0777 96443.6096 91287.5488 103631.0021 222669.6542 88142.0532 140386.1485 169948.2180 108294.5633 219357.2348 205968.1881 75415.7464 144042.7566 93701.2333 84989.5908 227442.4840 116921.7848 167011.1645 127214.4393 179241.3726 114361.0038 65323.8310 115904.9849 82468.7947 56482.8527 113444.1152 46595.8898 109945.0086 128877.2529 203927.0041 129159.4263 116849.4910 295092.0615 104004.0230 141671.9278 186264.6566 98725.4410 176713.0218 103652.9078 154615.2752 131006.5361 111391.4347 117346.5332 155261.8509 149249.0316 70780.7435 203645.2692 179631.2835 71942.5729 169763.0576 119562.2898 55668.7457 105569.5640 54005.7761 70399.7897 145473.6304 164765.9137 134964.1524 217587.3650 108201.1620 270947.3592 170630.2386 73320.5181 45729.0649 91472.6771 192614.7701 97281.9764 169811.8472 122106.9621 138427.9902 205097.8572 143316.3655 67877.8454 136194.4591 77841.2078 255131.3185 170052.1210 62117.7041 190079.4867 216913.9799 149748.3391 94545.1847 197965.4995 143911.5440 88113.0735 130122.7474 104117.5653 26452.9374 104681.1537 65774.9342 139971.8661 145023.7623 23954.1141 77778.3908 270276.3063 141792.4523 263596.1203 162980.8278 226087.6018 277521.5583 115150.5427 48290.2935 63641.3606 79744.0216 86003.8398 90142.2415 222140.6887 315676.2783 46053.4991 108003.1841 89650.6778 186329.2940 224476.8788 100181.0847 97584.6532 306902.3754 101046.5455 70341.9627 109838.0732 195262.6646 188147.6150 146977.9692 88007.2322 48482.0430 137510.9280 53812.2981 258604.9457 137869.4211 103401.5473 89599.9821 89499.9599 175556.4741 100828.1047 232265.5618 105140.2971 64465.6516 390046.2660 134932.1134 104374.7874 118393.8575 168928.4336 160619.9966 69879.8290 206100.5510 38361.2941 120037.6453 98975.9169 58332.5759 196929.8644 35971.9616 129146.5400 182991.5598 122353.0872 72217.9000 83928.9443 88250.0309 96920.0768 97478.6233 78446.7510 77293.6753 84487.6472 87278.3649 88448.7410 86521.1500 76580.2250 77227.7608 83213.1238 72221.0033 74873.1153 70104.7306 93554.0409 89147.1785 96651.4323 97725.9215 105281.4078 98779.9393 82195.0970 89616.1303 92712.0998 126333.2293 116867.8423 138816.1126 142414.2058 143241.0857 147063.8333 141320.0283 132429.7176 132220.4686 162819.1292 161435.5510 145584.7166 150390.7520 136511.2330 139718.3005 146096.6572 154530.2859 163533.9719 128517.7957 120598.1866 122841.4855 129376.7663 116797.1863 117137.6472 Pyroglutamate_R1 Pyroglutamic acid 3818074.9510 3258261.2260 3433457.4030 4188923.5500 2876880.7280 3292788.7220 3208774.7690 3667296.3750 2834257.3250 3400736.5890 2897379.4700 2995584.2450 3470606.2980 2191314.8580 4044096.2520 4441367.6120 3439470.5900 2840324.1150 3859820.8120 4062169.0950 4138555.7500 2251951.9870 3225807.3390 2896635.1170 3893718.8490 6011274.1710 2746565.5390 5833294.0630 4807161.6510 4530542.7770 4425546.8520 3429101.4020 3008374.2980 2684533.3210 3272526.3330 3106368.4580 3036391.1410 3853476.8710 2863774.3480 6574309.2440 3615948.5560 2711727.5000 3269836.5080 3743636.9090 1538403.7960 3071369.5170 3359788.3240 2177443.5080 4450185.3040 2549504.6010 3153984.2880 5816554.3540 3637988.9590 4067709.1100 2570634.4630 3823242.7870 4582359.0360 3719703.8280 2380916.4150 3808712.1150 3614393.3920 3746338.7370 4558364.7770 2600012.2840 2328270.6160 2653887.6020 2947937.1030 3404694.8050 3021776.0910 4830896.3850 2838172.2670 4552794.4730 4611118.0760 2891362.9230 3497454.6400 3131144.9050 3337087.4790 2319263.4950 4772714.7450 2504514.2980 1948850.0490 2487407.4290 2682232.3580 2520158.7160 4209559.2500 6007710.3790 4089506.2740 3700074.0200 2421475.8150 5231897.9660 3525470.3240 2319718.2570 4700584.9120 3281159.8930 3380018.9970 2254945.7120 2519687.0490 4108772.7590 3639506.0860 2869327.9410 2847514.1850 4895440.1950 1986063.3060 4598210 3073035.1880 4398814.4270 2183892.2550 5225769.5860 2399562.8890 4223268.8640 2460401.5020 4680286.0100 1937312.1110 3637874.6360 4115150.3270 2857492.2910 4253406.6010 4766297.7680 3441176.4320 3470749.1480 3700890.8460 3297353.7050 1825671.8010 2799019.2140 4266795.3540 4377412.1650 3098601.4410 2224097.5550 2451081.1710 4020957.8240 3029490.6860 3200572.4780 4295698.0020 3549475.3910 2093983.2850 4160708.7270 3745628.8530 4159829.1340 1987715.5950 1554183.4600 4110539.4580 2294927.1320 4858219.5260 4170925.7790 4128706.5170 3807226.3280 2675252.7360 4497085.2110 1916607.8320 3308545.8500 3806124.7280 3833408.1200 1852947.3560 2535378.8310 3981904.9500 2708636.4490 3233910.9930 3865513.6390 3950390.7400 3637200.0560 2406099.7830 3539699.1860 2909491.8160 4137848.7540 5577371.9160 5083935.8150 4849005.4130 4865334.1300 4861261.6210 4157650.8690 3953998.4740 4362890.0400 4171004.5960 4363477.7630 4538062.7980 4213029.4560 4442808.8220 4399898.5930 4241546.9960 3723827.9380 3309966.2530 4485015.5700 4409065.1600 4596703.2370 3933797.6290 4009373.3040 3772646.1510 4022121.3970 3815330.6300 3862617.7250 4001352.2690 3788870.3430 3761528.7310 3820755.5000 4023892.8910 3859064.1860 3308592.3540 3164726.6860 3036919.2220 3694789.3690 3699497.4220 3614711.9600 3550335.6120 3370525.4430 3755144.8940 3522585.1930 3697205.9310 3919013.8920 3533079.9570 3454283.5570 3440603.3870 3294020.5940 2956284.9530 2895245.6700 Pyroglutamate_R2 Pyroglutamic acid 3681583.4410 3076656.8510 3327502.8240 4063919.5260 2836611.7240 3046097.1460 3115537.1520 3442802.1860 2656982.2570 3254886.3310 2750207.8660 2975049.8260 3293003.5480 2072985.4690 3874364.2880 4324823.6070 3258700.9780 2750109.7510 3702600.6570 4048597.6600 4129315.3040 2014560.7760 3183195.6620 2716216.9970 3727593.8780 5703538.5180 2754248.9020 5426158.1330 4700324.8550 4529667.9900 4306612.6440 3394890.3750 2958704.9390 2688052.0350 3064664.9580 3116593.3720 2958533.4740 3697226.4200 2708125.2060 6209378.1370 3392459.9870 2619754.1360 3308109.7880 3449319.1100 1441192.5690 2921826.3480 3394416.7150 2102865.2690 4307668.0140 2544552.8550 3034900.7440 5346614.0430 3477455.2250 3914383.2290 2439357.2110 3775333.8680 4395884.5440 3662656.3240 2323429.5400 3648400.2980 3545384.2390 3597956.2920 4354022.9620 2454775.0930 2265218.1760 2643313.0890 2913505.0160 3184024.8620 2958207.8500 4604809.5460 2769659.3100 4523124.5540 4400764.2130 2879510.8230 3324666.0900 3008876.2100 3308808.4770 2221429.0880 4737859.1410 2304172.5760 1805090.8050 2306803.4970 2537760.5250 2585437.6400 3984563.5860 5762444.4930 3948984.0220 3592314.9480 2334293.2310 4961748.8370 3491817.8610 2243163.4950 5808555.8410 3263106.9320 3291625.2200 2268287.7810 2363048.0350 4025116.0930 3511621.5270 2851007.6330 2818381 4673905.5430 2014155.5500 4332126.6680 2896718.2490 4099275.6040 2071975.9700 5382590.9710 2345985.1030 4076139.4700 2473543.4220 4395994.3600 1862506.1670 3629215.3900 4088669.5830 2671056.2120 4050562.4990 4227823.9540 3283865.9170 3358001.3480 3323918.2630 3227271.4040 1706724.5010 2631209.0400 4088848.1150 4114085.4150 2997755.1990 2085257.1160 2369095.1140 3829086.9600 2904382.8630 2944178.3760 4451922.6440 3292493.6400 2097705.6580 4021549.6880 3505468.8240 3970156.4070 1991007.2700 1493523.1620 5100156.2200 2298113.5210 4887411.5340 4013530.5660 4066059.7400 3596881.6340 2532557.3230 4288221.9500 1883773.3520 3168257.0600 3734407.9140 3699363.2040 1728085.6710 2401450.2110 3966526.6180 2570278.0640 3102354.2550 3668417.0630 3893542.1260 3713791.9180 2272316.7830 3577911.0880 2754728.2310 4101228.8390 5402442.0750 5096786.0390 4884186.7970 4790733.6550 4925082.7380 4330902.1270 4079342.7150 4353484.4700 3912044.6170 4103906.6060 4509377.9480 4202078.1470 4425625.1700 4127927.4450 4403767.3850 3882476.5290 3282247.4210 5185.2090 6536.1621 8944.0839 10180.0137 10353.4312 6162.8761 6220.2640 4698298.1350 4353711.2120 4774717.5890 3742116.5470 3884633.5640 3655128.9160 3901114.6110 3718909.2270 3736949.7980 3899304.9540 3724489.7520 3759142.0560 3543991.3040 3907238.4820 3686991.6530 3242197.3690 3028035.0410 3019558.6730 3675425.7810 3693954.6540 3417117.8750 3391055.9320 3336635.1190 3782550.2780 3504367.7040 3683996.3610 3731378.0840 3350621.3140 3435796.4560 3255721.2890 3258604.4000 2817575.8980 2752484.6920 Raffinose_R1 Raffinose 14908.1300 16305.7791 31283.7809 10205.8436 4757.7822 13651.8214 47276.3805 9189.8844 24977.8207 9514.1601 5618.1051 14493.6518 20312.1233 8041.3841 4370.7531 39796.7942 12869.7884 47037.2649 19113.2043 35774.7581 15081.4395 28410.5411 19707.4214 13201.4864 14859.6023 24644.2034 17740.8904 6520.8045 16467.5340 11816.1074 11706.4703 10401.1487 7820.5042 15802.7089 10288.9244 18128.5479 10837.2041 22374.3626 7473.0716 26798.9433 7832.9878 13933.9144 24270.6318 10598.8723 12488.5229 5839.2506 27777.9473 4792.5680 9774.2755 14345.0478 9928.1605 8910.3272 12169.1332 8595.9522 18266.6277 9924.7570 44294.8545 7005.4712 8460.5516 13727.6674 12850.5305 3738.2264 7883.3809 9335.7049 27149.9550 9105.8673 27303.9550 7180.0926 18399.1662 5710.4577 9481.8207 11925.8685 18781.7209 9795.4487 24774.9434 46272.0408 47670.6639 11486.5687 7045.2888 19714.6243 10487.3493 11905.6496 35533.6332 12328.2567 15475.5716 6805.2243 31619.0594 22333.2171 9698.7470 6566.9200 9355.7607 33926.5833 18892.5928 6538.9977 7260.0574 17207.2288 15813.0538 6141.1827 8886.0779 10768.4068 13967.7343 15365.3344 35613.9787 6334.1201 4748.6386 9789.8406 9264.5517 5642.2957 7102.9856 15172.9660 4123.2650 7568.7894 5340.9172 4176.1433 13699.3137 12025.5909 5091.4163 4481.6526 6496.2667 7417.9308 15434.7857 14469.2198 12758.4308 15906.4139 13856.5635 13457.9097 10623.7760 16850.5140 14392.6924 4235.7246 14207.5569 6001.6839 8993.0279 15780.8497 14197.6857 13632.5822 8861.6321 8424.0397 Raffinose_R2 Raffinose 22513.4206 14562.9724 30371.9368 6396.3580 15336.4329 12055.6480 34425.2841 5908.0067 10551.1763 11959.4629 19292.1426 3521.9945 14960.4529 11690.3211 26806.0323 7462.6577 7805.2709 10826.3948 33625.9043 8471.0593 44423.4187 17590.3612 30052.1760 5694.3015 21529.2282 24241.3249 7477.9993 10958.4282 10500.8378 20989.4116 21947.1648 9528.0901 23316.9718 4654.4296 8611.1434 6254.6087 5758.6219 16129.4956 9261.1614 16929.0406 8143.8015 29822.7512 6964.5153 24158.1511 17632.8088 13213.7677 2088.4988 3820.7626 9972.4789 7876.2740 1764.1654 7320.9067 14574.7003 7019.4806 38353.0561 13168.2882 12849.4922 11446.8468 11266.3165 6187.5826 13946.4908 9380.3791 4392.7064 7197.3953 13429.5859 19251.5045 14561.5930 38175.6540 38493.0124 4919.4462 17825.5497 2213.0585 12704.6765 8361.9695 7696.3410 20674.8419 6328.2406 28126.6586 11769.3303 2334.4683 32704.9296 9085.0290 16315.7248 10558.4877 11724.6731 18253.7336 4692.9009 17534.8212 7122.9928 20525.0896 9484.7273 51112.2838 6552.5195 41384.4175 3255.6003 9642.2158 7260.8300 12471.0643 7023.1151 9085.2227 56989.2518 10743.3810 11650.8824 7932.1027 50300.5416 19359.4598 17594.2558 11806.8876 6140.9567 21052.4628 30245.4573 11518.9542 20979.0033 10176.0208 9773.8262 8739.6268 3551.8568 5206.5307 29843.8032 8968.5276 8308.9686 6114.8251 4570.8190 9278.2981 10571.6724 33531.2642 8100.7386 6701.6048 6292.0267 5925.5675 5026.2932 6022.0355 7122.5872 3741.7424 5293.9306 7077.5304 5757.3033 5389.4590 10975.7075 9796.8713 10765.9400 11177.1632 11636.7636 15436.8029 11767.2687 13811.6358 9255.7318 9476.0391 11420.2039 13582.6492 13993.8343 11701.8412 10809.3594 9992.8381 8810.7714 10624.8228 8243.1858 9449.2588 7501.7641 9361.4218 11063.0300 11787.5157 9845.0278 15379.5118 17406.7500 12783.8360 14947.8029 12905.2357 12688.7791 13676.4080 Riboflavin_R1 Riboflavin 250809.4758 216252.9967 461401.1554 3855679.8350 122597.9092 2448500.8760 26489.1670 1197194.2380 676666.6354 2381140.9450 647887.0701 649528.4644 2526719.8780 133818.4148 265360.6183 757044.8335 99382.5508 121726.9460 958240.8954 761333.0558 71554.7812 236920.2978 2236253.7560 860846.8120 46463.3075 60666.1032 762846.9685 94771.1074 422901.2166 269711.8737 607778.5473 72454.1751 86237.4569 94808.8865 75514.1461 122252.9920 679785.5392 435375.4071 48472.6313 269294.0062 484843.4623 101465.8044 242062.7098 559428.3137 106727.9501 780892.7959 176695.1682 573112.4528 284843.0417 333429.2758 1313435.1830 81091.9660 180376.9952 343002.7813 750161.6483 79313.8458 181851.1439 155618.9987 1035431.5040 452727.6884 619273.9899 556617.5645 53690.9259 17744.1325 349197.2616 148747.2170 348845.9720 67931.8324 69401.6864 1809213.8830 324724.8475 1379664.4200 136703.6363 513220.2068 169565.2643 52276.4743 1080192.9050 63708.5289 356794.6644 73632.4125 141910.4255 502464.7991 2408545.4740 3100216.4730 348856.7643 222148.1875 240208.4933 1022087.5100 759085.3458 468913.7096 372127.8948 708306.6373 420606.2321 912642.1344 1405415.9660 963247.2442 95388.0648 521151.8947 386079.4013 1684010.8130 267865.5630 2408215.5140 75938.9817 83752.3682 444164.6280 763819.3972 64560.6593 2830620.8470 365390.0785 1798305.1880 299658.4384 81116.7104 221210.2625 305056.1095 501281.6524 683307.3946 476886.2847 618245.0567 2446048.9130 271639.5520 68647.2219 630329.2100 354435.1478 128295.9337 1250739.9690 382870.8031 2333662.0690 21611.9032 572867.6557 198445.5786 104797.6443 274992.0906 1542275.6290 134602.4856 982294.3363 1853392.0810 254957.3324 222923.4064 899544.1933 271761.9692 57200.8951 921920.6690 302453.5818 265384.7876 2033242.3510 751378.7411 735746.9053 174930.4437 381790.7620 118213.3400 75099.9376 211089.5635 345520.6396 134132.6116 56960.1030 626349.4030 102717.1057 330928.0321 114479.4698 870443.8631 142016.9220 35111.3821 429193.2366 256807.2641 3108114.0100 282301.3495 271859.7222 274407.1263 241653.3974 163498.1115 148723.8505 211601.6424 189476.5155 190595.1469 192660.4384 150407.1261 146014.6866 244039.8986 226708.9048 186288.9348 165143.3001 167880.0357 140726.0888 157135.3026 157756.5978 155072.0377 124568.8852 132649.4584 132134.6937 128243.1193 790519.2921 798838.9053 804374.7145 883691.8704 893378.4433 936753.3586 82487.8628 134347.5419 95356.2014 682224.0601 726799.8745 612655.5281 677651.8554 654812.3242 789385.2303 70941.6403 134560.5989 135262.5344 684220.1679 702217.2035 656110.0041 727836.3811 688138.0647 702358.7074 Riboflavin_R2 Riboflavin 240942.3077 202551.5523 486181.1006 3739828.5680 115045.9733 2358582.1900 38196.7666 1152427.7090 637559.9202 2297395.3330 629724.6567 623265.5378 2443165.1030 129491.1306 290904.1873 732748.6810 111138.7802 145567.6635 925639.0458 714558.5099 61492.0345 264820.2639 2174306.4430 831402.4737 92634.9848 55687.1723 735104.1565 86031.5875 408648.1313 315747.3364 587371.4116 96442.9542 87543.4894 119393.3968 137851.4910 111636.0833 651251.2972 419595.8273 57266.6345 260655.5568 462677.2800 99868.4558 227188.9027 539493.6817 106913.2835 746713.6124 175128.0287 556798.7151 317172.1840 308674.0821 1273073.0830 80677.3167 199897.6627 340340.6261 726259.8683 75471.1899 164873.3718 149482.6099 1007028.9510 434588.9635 601599.2595 534648.8004 46639.3367 21498.3942 333100.5899 142669.1373 329137.4707 66168.6098 126754.5178 1732838.1510 307603.8449 1329909.7440 132327.5245 486974.7377 165724.7902 61862.6139 1045279.8500 58398.5731 353459.6310 86223.1208 128508.4430 483597.0950 2313322.4640 2985840.5660 342038.0951 217040.3346 229083.9757 979103.6881 746838.4302 461605.3492 360584.8856 702600.9893 410823.1075 880945.1822 1349766.8100 949251.4187 129320.4841 498385.0947 383411.5911 1627379.0460 253964.3660 2337119.1270 75824.3960 92104.0406 428789.2258 733239.1523 62278.2608 2730008.6310 352751.1933 1732582.2460 288201.7890 96798.4078 230930.7286 292593.5438 475253.1145 655402.6012 469013.5213 598826.3972 2350237.1490 262730.1741 77270.2177 604650.8148 332436.5417 153052.7982 1195906.5860 366509.2070 2236009.1670 44070.6051 546771.5224 185036.4712 99297.0279 269841.0119 1481089.6620 129794.6262 934355.2732 1769569.2010 236180.5269 216268.8195 867292.7261 258127.8657 64946.0982 878171.3876 291062.9080 276830.1769 1972171.1780 722428.6853 715974.6624 190964.4450 357519.5214 119739.7453 106861.7553 190127.7538 329055.1150 128250.3097 50273.5878 595037.0402 107792.4066 321606.3447 132648.2272 842902.7137 136997.1107 50745.4995 438477.5851 251349.5361 2993727.2580 282540.2282 273535.8240 271361.5576 237301.8844 174709.6250 151118.6986 222196.1192 198773.5258 194614.1129 181982.9561 151505.5684 156048.4869 245572.4101 227218.8645 192162.1997 167235.2903 168345.1157 158505.9145 165984.9571 142286.4274 140376.7365 130089.2977 130444.3446 132351.0995 133128.1105 774556.8482 779263.1465 792088.7955 853983.7882 870754.0798 913344.0359 109252.0237 135497.6409 122131.8828 656665.8326 694446.8098 599182.6248 649875.5528 626678.7085 757728.6462 103341.3640 159166.5939 156374.8913 665612.7951 307530.5329 634599.2131 703854.7937 660134.3749 672797.1587 S-Adenosylhomocysteine_R1 S-Adenosylhomocysteine 4864.9512 7430.2887 5105.8123 10986.1200 4293.0185 6861.3148 4809.6935 8557.7074 3941.1254 5993.2698 3917.4553 6275.3973 8122.8573 11643.0825 6407.4496 3551.8382 5908.2530 7826.1586 6436.3530 4960.3885 9609.2661 5131.3182 6850.9147 7190.9779 7736.5793 7774.4251 3708.0997 8419.4451 5072.0173 3014.0897 4242.8264 5032.9695 9851.8453 3519.5668 13635.2171 6395.8585 3383.9697 3567.5706 8695.1850 8815.2401 4845.8414 4762.0975 7320.1793 7626.7788 9346.5347 3983.9604 4366.5178 4806.1803 5093.6825 10093.2255 8397.3827 7695.2641 4495.8904 5145.8844 5163.8828 5809.2902 6351.5224 4065.7879 6107.9841 7957.8887 4856.8825 6002.4154 8526.7751 12062.1258 5460.6802 7095.6786 6232.4637 2568.8849 8258.4940 4109.8613 8023.7537 9556.2124 4927.6079 5001.8123 4871.7217 11009.7733 8119.6449 5197.5107 6317.8527 9849.9179 8936.1405 5033.3410 7868.2081 5528.5703 8662.5598 5741.0607 6251.4236 6782.5201 6932.0249 6000.1750 7123.5835 5788.5987 12802.6894 8557.2575 7802.3342 4630.6200 7727.3399 7547.8220 3426.6580 8930.0519 4328.1903 6338.0875 8598.9640 5472.7945 7221.5786 5431.8203 6842.1854 5014.4234 8370.5693 7493.6933 6111.3484 3847.1486 4503.5278 6894.0255 5138.1288 3637.7817 4788.6786 8306.9604 5441.7316 7688.4240 7693.9122 5923.0638 5204.3363 5423.1639 6076.7344 5541.4258 5878.9826 6104.0192 5595.5025 9466.0620 7942.8596 3555.3572 4254.5803 6660.2001 5488.3732 6766.2832 4666.7889 5502.1767 11708.9782 5083.5101 10641.2031 6057.5456 5512.3308 8518.4399 12684.5687 4809.7890 11833.5925 12838.2176 13519.6766 10447.7043 11722.5865 12625.0540 12190.8835 12160.1413 10659.4795 7055.6652 5877.3764 7223.8406 5567.4840 6107.3569 4774.3377 3838.6651 3168.6140 6280.3397 5632.9471 6994.8949 5984.3720 5085.9439 5413.8046 3327.0267 3891.4670 4769.5925 7636.1698 6705.3099 7033.1015 6323.8575 7122.4455 6313.3303 S-Adenosylhomocysteine_R2 S-Adenosylhomocysteine 3725.2725 5350.5754 3108.3749 6764.8148 4691.8677 3522.6266 6434.6328 2704.0833 4175.0617 2992.3295 4299.2861 5038.9478 8010.6539 2091.2477 3712.6430 1744.3217 2347.4138 3804.2759 5201.8794 4726.7100 2406.4731 6177.8522 3620.7769 2694.4568 4536.7961 3645.3313 4731.8425 5815.2166 2301.5890 5421.3492 1727.6104 3314.9116 1520.7191 2114.7556 3004.9390 3260.1557 6164.4696 9105.7192 4170.1421 2353.5324 5768.6148 1382.6826 5953.4959 2308.7830 3156.4263 1570.2747 4825.4739 5070.3445 6668.8308 2031.5261 2421.2222 3128.0346 1609.1571 6541.3551 5113.7083 5203.3392 2938.7363 3116.6220 3610.1136 4416.1630 2734.2274 3529.7708 5492.0813 3444.9776 2036.6819 3296.9175 3045.5657 6325.2027 8575.3011 3044.3247 4096.4529 3294.6860 5781.4467 5544.9034 5872.3304 2601.9089 3868.7264 7295.9864 5293.5427 2754.2189 4160.9409 6011.6228 6017.0953 3900.4572 4942.6722 4069.7789 5959.2985 2786.4560 3412.4475 1799.6089 4531.9642 4405.8251 3820.8733 1959.0021 5781.2594 3806.3751 8133.9546 6579.7851 4873.1997 2918.8465 5645.7325 5077.0879 2126.0816 2165.5243 2273.9536 6130.5210 2426.6331 4823.6684 5918.8873 3939.7203 5026.2914 2365.7267 3791.4124 5017.0304 3543.4059 6462.8641 4885.9378 2053.5889 2558.2471 3700.4327 3410.6017 2467.9763 3150.3991 3399.3702 5078.6210 3160.3137 5322.5380 4960.5044 4136.8419 2685.8373 4421.7878 3673.1621 3866.8367 3888.9383 3396.3566 5738.2146 5323.7729 1249.4140 2720.5809 4096.5639 3774.5263 4844.4589 2941.3541 3817.9357 7403.3360 2478.8918 6835.2780 4706.5877 4897.4834 8761.1645 3535.4812 9138.9131 9106.6844 9667.4993 6753.8231 8005.7755 8842.2324 7827.0932 7500.9067 7944.4689 5168.8410 4013.5628 5629.9569 3953.2058 3753.5394 3388.5557 2391.8819 1432.8158 4766.1052 5174.9434 4118.9403 3818.5911 4104.2246 3770.5217 4524.7685 4206.5778 4852.3605 3570.2599 Sarcosine Sarcosine 36413.6654 429970.3841 49596.3115 697645.5943 225624.2346 151123.6916 483752.3383 892347.7266 358188.4508 1008035.8030 683005.8556 495992.0201 305749.3878 416215.3359 654831.9769 493242.4057 283365.1731 174277.9261 321151.8046 304644.0844 35993.3759 402213.5411 936616.9439 188052.6423 23885.2980 672475.3127 258502.7697 38837.9310 737952.7441 603376.4376 64206.1036 481650.0723 237885.9971 745362.3701 147637.9148 453858.8923 248865.1099 431232.7108 77868.1283 37291.8083 706996.8754 395832.8752 15093.3818 382384.8687 846548.2094 215303.0290 245689.7439 94389.2815 461782.0160 550605.0777 738092.0955 37765.0177 362051.8451 72077.7846 37702.6149 112670.3443 308148.6776 285193.6890 277434.7427 755185.5739 198519.8859 418187.5666 70702.2073 131633.6053 73926.2188 115231.1476 518780.7408 35337.6753 80638.9491 45046.5437 567171.5388 169071.6741 717760.9103 387534.3190 655227.1209 438079.5370 704386.5914 446993.9233 111600.4038 175133.0822 481429.7839 10282.3851 274747.4082 468675.2666 459674.3923 701956.3791 290608.9396 109351.7145 254438.4332 55365.7127 593905.3353 167114.9323 75207.9671 76465.5487 603407.5339 433449.3918 479738.2500 50080.9211 538558.1626 1042930.0790 50192.2382 405863.6581 41364.5633 30135.1464 425888.7007 452196.2375 15566.9239 1034710.6840 829446.1292 247043.7707 310981.7748 520130.9615 482195.4830 406989.3535 137233.7954 745177.5309 30331.6666 78018.9183 28270.3828 854275.2884 12551.2220 340578.3182 277979.4350 854481.8458 762818.3787 68897.3592 22996.8417 343916.4307 463978.6240 610098.1397 200025.8983 384915.4091 112187.9202 542303.2867 413849.4630 81479.9679 219838.9505 272764.0876 272243.1639 49400.8939 64554.6407 481293.0884 60983.4974 51786.3745 572765.9927 353566.5477 251609.1831 83330.9290 939827.2822 256534.0873 658133.8170 133714.6869 284867.1642 110803.6295 35151.8333 445223.1653 451437.0623 245398.8959 821586.7061 696093.2886 533668.5999 1086140.7600 165834.6924 631613.8478 743214.4776 458598.4885 474039.4092 457598.3036 489766.8423 424159.2222 390745.5086 510910.3568 489806.8115 530000.6868 498092.3123 436392.8074 495254.6818 575612.1908 519231.6125 455681.0055 385607.9147 95725.1366 87788.1416 91473.9547 95433.6380 93930.6252 90743.8974 88877.7891 78947.8119 62070.6319 379788.7729 382242.4893 413082.9145 381706.6335 390863.1217 378659.4390 387381.1939 338034.2057 345897.3240 458727.6387 495283.2967 481649.9850 458800.9627 450622.7497 451385.4996 455312.0436 455775.8454 507037.4188 491390.7089 462928.7220 455348.8897 431141.1995 406810.1704 351363.7837 S-Carboxymethylcysteine S-Carboxymethyl-cysteine 15048.4345 15173.3626 66187.4120 23747.4119 54298.1398 19023.9891 88633.4053 13627.5618 19865.9244 69023.2634 10474.7843 15075.2481 15274.2774 11036.7596 33640.8704 16466.0666 33649.0317 14229.5233 19433.0757 17039.4801 137747.0748 12136.7653 23560.4355 62410.2220 12429.3424 42778.6314 35904.5678 158492.3458 108970.1074 31463.7202 112772.8574 29494.9712 13776.4440 19564.5286 11243.0905 11781.1413 14079.1194 25400.4697 10828.6685 26050.3764 42465.8176 11112.4876 10118.8857 17168.5892 5841.7343 13341.0089 21373.6852 6215.4998 20253.2576 11374.1590 19152.1668 159120.3653 22977.0986 23034.2923 16127.9223 16102.9336 12924.8451 29619.0238 23862.4832 40727.2955 13323.3229 11792.9317 38779.5584 25007.0632 18912.6809 80187.9434 12806.3116 14951.8847 12574.2060 19780.3147 19664.4875 19796.1143 32713.7454 86209.8089 17182.0252 44895.0499 16053.7088 350851.9901 25016.0643 14530.0818 7208.1374 10384.6219 9023.0891 14780.0819 11204.8706 44034.6787 18473.8987 16117.5040 13416.0873 10881.7281 18924.5781 14196.2097 21129.8266 17606.6643 21234.4109 16763.1826 19405.0302 91006.3443 17907.1871 10655.1969 10088.5061 10868.5791 12451.9921 13213.4585 76066.8900 33985.8438 9566.7263 74020.5142 14217.5372 22457.9041 32792.0395 35782.0544 6682.3772 83280.4027 32426.6411 8420.7871 19349.4106 27813.0028 12428.4421 12063.7768 23200.5896 39962.9579 11813.7811 162873.2733 16883.0886 13269.7715 8868.4869 18058.2238 12710.9857 268682.3605 8748.6239 13465.4590 21738.0935 43414.0553 12904.7419 69505.9333 8218.3267 19029.3887 13350.1017 55650.6027 21019.1978 13846.0304 19859.5992 23227.0271 43558.6855 14038.2184 12629.8072 37600.3899 13969.4660 107940.0071 13649.0348 11616.5930 15161.2048 82013.7669 120415.3553 17304.7145 15722.5522 46753.4769 20406.6595 18855.4402 68200.6981 27936.9662 14835.4682 12703.7892 16801.6756 63180.9530 57881.9064 54913.5488 69463.2068 53496.6828 47930.3544 45465.7912 44360.2161 51954.9179 55950.4142 51818.4620 53850.7628 49177.1209 48537.7762 43230.5131 40082.2615 117534.4039 107759.8926 111916.8023 83428.9283 90294.7362 90784.9068 91907.8710 96597.6014 102474.8237 33784.0934 34519.4452 36745.2090 37599.1793 35242.5790 36505.2384 37522.1772 39276.1823 36672.8711 31558.6041 30709.4253 32005.9856 32852.3719 30938.5582 32023.6255 35062.1393 40644.1413 38392.1262 34181.6484 34832.2088 31584.0563 31505.9166 24794.6758 24967.0192 Sepiapterin_R1 Sepiapterin 17213.5581 12944.6158 15679.9618 17815.7841 5861.6356 14144.6534 23449.9130 29263.9054 15643.9146 19031.8544 8450.7485 12552.1249 11240.1712 13643.8509 23729.0850 17339.5877 17423.6227 19253.1670 20395.8023 16519.2305 19352.8250 13252.6201 27217.4867 21248.7328 9543.0867 23642.9777 15149.4859 16723.1201 14619.1756 17044.7178 19749.8714 4931.8810 12006.0957 11651.8628 27808.2661 14275.3301 16292.8627 25328.1477 11772.1580 13355.9745 50553.7632 10787.7389 12118.2805 16916.2110 10760.5055 16236.1841 14829.3507 16005.7950 15870.1915 16788.3036 15353.9424 20675.7521 31058.4771 22935.7273 13667.6615 19969.0255 5032.3098 18869.1527 11479.7815 11250.7277 10035.0161 9042.3041 10481.1774 14869.8313 14418.1054 7264.1690 18712.1732 19168.3437 13437.2172 20465.2896 12791.1453 15662.0807 21048.9035 13351.7166 29567.2945 13529.2731 12440.9639 16763.0374 19150.2137 8936.5979 15592.2500 18200.7694 30637.2158 10226.0494 14778.6219 29187.6845 10624.3699 22755.1592 12877.8827 18182.7012 24029.8568 16023.2294 14395.6022 21637.1046 10111.6752 10399.5647 15933.5511 12782.8079 49334.5664 12636.7404 24438.8413 8032.3366 20719.0306 15474.2436 14767.6967 10223.2513 9925.6697 26050.7495 16077.7023 29663.1357 23093.7636 24902.3293 12904.0594 27235.2488 26979.9509 22787.6971 8231.6193 24366.1738 11651.5740 9936.6485 13629.6295 19089.4551 15388.7180 16546.8450 1468.0014 11025.3016 10632.0876 12396.8823 27162.2164 12160.9910 10415.4127 23414.3409 18247.2319 17442.5416 11867.7480 16870.6346 10850.4932 8792.6781 29949.5896 22200.5145 14967.3915 19151.4334 25896.9406 6393.9023 14796.4693 5966.3994 17939.0805 19381.0769 9269.8780 14681.6327 13662.8772 19489.2277 12832.0901 75322.4707 95534.7709 86658.5214 96682.3433 75395.9551 70069.3530 73431.0714 73281.6800 74942.9801 73779.9743 62836.2835 65781.3877 73293.7452 68698.7052 70920.3320 82017.3772 17059.4785 30062.0399 18722.4626 15284.7815 15887.4679 15461.4009 20548.4981 14944.2630 28838.0673 10169.4406 20506.1146 19886.4171 16437.7489 24031.8340 24012.6975 18234.9558 18046.3747 16029.1008 12920.6106 15721.9800 18493.8266 14224.0326 15888.8378 16942.7109 15869.7414 12982.5699 13018.6951 12536.1100 16921.5158 19222.0872 16293.2666 13468.5984 16819.5606 Sepiapterin_R2 Sepiapterin 11665.9577 5666.7805 6633.1776 7330.1934 6450.6088 10219.5401 8308.6354 6537.7865 5717.8919 7627.3317 5160.4375 6943.9493 14403.8883 9691.0772 11102.8560 11363.5160 13212.8603 6226.5188 10576.1549 7171.6078 9980.1148 3928.2243 8817.5808 11926.1989 5798.5221 14609.5938 5263.7790 5667.9244 7623.1539 7220.2157 6253.1770 15383.9435 3733.1771 8487.0964 15839.4500 7308.2102 12919.6629 8317.3006 5964.6984 10148.1470 4218.2727 6004.1653 4339.4887 9680.0923 7496.7231 7713.4576 6987.3509 65637.2764 59710.1636 11861.2508 12736.1713 12240.1143 11890.8258 11871.3841 11473.7605 10220.3882 11013.5128 10092.9287 9040.7547 9763.7503 7366.1578 7341.0286 7466.8212 Succinate_R1 Succinic acid 20678.1064 35195.7562 26213.3524 32758.2687 33061.5454 26643.7167 36899.0080 26933.5275 25188.1194 32488.7346 4351.9715 17885.8867 18250.4767 18069.8202 38699.2537 38804.3660 27240.8496 30375.4361 13871.2686 83677.4195 40198.6033 57713.8655 40115.7705 33636.3077 24051.9126 66651.8865 34752.8436 78844.2634 30777.6741 40447.1263 27263.0994 25185.3188 17363.5990 36731.3676 24922.3392 43294.6747 30705.0882 24863.5917 16334.8315 74538.2795 26761.7905 26245.1488 21292.3117 18820.1874 18209.1512 50848.2106 44176.6440 17459.2627 40573.9458 50241.9679 35114.9743 81448.4170 34534.4060 19577.5855 40841.2185 39213.7656 73662.7671 61507.8245 35094.4235 23053.5210 59739.3083 38028.9094 39430.1107 25905.1699 17125.2506 24346.9402 34047.3149 24890.4011 23152.3686 42369.4602 31323.8639 41565.3735 49133.5929 23198.1668 54302.0244 56248.7964 29584.3132 38469.9658 56670.2935 15783.7731 15792.7983 48089.6742 23010.0786 17591.5000 29998.1341 69323.8450 65495.4645 26649.4754 29287.2356 73561.0747 64442.1219 36266.7739 57147.5862 38072.3034 42643.1868 20417.4931 32240.0589 29436.2890 39630.3317 17336.4753 60900.6047 44501.9965 24940.7257 36877.1909 32639.1743 35472.9425 63626.5059 51213.6461 26080.3350 53810.5972 33163.2406 17282.5730 22435.9543 22565.0991 46486.8592 22372.3860 25730.2701 39894.4613 17463.0934 39011.3255 27351.6199 36118.0035 30888.2908 44638.3288 63708.0334 40553.3462 18383.9519 37079.6330 14016.7544 40219.2168 62761.9647 36438.9890 26958.4378 44958.4107 24073.1959 26622.9077 20087.6483 48708.8396 17931.4123 18302.0709 39202.1056 19631.4965 66991.1366 45290.3221 43125.5582 70916.0740 33926.1030 29803.9456 21263.5553 33154.9650 33901.0005 33491.6420 29392.0934 21192.0564 37566.2279 22013.2191 32453.5731 69039.2116 32266.5875 45648.1626 11216.3856 24777.3369 36023.3554 36579.6047 18270.4121 34349.4323 30536.8184 35608.7492 29346.2401 20301.1685 28472.1187 23155.8934 26601.8113 29782.0819 29244.9978 18136.7651 22917.1811 25523.1283 23137.9667 22331.7351 22409.8625 34768.3851 22167.7147 31103.3243 24586.4848 25636.7939 28146.1346 21925.1559 17824.7855 17472.9406 36501.6875 37620.3324 37979.0930 41390.5409 46633.4717 39205.6988 32907.0678 27846.8857 28613.9138 47290.5580 52021.4240 32903.2138 44679.5853 40434.1314 45718.2147 40113.8430 30759.8831 38599.8170 38168.6806 30890.2412 28889.9069 26193.6037 23329.8197 28047.0932 Succinate_R2 Succinic acid 27442.3253 33710.8431 23214.4845 35834.5672 33492.7121 30023.3876 38639.5728 27906.3835 18819.5245 28056.4767 15898.2235 12073.4694 16791.4452 15966.0271 34921.8777 39198.7293 24823.5573 30838.1801 5954.7109 50379.1543 39725.8713 50347.7673 40084.9330 28922.8857 26333.9487 56478.5027 32727.2865 79196.2462 32815.6214 38956.3925 24631.3925 26985.8849 17824.6563 33462.8450 24252.8157 41349.8398 27130.4685 26974.7355 14555.8887 71560.1011 25634.7287 21539.2708 15990.0490 11738.5197 10611.1649 49858.6558 40664.0963 19596.7889 36402.2231 26389.6236 34334.7743 77994.3231 34163.7533 19583.4121 44456.6384 37464.0239 75457.7463 54298.7957 33524.1307 24120.2979 58439.1170 35130.3220 37893.0518 21238.7029 17140.8704 23262.8439 31224.5052 24928.3661 19398.0525 40641.2341 28718.6332 40378.5305 44670.8855 23665.0966 50557.6314 57218.9389 28793.1881 25187.8769 53994.7696 15442.4463 15644.8697 49130.1868 23068.2969 14937.4207 33425.7530 63471.5936 57514.5238 27443.8216 24740.2786 72980.1031 63910.2932 36389.8370 40571.3563 32157.0485 40414.1909 18243.0004 32215.7309 29305.9696 33714.4499 12910.2103 54354.8262 36641.8846 21577.3988 37771.7289 24704.1602 42938.4169 60966.5321 26563.0321 29702.1894 53220.6932 33097.9674 18923.7822 14638.3016 25058.1252 51404.7480 18703.1377 25372.7585 39370.7055 15975.4125 36410.8880 25675.1687 33350.3807 17354.2190 37291.4934 64046.7323 29522.6931 19159.8984 37803.3346 12744.5135 39058.8946 66051.9432 35102.8088 16496.9476 44536.6297 23896.7004 29591.3715 19659.7763 43992.8713 23448.2653 14443.3227 32827.1183 17887.4364 55467.9746 43789.7010 39320.9009 16149.7223 29027.4991 17419.2418 21176.1343 32951.7886 32370.3385 28969.9102 17489.8102 19057.4649 35770.4301 21296.9301 21060.1788 56775.8163 20612.1189 44144.1243 11602.4227 27827.2846 36844.0679 37707.4587 17126.1413 27428.9125 23102.7264 28982.4261 29045.1971 24587.0027 19770.4902 24336.5650 24331.8494 26570.0963 28053.6541 19386.5663 20616.2436 23005.6709 22047.7216 16371.0052 19683.9042 33543.7885 25634.5574 29263.0825 27720.0160 28940.3108 28998.0875 15986.5407 19481.6192 20176.5273 34596.9194 35315.2190 32072.0905 36229.0048 38672.8801 36344.3014 30021.8957 26811.2172 23622.2296 41562.2317 46678.5398 33930.6431 40084.4077 37230.9104 40722.3061 36453.0369 30667.9549 38352.8281 32022.3202 28833.5852 29011.0026 28472.5022 24981.8917 24339.1861 Sucrose Sucrose 196981.2063 34494.8097 145071.8045 240871.6899 69579.4830 135020.6041 261366.4463 78069.9165 304387.9780 155994.2572 39604.2956 174931.8006 147865.5600 55756.0431 129785.5211 330586.6134 214089.6037 167913.8002 81243.3756 102690.6398 301678.4770 389110.9574 168455.8459 602642.5618 174939.2148 290846.6246 286487.0345 24455.8939 310194.6875 101835.4473 261546.9623 338409.1465 179676.2150 195440.4872 217749.5484 45011.6388 214820.7659 52168.1688 249444.1402 207987.3642 103002.6350 31116.7174 341408.3929 142653.8082 51255.7344 130668.3482 357155.0041 221833.6766 229922.1514 116709.9917 318997.5438 30640.9914 152198.9346 746441.4133 162226.9670 71406.3030 232993.1839 66671.4863 531628.0939 329876.5520 139392.9936 95297.8573 109364.6795 449679.6780 81857.7928 41743.4663 269840.6411 61992.6303 244020.1849 126640.7039 114276.7726 198797.2335 122387.2791 211363.0911 22322.4857 63950.9593 124382.2967 159472.0203 152087.4795 376103.9598 144126.4671 263359.8924 306935.4146 270051.7360 166746.1411 232660.7010 120809.3133 205690.5837 307470.6065 298603.2695 116652.9155 141681.3993 107178.0700 59415.1098 147659.6077 558985.2028 110955.3606 86020.0887 55635.1124 233460.4615 37540.9241 382153.0182 127731.2119 20436.7864 248262.8281 180465.5194 518813.6960 150695.7481 258976.9747 159883.5662 78975.9902 157861.7920 76317.7640 216660.4271 174829.4717 41792.6859 205017.4894 246262.2996 267753.2871 69732.8072 276634.0858 135973.5434 134314.1239 139194.7616 62170.6530 139609.3460 258394.0903 98183.9219 169300.1982 133015.9723 24386.7550 50162.0943 152507.4423 154954.8984 183588.3800 208922.3721 287240.7675 115438.0344 204101.1896 209698.5257 119468.2603 569049.9680 220501.6342 105790.0705 224468.9366 245458.4371 321023.5899 118216.8030 142353.8441 36399.9192 307922.5004 386552.8986 125210.3953 36683.4475 251964.9028 108216.4377 111798.6726 53662.7976 166240.7914 152426.2786 324528.6749 39866.3238 176865.2035 16204.8593 441978.4662 141547.3344 139937.1454 172086.5761 174077.9005 129561.8676 124286.6006 149605.7343 135431.0195 149975.1480 148696.5112 132169.7153 138474.8196 146261.3651 135179.0825 140185.4122 133756.7681 171793.8497 159743.9294 167853.5308 142682.0253 166958.3287 146325.2577 144622.4703 139518.8717 140740.3141 306474.2828 326444.1116 287537.6251 439334.1789 277509.5644 279946.8452 222034.1837 181203.5631 195774.7010 169553.3327 182114.7565 157077.0020 151388.9254 256194.8022 161084.5501 187405.0637 142656.2917 151577.7516 217354.8894 215377.4637 160673.5067 179646.7005 156740.1486 162418.5792 Sucrose / Trehalose 173115.6753 31012.8636 134891.4869 300498.6138 57799.6791 118772.8690 282045.8153 354973.3773 137635.7575 34998.5760 160539.4403 136405.4157 47655.2703 110936.1152 400430.2998 249617.3979 150517.6102 75250.3033 93380.0169 273237.1379 362235.6291 139147.2417 565019.9178 155972.2323 284253.9138 260415.2597 18958.3087 271679.5908 236068.8746 302261.5282 167963.4068 179201.4389 204098.4283 37269.4382 205413.9494 42002.7481 237446.0385 190440.1546 328578.0774 221190.3996 43427.3459 133558.8009 328583.1036 230508.8694 351363.0442 165577.7849 302630.7134 19620.0191 134918.7295 694545.4893 148939.1294 66558.1860 194410.1889 62159.9425 605226.3122 336570.4100 122467.3991 84290.4236 96205.1361 420785.2298 74344.8546 28736.0527 309370.4837 50548.1419 223760.5157 106502.6881 213343.4297 112091.9860 192550.2706 15126.7271 53464.6836 115056.4995 149092.4938 510990.1158 124723.7202 239543.5315 285030.9379 258366.2341 156498.5606 216034.5740 101645.7883 291639.9888 107955.2594 137235.9720 105883.6234 49155.7402 123524.2785 536569.2837 100870.1926 75596.6771 46166.9951 212898.6474 28427.2484 352653.6893 114017.8856 16178.2938 274213.0745 172850.2288 568733.9238 132964.7340 314488.8195 142595.2463 65888.5113 139987.0789 70418.4341 206386.1932 148009.9831 182672.0415 232544.0291 250228.4870 63503.6921 254276.0952 121537.0360 120184.0810 125324.6150 49165.9461 151735.7175 242073.2648 126289.4507 158318.2575 124430.4937 43582.0653 142377.3217 143026.6031 173303.8917 243214.4921 273440.9605 98450.7049 186740.6786 234754.6082 115875.3492 548419.2513 202681.5448 95250.1767 283791.9489 221352.5688 304935.5545 129395.8903 233121.1089 31619.6804 290616.2348 457872.2057 115875.5607 29034.1055 226245.6353 94626.8090 110880.9983 46179.3113 153385.9082 158154.4509 312057.1114 29232.4336 231594.1279 410668.6094 131679.0517 126648.2642 154702.6632 163441.3828 119234.1766 110505.1583 133983.8776 141853.4920 240941.7666 132833.1018 117528.7056 125076.6395 134146.1975 126820.7807 127591.9144 122999.8178 34787.1354 35124.8623 38142.0004 13424.6539 17694.5118 18807.6241 54170.0125 59560.4791 64588.9390 46558.0213 55038.9221 56659.1346 57856.3865 70923.7780 72832.3377 50283.8595 58576.7420 69133.9586 162042.4158 149231.3546 155119.1002 138541.1921 161904.4827 137471.8165 181818.3517 132208.1487 134016.4050 292734.9490 501698.3727 269249.6978 655947.5290 258150.3667 427469.4271 205605.1110 168843.3961 181485.5709 163707.6890 167382.0701 144092.2096 135680.0581 247086.0342 151344.6088 176599.8205 135252.9654 141224.6973 202776.6267 300184.2329 155949.4021 167811.6781 148255.8383 155148.5985 Taurine_R1 Taurine 2971098.0920 2239545.4110 1925340.7190 5760521.1650 4268889.0760 5976045.5780 315019.2370 4730826.2360 3081219.0280 3770879.6000 3503309.5160 778596.5487 3900989.0860 2326683.4370 2929077.8760 3305755.7840 4430632.0210 3650273.6660 2514036.6470 4697048.3250 5482705.1120 2568414.9000 9397779.1570 2149718.6500 2235410.1660 1191589.5120 388644.6522 5530069.6760 2440356.7700 6814025.5290 3784458.5150 334195.7558 2777750.5000 2587811.1550 1751332.5080 2646740.3350 201395.3817 2686682.8920 227790.0010 923379.2396 4505831.5830 3462840.1360 798757.6923 6016853.7150 2541223.5460 1274173.0110 623029.7120 1966737.2250 4552145.5990 3089666.3180 2487230.3020 5977913.4510 3145771.8830 757994.4623 1317192.0540 3508629.3570 6127143.9010 2427992.4510 444465.2263 2325175.0490 1992789.9450 3324369.0110 3907613.0420 3713991.5140 2229362.0290 3793881.4530 2267354.7600 6146053.3750 2786933.2400 3116066.8880 2796133.3360 5064095.0970 2300799.0330 1222135.7310 9390509.0590 1968840.2750 3920757.7620 3210423.9020 3659955.0180 2490262.1390 2412991.8890 1902790.5110 3226052.3730 3884045.8390 3733898.2410 1255396.5510 10586984.4200 3076608.8480 2561932.5230 5303894.4000 2547618.7670 1172141.7980 1568907.9040 2824588.0560 6829548.4840 1241279.0380 2892454.8390 3635759.2130 5527470.6870 3946511.9400 4949353.0220 3492421.6740 2486681.6000 7032321.7940 1245651.1140 3836467.1140 1528276.5500 4754767.2040 2239999.4990 4799420.2930 2225393.4410 1079370.0150 1949298.6800 2276927.7230 3280023.1360 3580302.0750 2234353.0620 2527020.1020 3274657.1860 3082962.4570 2417364.5070 2666849.9180 2700411.5670 3940539.6740 2762288.0970 3232480.8860 2987847.4770 2605602.7890 625741.3072 2202640.1510 2849087.9270 2676156.3630 3817386.4000 2672647.2570 2214382.9150 2662666.0950 1431493.0500 10601526.6600 1972814.9800 1623625.8520 1341362.8750 1138794.8980 2146133.3240 909090.2312 4481873.8840 2008423.1410 2771993.7640 3192397.4570 1862303.5780 2432354.8480 1101025.5910 3200185.1430 2875768.7040 3773550.0110 5425884.0120 2676638.1050 4374859.3190 688345.8627 1870894.1310 4499844.8770 4021896.8190 3497424.5400 3829915.8940 4132407.6410 2822964.9860 4587601.5020 4469167.6930 4654840.7550 4415411.8470 3824914.2250 3881494.5340 3878330.7330 3759932.2190 3361482.3440 3354263.5920 3112391.8820 3117497.3250 4141045.1330 3802652.1500 3689511.3650 3403484.7330 3817900.1140 3679749.8400 3814969.3750 3162300.8870 3361461.2000 3153517.3570 3051047.0120 3108794.9510 3237248.7040 3671204.6120 3612236.4020 3639116.1980 3533776.1540 3487754.8230 3450897.3560 3223533.9790 3086991.0300 3140876.8370 3447965.1580 3410182.4890 3132190.3150 3076882.0160 2726815.1740 2952357.0680 2810745.7120 2975563.0710 3006576.9440 3391319.6140 3345428.8200 3273655.9210 3244519.0950 3082500.0700 3073088.5390 Taurine_R2 Taurine 13860.3955 12826.5931 11728.0588 16677.4349 20225.2961 18431.5929 5036.5323 16617.2735 14123.4342 15917.5768 15299.3431 7211.2101 13800.7127 12692.2586 13818.7388 13166.2257 17010.1279 14896.4182 13050.5564 15921.0527 19122.2236 14088.5102 19843.5923 15467.8290 12519.8315 9019.5656 6009.8405 17998.8449 11264.8095 18707.0032 14829.5696 3197.5426 13471.4468 14604.8257 13712.1181 15008.4804 3157.0493 12705.8152 5581.1169 7907.8161 16753.9675 15137.9051 12010.8120 15187.6832 12794.6122 11721.5723 7433.7727 14875.1292 13523.3165 13813.8510 14534.6254 17260.6646 13100.6567 7285.6145 13504.8144 15692.8300 16679.9127 13426.9865 7750.8324 13539.9689 15919.4043 15221.5275 14785.9688 16529.6656 13661.5575 16002.7289 11750.6870 20393.9552 15234.1897 12346.4139 17349.5943 15629.5363 12450.6340 10429.9507 21631.4520 11353.6267 15646.6444 15683.6925 13583.4422 14619.6064 11464.3237 11329.4449 14902.3495 17707.1641 18556.9466 6694.4877 19570.6820 16099.8628 14900.3314 16734.8888 13703.5079 14098.5546 10452.9802 14768.7823 19273.0188 11898.1085 17367.0339 15917.4133 17553.8052 15538.9724 17700.1930 15367.5056 16077.0147 18869.4947 11333.4618 14076.6696 7072.5706 16253.6410 12102.5469 17568.5655 12595.6465 9584.8931 12800.2034 15023.1954 12280.2546 16595.8952 14578.7309 14469.5223 13795.1204 15578.9425 16527.9882 13653.1638 13487.1447 15089.9276 13462.8691 14467.7480 14163.6840 16457.6309 7733.8580 12172.2164 16518.8287 13898.2187 18104.9476 14201.9056 9711.0309 15246.8391 13112.6135 20198.0171 12287.9508 9448.5871 10115.2979 10991.4578 13286.9210 9703.1505 17207.1205 8491.8514 15370.5927 14325.6434 11980.0902 13717.9895 7105.2650 18358.5354 12719.6564 16312.0371 16712.1561 10889.3893 16332.6194 5399.8776 9311.9640 16056.9802 15660.7773 18411.9168 15523.0516 15284.4733 11642.6996 14743.3349 14124.1944 15185.6489 15615.9163 12081.2852 13580.1823 13624.5453 12074.3243 15451.8079 14768.6149 14029.7110 15434.1288 14973.5277 14443.8973 13205.9332 11431.6074 13965.7401 13294.0112 12407.2160 12597.9854 12334.2671 12036.6410 12992.7727 13006.5971 13977.0309 15717.1063 14052.2535 14764.8141 16867.4418 13674.2653 14755.0658 13907.4992 13202.6038 15243.8919 13633.1313 13900.6757 12886.7690 14157.8110 16357.0023 13836.4301 14882.4565 13895.2264 14381.5327 15325.8603 15059.5547 12597.1938 12524.8207 9949.7843 12809.0790 Thiopurine S-Methylether 6-Methylthiopurine 4041.0845 2348.1654 3090.8051 1636.9086 1739.5756 1307.8334 2149.7588 1604.1128 3425.4018 895.4528 3138.6487 839.3509 4605.9961 3745.5937 3488.9477 2277.6977 1250.5104 888.3904 2437.2814 2497.3301 2652.0331 2207.0889 1581.5444 2755.7699 192.3223 2160.4920 3352.9716 541.7718 1206.5269 1621.4639 1846.7997 3883.2999 3677.4682 2282.7706 1977.6701 1148.4985 652.7675 2079.4153 917.0604 4505.9722 832.4530 2023.9362 1341.4787 267.7913 2860.7551 2249.7098 4291.1066 1736.7873 646.6307 1199.6166 1530.4786 6350.6290 778.3216 5559.2256 1795.4244 959.8096 2983.0240 1559.0294 2602.0964 3593.7408 2655.0929 2388.3905 1507.9915 2566.6544 1294.7162 1644.3886 2251.1806 2047.1252 617.5379 2810.8912 1529.9397 1636.6658 2523.9789 1655.7071 3251.5319 748.4897 1583.3047 2319.7599 1719.2408 2966.3345 1717.2631 2046.9536 1415.6629 1347.1196 2071.2693 2296.4715 2057.9341 2732.9387 1848.1322 1786.5015 2282.0133 1832.7515 2336.4216 1842.6825 1458.3638 1431.0641 1585.3838 Thymine_R1 Thymine 10662.2125 14784.2755 7149.1355 17063.4826 9533.3072 13590.0885 15390.1282 14377.3713 5647.4335 9654.7348 30181.1284 1545.2498 6772.5414 6626.1266 11764.8405 4237.2734 11019.1562 19040.6103 12025.3353 26291.2126 17652.8536 11234.8242 12032.2769 9575.3003 7947.8601 17460.4841 20855.8683 13515.0837 8907.8767 11624.3419 11072.3229 20199.1403 2772.9064 12686.5209 6588.9659 37260.1096 7363.9650 15709.5117 4883.4554 29209.0295 9448.8427 16854.2215 2751.3807 7525.9162 13311.5106 15338.9664 10706.5730 8264.1197 12698.0186 15171.4143 11403.0482 3581.3131 19939.5853 10860.6879 21230.9178 8763.8300 22603.0026 13812.3443 6828.8460 18755.8878 26803.4119 5771.2932 3672.2297 11346.2314 7562.4277 12635.3266 10046.9532 9429.4139 3519.1101 11164.4838 10343.5832 10399.5744 15458.1002 20470.8873 10490.3952 8417.1771 20660.2111 5916.6664 6904.2648 11523.3531 18000.7041 14337.3988 15445.5324 18422.0451 10017.4376 20633.0964 8488.1145 18642.8043 18656.8399 18449.3952 14478.2311 22319.0420 5763.0634 8991.0045 7655.4189 14998.1732 6348.8142 7472.5400 9676.9752 4848.4055 21334.5452 7217.9838 12703.4020 29892.5930 10375.3302 23591.1309 5770.9572 16757.6983 9542.9518 16929.7538 8374.3036 31230.9845 7299.7615 42369.7178 17175.9575 10120.9288 5626.2226 8705.9193 7186.6063 12091.8178 10584.2649 13620.4818 19101.8230 11993.5799 8233.2597 20632.2717 36619.9717 15832.2203 16918.3504 17664.4879 40584.4718 27118.8210 13421.6197 11809.6971 23431.5537 7387.2037 16163.8261 4832.3056 4782.5186 11752.5405 8944.2341 8131.2289 8969.0271 19106.1376 10873.3376 9162.5105 9257.4954 4085.2751 8911.7111 13458.2302 12110.1497 15957.0819 17441.2997 20613.2883 14116.3547 4889.1750 17498.7047 16987.0272 9158.3641 14074.2069 13917.6936 15739.0638 15239.2548 12791.6856 9887.7344 17736.3276 13518.3255 14523.5778 17691.2545 14663.2973 11919.3600 13925.5586 11684.2696 17517.5154 9849.7656 12390.4352 6437.0972 7050.0953 7938.0220 9852.5006 5926.2302 7582.4762 8917.2093 7511.1525 8073.5871 8450.6664 10695.5129 12713.4022 8275.3036 8588.8576 10996.6074 7530.9789 9859.9588 10108.1591 16168.3212 15434.5958 15762.7052 14014.5799 12071.9377 15994.1888 9396.2577 13316.7747 18750.7855 18540.0190 13843.9267 13258.3269 13669.9498 12929.4811 13624.4244 Thymine_R2 Thymine 11828.3338 16154.8458 9676.7576 14102.6448 27677.0966 12466.0674 11094.2802 13178.8750 20693.6545 9473.6832 14912.5364 9567.5579 8214.8673 16471.4917 15651.7274 13503.5099 9606.1234 9983.9692 7691.4033 10409.9018 35953.5693 6042.3081 14898.5837 40751.3021 7038.3247 14355.4085 13117.5231 14801.6894 8624.5717 14206.2713 16191.2766 10376.6923 18400.4964 21056.4111 20924.8636 11239.9160 5755.4119 19832.4046 37217.8334 6562.3605 6835.1794 6165.8518 10718.3322 9403.6857 5660.0220 15244.4239 19397.1472 7653.4012 15833.6474 15839.0240 11020.7914 13397.4378 14105.4197 19786.5082 6192.3395 15588.9204 16788.7801 13165.0438 2938.8087 22233.1487 16040.8374 10301.7977 19011.9818 5630.3298 26519.0519 22801.5502 6099.7316 12433.3334 7644.4460 17975.9957 13464.5890 5487.7504 51830.9684 11045.3120 4054.4079 9381.8407 12646.4153 8825.3839 12704.1387 11629.6212 9152.9299 19859.9490 35500.0798 13458.3229 11668.0009 46563.9918 23953.3831 8708.2689 11047.6265 23159.4452 13447.2595 9131.4842 7043.0584 20250.4309 9888.2074 8379.2119 9416.0298 13036.4286 10874.7942 13467.2614 19363.7772 11788.2654 3900.2601 7960.0945 15666.0204 7479.5331 3717.3750 12822.0999 11942.3673 12459.3914 13533.0463 11627.8228 13140.7394 14432.4322 15143.9302 14481.6120 12102.3103 12310.2333 14488.9499 11707.4990 4692.3918 7023.3371 7480.5906 6434.4202 5991.8300 5932.4638 9308.9352 13924.2574 11953.8311 9965.9206 5644.6286 8086.2820 16865.6384 15012.1180 16915.0323 16059.8334 11103.1225 12979.9245 16516.6099 10436.0192 11667.7990 12673.6264 12619.7056 12366.2483 trans-3-hydroxycotinine trans-3-Hydroxycotinine 8696.6324 13323.4243 9559.0614 19796.1138 15178.3965 2537387.1560 2527568.9600 2441227.8520 2413876.3120 2096501.0670 1931461.8880 2004496.3110 1959441.1050 2033676.4100 1990027.2320 1794343.9300 1974331.7430 2056433.2790 1998645.1890 1714864.2960 1635639.2520 6516434.8100 6197530.5900 6666159.6470 4886969.6820 5102644.5440 4692932.8060 4891186.1550 4922358.6720 5195798.7280 Trehalose Trehalose 185480.8867 30003.3583 137122.1771 233141.5998 57628.5037 125221.2700 250795.8502 68067.5258 280842.1395 149068.0826 36238.2305 124131.3921 139167.2694 49507.7518 113892.8948 327205.1890 206060.1021 152600.3709 74299.9560 94015.7722 278643.7639 386811.6049 152584.8257 595962.5014 159039.0934 286141.1095 272277.4056 18205.0241 308147.7685 96219.6315 254876.1482 325134.1180 174117.6179 180586.7397 207059.3125 42173.5167 199811.7994 41553.9404 230152.8650 195635.6559 98455.2814 24666.3955 337909.9823 121329.9559 43058.5393 109334.6893 354787.6260 222896.4655 227266.0234 107561.3619 314525.4917 19375.5379 144871.8108 421344.4035 155283.1453 60398.6988 231997.9466 58533.4825 518259.4337 325680.4020 118336.0018 78710.9628 106161.4313 437910.6898 73393.9651 29437.5215 263865.1059 45740.0479 233540.1774 118997.7160 110123.5810 192574.6017 107943.9249 201722.3410 19458.6245 56103.3773 116219.1694 151574.7434 144987.1519 374558.5251 131433.9627 262373.0007 298072.3977 264884.2083 144162.1526 228712.6040 111494.6162 197359.8988 301998.0369 289991.1567 108002.4098 140149.4231 101018.7928 49601.9205 139794.3136 554512.9282 105910.4017 66188.1272 47695.5645 226966.6388 29972.0814 371788.8010 120994.4973 18061.7140 242822.7928 162573.9429 313350.6288 144086.7160 250291.2572 148398.7695 65058.6131 150375.8120 71979.6110 214453.5441 151071.9286 36800.0237 199406.6650 242313.7256 262219.5402 64786.2346 271130.6017 132676.8679 113237.9516 133380.0705 55619.7763 118031.0789 250830.9206 90780.5126 162508.0344 129198.4515 23712.5056 44672.8988 143668.5786 150169.3148 181062.0922 201634.3167 279754.9132 110513.8540 189716.8409 192050.4245 104305.7869 568236.1503 212283.7953 77554.3639 210447.1559 235886.9383 311560.1169 104599.4192 127581.2130 31312.1443 304720.5423 387741.8777 121021.4717 27027.6207 233409.0908 99865.1855 99598.8448 47116.9298 158008.2169 146067.6276 311659.7560 27739.9592 162178.1953 14051.6026 429806.6867 123835.9679 135116.0605 164827.8923 168190.3193 121908.2329 117321.6161 141900.2513 128992.5490 127036.0253 127481.0254 122118.5386 134304.4041 136945.4972 134243.8286 123599.3754 122649.3939 168519.0961 144817.0528 161362.0512 141276.8026 154134.8323 137136.1544 137148.9020 119928.9687 138766.2656 295726.3044 321112.3529 276113.6872 416718.4038 257957.1212 260253.3302 215549.9120 167367.8543 185137.1031 169648.6482 176763.6004 143163.7445 141560.1368 248425.7661 152913.4870 187692.7178 141223.4622 146849.1940 207040.6926 206164.1299 160628.5592 169231.8593 147458.6473 160416.3678 Trigonelline_R1 Trigonelline 7024231.3910 7351447.6260 7770163.3760 8682608.1210 2616824.3500 1952777.0370 6647609.7650 3566071.9310 12819187.1100 9874641.6650 6722857.8160 4329388.3510 462232.6935 1313161.7890 2240824.3010 15701756.4300 1529379.1720 3632617.4520 11723192.3900 3079824.5140 10989409.3700 3337594.3630 8700909.8600 3761249.4290 7695998.4850 2048043.5310 6506622.9260 6015653.6260 2410241.9330 5368705.9080 13702566.1400 58330350.2400 11379229.4100 3049799.2620 3889203.0800 2949518.7020 13051180.4900 6107757.7600 2511945.6570 2126822.5650 6579931.3790 1657439.9280 2451179.7310 6829351.2750 2028439.7060 17887221.0700 1834458.9140 4992965.1900 3882343.0020 3327554.9450 9804792.5340 6462024.3020 2714584.6180 61946061.6000 2612046.6170 37530435.7500 2205478.4500 1858466.7290 15048837.5200 3162915.8920 2594926.1450 4875050.6880 8819422.5000 3002873.8370 5905997.2340 3268210.4860 4751306.7130 2016562.5890 6199491.5430 1846386.5790 2540303.7860 2460598.8090 2020008.9100 4991593.9940 3167759.8170 1594266.8840 1379148.1330 2023024.9060 3411809.6110 1519249.3330 1400025.2730 1118326.6710 2691588.9570 8008169.9090 2814110.7550 2076738.3090 2074872.9910 7815653.8320 7318626.7250 792496.1653 2648212.2630 2148626.2790 2674667.8640 6051870.3840 4136945.4800 4609545.7090 21119507.3900 3240556.6990 1876918.5480 3218106.4690 2972332.6730 3558386.2380 1936155.1590 1108223.9570 5362863.0510 13175877.0300 8955769.6840 24954115.4400 1881396.2100 2696303.9510 45413784.5200 13455216.8000 912424.3819 30251778.5500 1649546.7780 6522062.9040 8789103.8790 4444915.2290 3097720.2050 2471779.6790 8197707.2060 8828377.4250 5048473.0080 3260405.9020 3422950.8810 2100259.8170 2809601.3600 4168857.9850 5476420.0280 4655529.5390 1043502.5700 1052247.8600 2187882.9070 4268693.4340 10128221.4100 1433677.2150 2742591.3970 2025508.3850 3649685.8400 3116069.2600 2329490.6300 4315529.8150 4880615.3530 1463540.3780 4462818.8240 5317033.7170 7783287.0130 5025340.9960 2510713.9950 1903357.0550 6108015.9580 30927591.5500 4989061.3870 3080835.0960 10653442.9800 1252189.2130 6121736.4570 2787960.1780 10501975.7800 1772320.1130 2688485.7660 7536927.4330 6809713.7510 4108853.0060 8020159.4480 21512388.3500 20977729.7900 21499225.8300 20117139.0100 16675878.8300 15457018.8000 19262649.3100 18245272.7500 18113804.2900 17891758.6600 15514616.8400 16221185.2200 18390842.3400 17174233.7800 17368749.4500 16043540.0100 41385944.0800 39310575.3800 41349018.8000 33789642.4700 34781708.4400 33577486.7400 30335606.4900 31713008.2300 30815624.7800 6700859.6430 6594073.5410 6253754.4510 6251077.7730 6070422.4140 5874751.1730 5250059.4630 5056756.8460 5095858.6050 6228982.4170 6489302.3330 5815304.7560 5882908.7560 5607637.5550 5370617.9390 5527400.4410 5370919.2440 5685089.1370 5415462.5340 5208788.5700 5094269.4870 5403139.4480 4936679.8750 4709851.3310 Trigonelline_R2 Trigonelline 6779694.0080 7132370.3940 3501960.6290 8429805.8600 2606184.9610 1938715.9730 6418611.8960 3512394.6130 12367104.8200 9621238.9920 6527617.9670 4116465.2450 457143.1155 1327676.5930 2218216.7210 15128541.4300 1587535.4730 3532027.2190 11327541.0500 3032185.9840 10737956.1100 3275789.4460 8458004.6000 3728703.1180 7560199.0340 2242872.7150 6457960.8000 5880324.2210 2282048.7870 5242403.9890 13364903.8600 55942795.6200 11084143.3600 3017248.8850 3762793.6320 2909999.3520 12544573.1100 5932527.4800 2437274.8100 2199344.5420 6430801.5410 1703121.9770 2391106.6860 6627853.8630 2018297.7250 17166083.7000 1811696.1430 4862020.7320 3724071.7150 3289627.8750 9508022.1730 6246374.2400 2684351.3120 59316644.3300 2579813.7780 36066454.2900 2203860.8340 1899475.0270 14642257.0200 3113004.7420 2597207.3870 4682650.9390 8590669.2560 2901413.6530 5738723.9100 3168867.9710 4701243.1940 2010539.9930 6004731.9200 1865489.3020 2521643.2180 2477121.3010 1957676.9170 4863101.5490 3147603.8350 1601562.8650 1337546.7320 1940649.1820 3396582.3240 1537300.0660 1402834.1980 1093896.8130 2658960.0500 7797669.1380 2697093.7180 3287251.4630 2052928.6470 7588834.9680 3133504.4310 1100965.6780 2633378.2120 2161250.0570 2578783.3220 5926984.8550 4006855.5180 4561336.8560 20230954.0600 3188114.4730 1928123.4750 3077756.1380 2955248.2890 3514636.4100 1929815.3120 1153585.6130 5235166.7150 12728103.6000 8708216.5780 24331749.0500 1814860.6450 2642635.4910 43823712.8600 12958941.2200 946900.7138 29122502.9300 1723819.5170 6405225.9440 8531348.7760 4382288.0190 2995882.6220 2497794.7980 7986959.4660 8663275.7990 4901049.6170 3119555.5010 3408449.6220 2089906.1480 2756298.2190 4120753.2910 5385359.6640 1927223.7980 1082513.7910 1071056.2000 2113078.9940 4211792.5150 9879350.4400 1463858.7420 2666140.3420 1957918.5000 3587184.7470 3059920.2140 2246012.9270 4224865.0670 4757167.2690 1420182.0310 4313859.2040 5223255.6430 7605988.9320 4985826.9400 2394101.1230 1906614.2960 5939365.6480 29774857.9100 4847933.5000 3063581.9940 10294695.8900 1256100.6270 5945428.8640 2823645.7050 10158291.5400 1833071.4570 2673247.9930 7251587.2620 6600115.0790 4110390.6240 7757898.0690 20784626.9600 20498124.6100 20720475.4700 19370666.5800 16042678.0700 14881729.2900 18522391.5900 17595370.9000 17466543.2700 17179414.2800 15052496.4800 15907021.4300 17696993.5700 16525002.6100 16702555.6200 15393430.3300 40085685.7200 37883449.1900 39911859.7200 32614154.9800 33565113.9700 32335726.4300 29168801.4200 30500078.6100 29639284.9600 6653786.5890 6514745.4940 6088324.1630 6026426.8700 5866217.1390 5728584.7390 5043892.2260 4872387.5060 5029797.2500 6031960.2790 6268545.0970 5673096.3150 5688969.3700 5387325.5690 7661959.1060 5348200.0220 5187529.9410 5486772.3430 5262873.2910 5023725.4120 4956767.6750 5262078.6230 4799105.6600 4592861.7350 Trimethylamine_R1 Trimethylamine 16688.4804 10897.7597 11542.8636 30470.0933 8184.2003 13179.7996 13740.9392 10181.2205 6669.4418 8687.3254 17490.1736 7927.5149 6722.5030 13286.1630 14942.9092 18658.9181 22808.3593 11113.8359 13304.0993 10951.1356 8969.4151 21226.4182 7678.6874 4592.4415 15929.4536 12757.5846 9786.2375 10062.8525 11294.8375 5872.9689 11496.3371 16690.5683 8793.7584 15684.7656 5310.7991 13620.8062 8545.7628 13216.7965 10841.6968 10847.0327 19824.0337 11956.3058 9550.3921 7272.6852 10783.3650 12122.8068 13113.9505 5675.4650 8579.2773 14822.8166 10264.3398 7198.1181 24837.8339 7743.5701 18122.4762 12493.6967 8693.2881 8785.5742 19478.8891 11114.0976 8664.9391 7119.6679 11203.0662 9391.3585 11227.9469 3819.8689 14165.5989 12670.9627 17379.4022 11575.1253 15984.1536 9350.7604 9125.7768 11334.3287 15617.4085 6807.5107 9675.4276 12027.2239 9869.7146 12833.0551 9224.4106 7999.5593 10496.4650 10395.2277 26004.6332 12543.5099 12289.6112 15739.0769 9167.2011 9722.0452 12259.3498 5208.4951 10939.8829 14099.6855 12503.2463 9966.3562 12789.1718 10564.4247 17392.6765 11213.9571 8118.3518 16103.9757 19418.5850 6991.1660 8025.6263 15887.6401 10439.6497 9238.2147 13135.8405 5572.2989 14645.7167 14670.2997 16120.3885 12885.0230 10361.7543 8363.9515 16020.1848 12250.1126 10230.7740 7866.9574 11378.7348 12019.0247 13375.4911 12958.6032 10315.5724 20725.1599 9836.9597 8363.7413 7663.4123 6238.8525 12480.9722 13768.6304 11006.3568 13512.8615 11880.1719 8420.9557 10630.6310 9678.2640 9590.5587 9671.3981 15038.6851 4531.6780 15466.9405 11509.3561 10105.3476 11825.2717 4813.4949 12636.7503 14099.3784 16279.9092 20786.2960 14179.7270 12960.2916 13431.9511 7699.7797 13061.2363 9650.9688 12124.6480 12815.4315 13937.0365 5017.4931 11788.1725 9776.5983 14673.2753 9206.7394 10026.9080 10548.9382 16497.5243 17280.4809 17455.9335 15824.8571 15001.9785 15842.4266 12796.9480 12365.2469 14821.4168 8971.9605 8575.6798 14052.7904 11262.8554 10926.2560 9811.5344 10252.0507 10579.4122 9455.8584 13668.7018 13951.6557 12511.8680 12882.5616 11054.6708 11040.0558 9446.1838 11386.6249 13503.9087 11815.2036 12191.5906 10253.2491 10845.1749 8073.5552 8756.2407 Trimethylamine_R2 Trimethylamine 15005.0050 8397.8411 12393.1846 28217.6396 5371.4803 12050.2246 11739.5373 10348.4430 6061.6757 8136.5247 16532.9149 5469.5986 10932.9838 11973.0561 12222.1285 22606.0294 10868.3917 10448.1189 11335.0112 7609.7794 18893.4125 4520.0288 2225.8437 11350.8696 14778.7422 9074.6869 10125.2281 9083.2358 9716.3591 9675.3092 6085.6214 9066.2349 15478.4227 7883.5143 15620.6233 12966.7005 7859.4082 5660.3671 11463.8826 10447.5430 7661.4131 17751.7395 10611.0430 11109.8543 6820.2780 7415.8275 6385.7620 10352.7498 10134.9547 11089.1765 13959.8771 6990.4524 9729.0122 24528.7674 5279.5954 16988.5114 9735.3742 4579.5620 9924.3954 5585.8813 11149.1299 7208.1141 5331.2118 10457.2611 10292.0964 12159.2339 8647.1574 16281.2115 10138.9386 14233.1088 5979.4408 11089.8736 11189.5631 8695.2321 7805.0844 14000.7560 6882.0702 9769.1494 8833.1650 13001.0418 9063.7521 6950.0743 10199.3990 8606.8407 23399.0066 12622.6467 10234.4454 13258.4813 8784.6425 5519.8874 9562.4566 9433.4688 10198.1701 7607.5889 34870.3510 9563.2235 11825.2904 10384.9960 7728.1818 10815.2468 7919.2976 11825.4894 17286.8278 4268.9466 14441.4853 10563.8565 9835.0580 7368.1470 14574.0005 13476.5229 14887.5559 11530.0074 9730.2313 4505.6147 13037.9295 12731.2925 10096.0192 5689.6981 10754.0586 10855.8472 11196.3516 10125.8242 7854.6540 19450.9805 4980.7738 7874.9214 5907.5037 4753.2557 3887.3908 12854.1284 9779.3443 8010.2815 9509.6835 8483.9749 3603.4673 8656.1185 12065.8754 4560.2374 13131.6194 5281.7740 7268.6688 9965.7795 8206.8099 13163.1008 15665.8999 15797.8925 11424.6885 12205.6300 10610.9589 16338.4078 9651.2410 8681.0955 12642.4582 12971.0301 19635.7571 16879.7351 12149.4445 15776.1189 12611.5678 11353.3835 13363.8328 6698.4590 12892.6630 15440.4482 15196.4020 13714.0563 13229.3249 13181.7544 11815.8255 12350.1447 14187.6465 6387.7149 4134.6073 11755.2763 9026.3566 9602.8593 9488.1821 7744.0745 5274.0678 12362.7479 10053.2943 11637.8284 13020.7508 11413.0934 10815.6134 8919.5749 10624.9234 11951.4186 10934.2476 11678.2746 10304.4085 9366.1534 6734.5839 5825.2323 Tryptamine Tryptamine 200728.6198 363533.5746 579503.6764 339175.9890 544686.4720 525007.0368 137186.6243 400110.3164 392685.2850 403626.2002 157254.1098 262380.3532 129835.7671 670150.8865 135501.1399 135821.5801 453653.6229 58745.7330 225426.8961 331636.1160 186492.6140 541799.0983 340706.1660 245133.4630 787855.9930 497036.2375 303149.5614 522810.0910 230363.4935 379633.2455 116243.7656 608661.6335 484664.1383 474985.2653 1382157.3920 425991.0982 620512.1073 451478.4943 194173.6845 499850.3585 817494.0079 792926.9623 973067.4436 650313.4134 811861.5090 719045.3924 308073.8725 336855.6642 412754.2871 19368.2271 20934.8446 18046.0262 17026.0987 14127.2629 14632.4781 10802.6060 13545.8519 13818.7350 603838.3529 729195.9973 673482.6487 523891.7001 599899.3182 611388.1442 582806.6663 632468.6731 565283.9540 527253.7374 588604.3120 256751.9329 236281.0037 232074.0903 195145.1656 543166.5570 620361.8219 334939.0094 454776.8123 614881.0375 562174.5893 356744.4373 404458.8845 452381.6387 Tryptophan Tryptophan 89016.7572 174551.1219 81336.4939 167398.3694 21332.1215 116126.2194 87140.5136 1228303.9210 52368.2902 137789.4183 287095.9895 324694.6434 95049.5269 304297.3321 181325.8641 159228.9909 41387.7984 139349.9384 271616.0117 100550.4108 57178.4099 130197.2347 806198.5782 1264936.8260 123782.9637 227511.3003 48402.3691 124811.5872 423042.9157 153529.9849 35391.6882 156546.3861 42419.7453 89725.0967 61351.7508 90749.8235 61782.8086 165189.0001 30199.0942 247414.1446 277088.0181 124879.9427 53778.6824 853686.3099 231661.3275 114885.2676 60446.9753 314496.1732 153683.0973 101059.6323 24269.4935 112075.2318 151270.2324 79020.2124 142271.4373 83926.3940 1378718.4020 226615.9478 47387.6989 112393.2413 145331.5892 94372.0324 120875.8253 51132.3005 28941.8412 45353.5485 277405.5440 48653.0370 133205.5264 1007313.0370 16367.1054 117074.7184 91898.1899 43262.7540 558058.8711 151880.6980 126525.0767 162655.6635 2223878.3690 74530.6096 63091.9072 54003.4583 24600.4623 161237.9170 64395.7965 240995.3356 237239.6149 149520.2294 40347.1099 223555.6768 81229.3617 155321.3727 142651.8150 32658.0654 460493.7761 24017.1951 255522.7720 76095.7111 233233.0384 200210.1498 167115.9281 224230.2185 40091.4584 562048.2946 33353.4011 237264.8365 67303.6255 2573349.1980 57863.6739 212321.9505 121377.7947 154481.9210 122678.9368 58175.4006 2343664.7510 269240.3809 143344.9899 228338.3048 51857.6312 99578.8736 21428.4032 239000.6361 235179.0841 215094.1422 1057565.6700 129009.3140 54637.3044 35454.2665 92894.2304 137920.4119 128821.4381 110286.9160 50100.4067 23975.8415 86959.9562 120337.6865 173659.0373 226778.0982 255011.5925 63224.8314 108167.0008 19200.7156 42864.2775 120005.6608 157620.1493 296382.9084 47323.1315 200251.6073 145369.7988 133560.9460 146944.3667 124671.3246 236554.9327 45891.3160 53147.9411 184022.8170 64665.0194 1032696.9060 1187558.6140 230501.7097 36203.1520 249777.2889 118150.5841 338710.3501 178762.8086 206671.1419 210452.2012 205487.2156 179406.1118 147698.3497 157752.0177 184704.1567 176189.4073 138475.6505 169001.0631 142007.1243 131564.1046 139846.2652 167563.9237 151058.0170 168222.0071 190531.0173 184588.6078 186039.8843 135450.9038 150319.9492 124517.1475 126683.5262 139534.8656 126613.8224 134602.2437 146527.2923 140924.7353 127569.6860 172754.1757 137769.3404 137717.3143 114675.7925 110941.9981 140218.5974 120907.9453 132445.1421 104768.8413 129088.6672 80308.0610 133537.9621 93653.7430 129451.3016 91832.0656 98078.7794 114551.2994 125687.0805 126397.5636 122204.7642 Uracil_R1 Uracil 46539.4648 53575.9852 31275.6997 90150.6643 51837.2303 69991.7808 188403.2122 73635.6415 39983.0877 41542.8210 109619.9067 24465.3820 30654.8986 27194.4059 54572.8477 53046.1518 60992.8209 68380.8503 39284.8531 102754.2722 39283.5581 58245.2948 38901.7303 87843.1158 43704.5092 76813.3657 61046.3043 99848.2556 52708.1400 110422.4020 36294.2970 21079.8545 94914.7047 60360.3953 111642.0443 69358.9489 24864.4200 122519.8565 18920.3460 115588.3320 49683.0264 80644.4109 42392.5229 57053.4899 23629.3529 90782.0680 78906.9899 48243.2827 93398.2268 57872.2782 33945.8241 97231.0023 50880.6813 35016.2117 137341.3150 85182.8745 161036.2919 96093.5552 112559.8195 42780.9579 62483.2230 146500.1920 127422.6100 35845.1861 38720.4877 25264.7414 44813.4470 47095.7637 84712.9877 47573.7973 45427.6884 73778.4611 63018.8444 32067.4098 145138.1329 108384.1655 38613.1201 92542.6157 44511.8445 9545.6079 42583.3701 59714.0607 50563.8866 39384.5855 61527.8188 85588.3622 86263.0640 134735.4055 54608.3819 49987.5108 108487.4968 121574.3954 44475.0885 51763.4416 145813.6508 30735.5080 45037.3883 35695.1363 80630.0280 45479.1453 92700.1719 59509.6906 28923.0907 80646.3292 31645.9964 68404.1825 48680.2500 70997.8005 62781.9019 118936.4291 40494.1005 33655.9218 49359.8763 80783.3851 45752.0039 97930.8803 43594.3894 87857.4953 25860.1475 76001.9029 25470.6160 50660.8741 30868.1033 117253.2983 108424.4005 55408.7200 27259.5049 42169.8799 44675.9457 128525.5142 78874.9025 62346.0621 52443.3795 113208.5714 146720.7912 116234.1227 80613.7696 83811.8996 55649.5397 29707.4286 48062.3263 32204.6130 29999.3648 93333.2319 37149.6992 22331.9919 53954.3704 84788.9139 50226.3227 97580.1570 32506.5193 22260.9562 27110.7156 25011.6707 37893.1455 66225.7762 30475.0204 86348.5348 120078.3201 125961.2649 25304.6498 70171.9070 151065.9769 74223.5507 42837.4245 39927.8287 42102.9109 42038.8268 38710.0502 37789.5598 35455.2784 53412.7302 54964.9675 44370.3878 46142.5685 43095.5715 47319.9650 41648.6692 44545.2280 43781.6340 38176.1445 38691.4136 35238.0077 38736.0546 44737.0154 41869.9043 42106.9373 35985.6797 34109.2262 33641.0477 59327.7651 58417.7271 64197.0295 59864.1114 55484.4600 60519.8101 55371.1214 56409.0729 51603.2339 74740.0422 77121.4817 77856.6865 76604.0396 64604.7691 70416.8462 66713.2968 69231.0233 70751.4047 67211.0446 64889.9884 69389.3858 69325.4640 63482.9665 66088.0781 Uracil_R2 Uracil 44562.7905 58887.0265 30445.3222 87716.4776 50099.0705 67631.3434 182175.9626 68772.0720 42392.8699 41017.4151 107153.6495 24426.2191 29049.4692 29776.0682 51662.5698 51729.9169 64230.3369 67478.2362 37550.0304 104131.0703 37665.7580 56249.3931 38058.9869 84630.3477 42560.9565 73941.4404 60124.0195 95665.1330 53017.9097 105808.0878 33855.6860 20870.1518 92423.2286 57827.4228 108465.3957 67856.4749 24463.8514 120275.3334 21603.1718 110250.4623 51175.4458 78474.0588 41643.2707 54962.8094 22247.2543 87960.8819 84845.6661 46875.5458 89834.0310 55940.1313 35166.4119 93531.2020 49921.0284 32996.2675 143719.9609 81878.5101 154363.2015 92740.9037 109677.0321 40748.2072 59626.5559 142299.9289 123237.1292 35303.6248 36833.8762 28181.0216 42878.5865 46617.9666 84464.4172 50741.0342 44035.1153 72983.8654 60644.3087 34459.2257 141805.8135 105068.1651 36721.5172 91914.7375 41991.1158 10854.5910 40976.5193 57597.1478 53755.0826 38678.8169 58545.1568 81352.4289 83793.1716 131181.7384 52207.6163 47839.6233 104840.3161 118848.4098 48434.4220 50095.0950 140856.2430 32342.7703 44164.9893 34715.7259 77433.1269 43675.3317 89011.9312 57560.5860 26276.1251 78817.6759 31253.8735 65742.2631 49309.0412 69475.3225 60933.0623 115813.7821 42148.8082 37112.0950 45609.5064 83491.5362 43796.0808 95125.9924 44315.5243 85788.7217 25671.0365 73168.6451 23409.0011 49252.3959 29349.1690 113075.0162 104238.7318 54051.4071 28294.7044 44713.8535 42067.1268 124347.4493 77046.0684 60063.4654 52988.8075 117398.0598 143325.2767 113489.1684 84175.4857 53958.6496 31428.0810 46020.2442 32991.8026 28944.8791 90777.7169 38620.2162 20710.1147 54471.7216 82265.3149 48451.2979 94635.8170 31731.2066 20005.0316 26503.1067 24077.8754 36931.5079 64450.5292 36218.8414 82185.2500 115537.6937 130870.5166 26022.1997 68598.2052 144630.8095 72734.1778 43079.2746 43483.3504 41357.0952 45966.6414 37900.9318 36287.2134 35158.2928 50429.8272 52315.8997 48710.2691 44377.7513 47682.0250 44083.6103 46111.5857 41961.1276 46775.3863 36551.8385 37339.9192 34346.8383 36314.8990 44991.3717 42788.8245 40558.5800 35362.9755 32766.6954 34218.6141 56522.1597 58900.6051 62749.8174 57885.8602 57483.5962 59912.2581 53761.8520 54512.3632 50744.8553 78131.5036 76509.4034 75943.8193 79580.6529 62468.6066 70473.3249 65177.7945 70312.4931 74981.5274 66663.4278 61821.1240 72666.0083 66656.9971 61610.7073 63341.8783 Ureidopropionate_R1 Ureidopropionic acid 137036.5941 171991.5260 140484.0559 197549.4140 138428.5642 145759.4472 158649.7334 170595.5211 138504.2593 112509.3728 470329.3476 144505.3940 100837.2762 154101.7787 126886.0208 535642.0050 137291.5460 164475.4191 160745.2729 134915.7337 134707.5797 202077.4787 243265.5231 107916.8419 180156.9796 171385.5180 120838.7196 164668.2339 144750.6818 138120.9870 129618.0607 111891.8890 106435.1244 130897.2007 179516.3027 157090.7146 145633.7625 187998.3647 81159.0282 150354.5075 170441.4206 126162.2197 186309.4265 163343.3718 65477.2696 116852.2171 193766.9565 100301.0852 92983.1908 92801.5724 114142.0690 177716.7276 153678.6107 151308.3690 170798.9657 171296.2068 174797.8082 128256.3526 208673.9325 173241.5794 413495.0652 172437.6452 135062.0163 93346.1589 114273.6956 259906.6131 133313.8218 138990.6580 110506.2372 170186.1182 138082.1584 160136.7237 515617.9762 108662.4516 263505.7153 134237.6082 100734.3482 136577.8352 159682.6622 75563.9526 128996.2800 270089.7392 99161.5203 111510.8220 134413.4875 181130.3486 335322.1503 118808.6873 97586.6905 203122.6968 143448.1744 153837.9997 144454.1622 95950.4230 278921.4519 166154.2377 150877.4756 187734.5721 221851.7208 164930.5319 244276.6381 137932.7439 100107.2631 202533.5556 106525.4030 370633.1592 192691.1373 335580.0395 114886.5011 228594.4188 186270.5366 161716.3821 77048.9576 100191.6415 320656.8612 431946.4937 201678.3969 138858.3911 193945.6008 154391.5560 122559.4495 144952.4391 95658.0878 191878.6943 215188.8326 132352.2768 182045.5380 125325.8488 114460.9470 181281.2570 161681.5468 95621.1864 97144.6290 188994.2683 153106.2621 161609.7172 131737.8522 342010.5481 165536.9370 106960.7225 143986.8075 157393.4996 162240.4430 316457.7588 156796.8339 133417.5061 104038.6103 165245.0201 107083.9536 170825.0998 145638.3539 116521.7883 111111.5235 282299.4734 119420.4155 131415.0727 127875.3513 248231.3022 184796.3474 186031.5580 101256.4529 88834.5093 197931.1140 173764.8051 129799.9257 194424.5293 187415.1426 189610.5289 180696.0404 151313.5040 165239.3103 185342.7347 162989.0228 166347.9614 169216.4345 163193.4760 161514.4085 186872.4746 156716.5317 171281.0186 150417.1915 177178.6240 174720.1732 174847.5859 160430.4805 169694.8015 153319.7456 173235.4925 163324.9831 166015.9154 171149.4398 156379.4834 182980.4797 165627.4307 165489.7741 177510.9565 146476.8634 151308.9937 143805.1321 173817.0242 180236.1549 171360.7080 162182.6062 153395.6452 162038.4350 146545.1987 159278.6429 171965.7263 179452.3917 167773.2387 174050.6738 162597.1992 153673.8696 170117.3582 Ureidopropionate_R2 Ureidopropionic acid 68648.4212 77479.5338 65797.9624 76275.5693 65039.5058 73525.7228 70447.8584 80771.4409 69034.2563 47360.1718 227675.1769 66686.4856 48270.2017 77776.4401 57011.7702 266646.0659 69879.2006 73647.2798 79388.6371 62252.2730 58858.2845 95767.3024 110245.2881 49616.5322 84486.1787 59104.3501 54560.5349 72409.0044 72393.2268 70837.0228 69002.6970 55232.5000 56002.8537 62136.6104 89509.3098 78348.0979 72990.1331 90635.3422 38832.0957 70167.5371 81047.9787 56390.0687 91118.5619 73301.7372 31471.4022 57141.5091 89045.4478 48713.8366 43369.7799 46171.2898 53634.3902 79948.1015 72221.0643 77063.4312 84075.6380 86582.8825 79394.7323 53791.5215 100132.1833 82811.7872 203844.7889 80303.0458 59099.7099 51315.1732 52592.6323 124316.9252 67755.0231 66180.0337 49281.9277 81141.1239 66626.5642 79967.1537 234243.9293 55366.0809 87688.0412 61612.0472 45688.6967 62108.8705 76948.0526 37687.5879 66126.8986 116461.5677 53763.7637 55362.8656 64049.3542 66308.0332 143395.5793 50657.2157 47316.2757 89763.9888 61293.4680 76256.7984 69305.3483 40621.6260 114691.4482 84840.4631 62929.4359 97642.0458 103438.4213 104074.8396 123525.4506 65189.8326 49547.7059 99605.8846 54164.0977 177768.7231 91236.2840 160447.0803 52937.0638 102019.0736 81744.6631 66431.9084 34228.8407 43842.1418 132605.9963 208823.0729 101262.6473 85780.6699 92622.9099 63836.4854 64521.3896 73189.1040 59617.1286 92855.3068 99864.1427 66533.2503 90873.1441 58553.4694 53083.3118 79553.7241 67948.6688 43956.0554 49140.6251 85530.7035 75503.2337 83117.2256 66326.7942 152569.3361 79295.3207 55212.0321 68696.2205 76295.8299 85445.7811 155868.4247 75982.5460 64008.9985 51094.4075 75658.1207 53956.4073 79809.2950 79779.7558 60923.8611 53328.9899 135603.4094 53857.9118 66041.7862 56326.0014 120376.4717 87936.9427 92071.8362 48745.5862 45634.3702 94560.6141 78343.7041 65252.2645 93483.7103 84455.5921 87962.4176 87445.2333 77034.8989 81561.9796 77777.1366 75805.2710 71327.3231 78490.1935 74271.0854 78723.9435 85624.1277 86162.1316 79003.5865 77121.2054 77876.3815 78810.9247 75719.1497 71718.7406 72658.5613 74636.4377 85563.4688 85462.9315 80266.0543 83506.7736 86851.8526 94647.0690 76867.4397 89034.4934 84783.0779 66393.3832 76822.2366 66855.9284 81246.8683 77371.4475 79755.6803 81456.8247 73458.7728 75202.9505 76293.0285 73917.4438 77306.7285 92605.8251 91260.7027 90211.2193 82429.8993 85100.0102 83884.9347 Uric acid_R1 Uric acid 9466298.6700 13323621.3800 14244864.4200 14614280.3900 12186207.1000 12539439.3600 10202645.2200 21162787.0200 10860026.6300 10638422.6000 13380966.4600 13241730.6000 12203033.1700 12427173.3200 11063140.9300 9824135.8090 14195812.3000 11076990.8400 12749628.0400 12932904.6600 10791462.2700 8797382.8140 16889373.2300 7420153.4490 12634429.5800 12396131.9300 17053086.8200 12626940.5000 15839055.8300 11661842.6600 20070182.6900 8653734.1170 10632512.1800 7952366.3330 6578062.4800 13034760.5700 10178921.3700 12277598.8200 2076218.6620 13679634.2400 15835045.5500 11418212.5100 6803686.5890 16376945.3400 9453680.4200 11112955.6500 9452495.5660 5006636.2640 9885145.8330 13721587.7400 7048870.1890 14084702.3800 13592139 7748436.8740 7513690.5330 14371156.8100 16005331.0500 8913260.4070 10873308.0800 12588530.0200 9265713.3020 17479293.0200 14091683.9500 10731438.1300 14430202.6600 14429711.6800 10199472.4600 7295474.3320 6515430.7230 10803151.2400 16254626.7900 14456986.0400 14537437.1500 11552440.2200 11035263.1700 12079821.5900 10684618.4500 11229653.6100 10047169.3800 8816267.8430 6165551.9820 5703298.8730 10427230.1700 7949689.1230 7522244.0290 14918115.4500 19498107.7800 12728560.2100 8829096.3850 13807537.8400 11282801.4800 7035691.3360 14367107.5900 15188056.0400 12970167.3900 3630807.2480 6443273.8890 15513265.6800 15173510.5800 9174269.3480 9226370.0610 6233289.7280 9619036.8100 9189529.6480 12898766.8100 15467324.3200 11026074.9100 8959702.7820 9998485.1840 9100783.0590 12402654.4800 10177795.9700 12653810.9800 11214776.0400 22705488.6600 13198862.0800 13304325.2200 11628743.5500 12213123.8200 13198059.4000 15620562.0900 11924115.1600 18644733.4400 13477565.7400 11814575.6100 14018358.3500 11268384.2300 10675316.4600 11611919.8000 15472241.4200 15339874.9500 13667319.3700 14325799.5400 15700348.7300 11726492.5400 9338478.5500 8223820.5600 19498070.7500 7519228.9440 10001128.1100 11816100.8900 3261083.8320 8584748.3200 10495504.4600 14623172.6400 10064517.2000 9696570.7320 14127253.6900 17248928.6300 12752939.9800 7658367.3240 8609772.8240 17126181.3100 14498667.9300 9983139.9600 6612831.9140 11635859.3600 13003540.7700 11537114.3000 9031343.6380 16098582.6100 10076549.5200 12396258.1600 16919488.4400 7217778.7420 16365840.0900 15348617.2700 15904790.5300 15742486.5900 13093810.9100 13326715.0100 13303575.7600 13082032.2300 12918852.1100 12768201.1800 11020186.5300 12420489.7500 14564857.5300 14353966.2600 14543282.0400 13557322.8400 18087834.8100 18124428.0200 18181740.6900 16712864.6200 16543178.8200 16132963.9400 15297241.5900 15551615.9700 15149966.5200 7575680.8530 7155555.4790 9013610.6980 5931378.7190 9857954.2910 8138099.5790 7854165.1760 8770574.3730 9466224.9700 12608089.8300 12525384.6600 11637293.3800 12511154.8200 5686069.1040 11880716.5700 7947822.8100 9571275.9910 10400085.9400 8589359.4220 8059781.2940 10512567.0200 10016703.5100 9389718.0830 9205811.1990 Uric acid_R2 Uric acid 9197969.6120 13031935.7100 13860660.7100 14215544.4400 11913830.0400 12183625.3000 9913162.2670 20577326.7500 10602762.2500 10336499.4700 13013244.4600 12931055.3400 11879087.3900 12063868.5300 10789267.4000 9602142.6630 13830070.7200 10789065.9500 12465628.7100 12560540.9800 10539503.9000 8579747.0890 16531248.5500 7231618.1590 12342294.7800 12034211.5400 16575530.6500 12289838.0600 15462894.1300 11349017.0900 19510804.0100 8442222.3510 10332785.0600 7751501.7810 6395754.5640 12723414.0300 9887059.5150 11933077.8400 2015208.4800 13357551.7000 15466254.4200 11102453.0600 6614820.4110 15988538.4200 9206794.5220 10800749.5900 9194400.4120 4859762.6910 9639131.3600 13326692.2500 6852267.1830 13701614.9300 13207011.7000 7560743.3310 7343897.3430 13957903.0900 15549225.7400 8677214.0270 10626783.6900 12260076.4800 9036901.4350 16982642.2400 13710839.2900 10477165.8000 14100254.0300 14020433.9600 9956540.0130 7103491.5190 6348565.6050 10503703.6600 15857165.9800 14145146.5400 14149167.5900 11224260.3100 10790735.4800 11797182.2100 10382159.4500 10914450.0200 9758584.2880 8598978.6060 5986165.8810 5541506.6010 10125754.2600 7768519.6070 7319222.2200 14539081.0800 18979424.4100 12382559.1000 8619532.3920 13416849.3000 10964740.2700 6865753.0960 13964703.1900 14774484.7300 12601239.4800 3544423.6050 6260796.4460 15172542.4600 14780183.2700 8902986.0740 8966568.8020 6076821.5190 9383700.6250 8927380.1000 12514391.1400 15116930.2400 10776895.8000 8713761.1920 9718519.7870 8856590.0500 12057801.8600 9919791.9910 12297507.2900 10903118.6100 22184117.4200 12820483.4400 12999635.9300 11360790.9200 11869033.4100 12834300.2600 15228768.0800 11636771.7200 18109520.0800 13116058.2700 11579279.7700 13640435.0300 10942501.4600 10382554.6800 11266261.6400 15043399.5000 14913332.9000 13292035.4500 13917405.5900 15269436.7900 11394541.5000 9075209.1060 7986889.6290 18953404.9600 7310213.0510 9719319.7220 11492201.5600 3180471.4690 8379630.6960 10254782.4900 14295957.4800 9831837.9700 9478686.8190 13718650.9900 16775260.2300 12391914.7700 7438155.4480 8403221.1740 16635693.3500 14097560.0800 9739790.0380 6420153.9850 11330152.3200 12644675.2600 11241099.0200 8820327.7350 15735882.1300 9778145.9530 12039594.0500 16459288.5900 7046659.7260 16004737.2300 15011394.8600 15541710.6300 15377371.5400 12753353.7200 12972677.8600 12950250.7600 12715159.2800 12562437.2000 12393131.9800 10715864.2100 12074323.8700 14146853.7600 13951629.7000 14112937.9700 13171144.0900 1899.9015 4794.4320 17716854.9000 17748552.2700 17779793.0300 16255406.8900 16099132.4700 15706798.9800 14879211.8200 15131036.5800 14721657.4300 7416216.5220 6991119.8740 8809336.1460 5790975.8130 9619240.6640 7949492.0450 7657480.1130 8549544.5610 9223490.2280 12252912.2600 12174908.4700 11320549.2700 12167277.8700 5526791.6720 5482219.0140 7721590.5740 9309723.1190 10114821.4000 8343044.0430 7831290.1740 10209886.0700 9726067.1720 9119968.7810 8942472.7860 Uridine Monophosphate UMP 11579.9597 15545.8061 23298.9927 18633.5420 8064.5207 9300.9843 16943.0866 15734.6527 13492.6357 19035.3841 15802.0932 13025.1932 30819.1854 15795.9688 11980.0412 9701.4512 11024.0405 9050.0272 26077.1203 5334.5505 6105.6683 7814.8198 11987.8247 4916.9636 7170.5540 9394.5264 12255.6443 6816.9811 14177.9318 12777.1073 18140.5802 8606.2992 5023.9552 8195.4624 11091.4278 7761.6162 10691.6318 22904.1737 24975.8450 10091.8214 5355.6066 20391.2034 19128.0073 16529.1901 22321.0744 6872.5935 8391.8737 4932.8321 7424.3025 14904.1558 16796.0226 8617.4420 22433.7045 4542.1957 7432.5184 8630.4079 5898.5618 11052.0560 7015.1107 18460.8448 6451.7880 11248.0401 9047.2097 7716.6620 4147.5283 11788.5554 9677.5474 5047.4263 11602.1498 8359.0689 13155.4564 10836.5446 8299.3493 6114.9618 11778.3932 7226.7801 21791.6775 10324.7811 7900.0766 10259.0239 9813.5489 9240.0824 24548.8093 28096.8467 6519.7643 8303.1097 8303.0355 15302.6461 6896.4491 7555.3804 7730.5580 3847.9666 9334.3632 8777.4240 13440.5500 5187.1228 6545.9145 13191.6786 15003.2870 7595.3871 6538.1288 10387.3862 8099.0898 7758.9461 8757.9492 11307.7021 9143.4593 39474.6179 13862.7881 6789.6431 10705.9608 9070.3814 11268.0336 8727.8957 9031.4232 15700.0856 7278.8970 7009.8247 29375.4210 9216.6301 6425.8089 12942.3463 14670.8389 13014.8188 6151.7183 45738.8026 31309.2912 8881.8161 12761.0522 9451.8249 12083.8839 6731.9992 22643.4664 15375.6223 7986.2605 21205.1694 10617.3148 9147.0255 11315.1291 10764.7152 7728.3297 6968.3604 6847.6021 9024.3927 8243.5579 11050.8223 5826.0192 15943.2145 26802.3155 9624.2138 10620.5225 5716.3029 15224.1328 11815.9758 7884.8098 10282.2910 6213.5169 10174.2990 11845.8301 3289.2938 7979.4109 6048.2648 17392.4117 8522.7876 8492.9417 2853.3079 8174.8833 7668.9921 6162.8636 8797.0100 6349.7651 11826.8296 9133.5672 10082.0639 7665.3042 7943.0602 7607.4463 10607.5251 10308.9466 8970.7628 7186.6181 14414.1383 15187.5606 14615.4481 15450.3694 15339.4620 14826.7671 15840.6739 18132.5488 17812.2833 10568.2194 8693.1472 9818.7587 8877.2247 11398.3478 9512.2240 9183.2905 6424.7083 11077.5420 11256.2913 14129.5017 14793.7353 11493.5535 12463.9895 12634.5828 13114.1323 12754.3679 11607.4556 15039.2970 14358.4292 14832.7275 13981.0906 9750.3819 12070.5398 Xanthine_R1 Xanthine 1492427.1680 1420292.1110 1330087.5940 2061734.9210 2752340.5780 2086634.3260 1321089.9960 2870663.5060 1274184.3030 1623031.8930 1004585.6720 455424.3420 1500792.6420 1787778.4800 2358035.7630 3335821.9260 1751419.6140 1790033.3420 1604863.3630 2019467.0760 2580435.8400 5316655.3210 1420557.4790 2295354.9130 1368087.1510 1781186.6770 1520690.3390 1997442.5070 1912598.5220 1485609.4520 2435634.0470 1627078.6410 1825890.5110 2394235.3260 1564398.4290 2009756.1200 1612268.9900 1292998.1910 857832.7994 2990354.3380 2235285.9400 1360830.3980 1189794.1360 2242455.1690 868012.1944 2963550.2330 2597540.2250 1816406.2300 2522867.5300 2163129.9040 2109152.7540 2055772.4350 2023618.9710 1735598.4180 4035476.4890 3162964.6630 1524216.1680 3251281.5200 3133247.2560 764792.6016 3708431.5360 1554877.6770 1162678.2150 1876963.7940 1135614.1450 1965214.1990 2439092.9480 2220958.2880 1805508.9460 3014435.9990 2114190.8280 2547925.5390 1914740.2410 1761091.9840 1666773.0690 2533829.5240 1699460.0900 1539333.1240 3262039.9710 1246540.8950 1378542.8450 3136941.6020 1683482.8810 1311206.9610 1105359.6310 1651761.5140 2254281.1380 1780259.2080 1543591.5660 3830451.4980 3901595.5660 3617296.7770 1282765.0050 2283913.5430 2399300.4360 2553965.1090 1614626.4800 1565319.5590 747756.5099 883742.8365 5160333.9660 2428926.4050 2560793.0960 1013587.9950 1731869.6360 4090014.5140 2752167.6040 1573775.2800 1677009.0830 3269117.5750 2543036.9200 1330935.4840 670738.0786 1341092.9910 1724761.3210 1030116.4050 1375710.3230 2070196.7230 1536837.2670 1329610.3730 2178538.2610 1485783.9150 1555093.7630 2359040.8820 2340798.9790 1073504.9920 1555960.6630 2396664.4520 1043738.0760 1905312.0460 4192525.1210 1524597.7550 1480055.9240 1437167.2120 1643090.1870 1576008.0740 1902578.1430 2138850.4600 945641.5978 1686406.9070 1142293.2840 2177497.6000 3762899.1410 2585787.1550 2512402.7010 1510151.6600 1656667.3400 3602190.4140 1312506.7650 1538396.6830 2832711.6690 1959552.7920 1438910.5400 2043005.4710 2487430.7400 742033.4277 1450498.7140 3040813.0200 1067144.5200 2930872.6710 607691.6377 1657275.0160 3165584.6690 1220540.4480 1485919.6180 1500949.8060 1441351.2320 1462058.7710 1474995.8050 1309852.3340 1277716.9700 1292308.1140 1225261.8220 1108518.3210 1111627.6760 1069521.1710 1127991.9660 1405474.3790 1294953.9140 1188307.0220 1135896.4360 1500701.9450 1446763.6120 1498944.4060 1368284.5630 1343188.5040 1327827.5070 1233998.8320 1271901.3630 1297301.3400 2165345.7950 2126779.3060 2165119.4740 2094498.7460 2118725.9380 2201353.2500 1882000.8850 1803763.7130 1767820.9570 2058950.8450 2157977.2550 1820110.4500 1819543.9220 1674908.5960 1796840.3820 1689031.9830 1796394.7870 2000540.7110 2126177.7170 2062980.8580 2036793.9090 1979779.6140 1699891.8710 1735981.5990 Xanthine_R2 Xanthine 1451856.4990 1460841.9190 1291423.7660 2004013.6260 2687431.5670 2026398.5580 1348513.3270 2798227.2510 1292440.5130 1577567.1640 976678.4691 484325.3644 1505041.9130 1756115.5570 2307876.4930 3261030.1540 1703467.8490 1747255.9240 1568108.5740 1961069.1100 2517907.9920 5190239.6720 1487375.3970 2241055.2930 1400577.1760 1733883.2840 1476721.7040 1995415.8860 1866338.1420 1494329.2700 2366884.5510 1595622.9530 1775126.6700 2334873.8710 1520626.3170 1962345.2650 1586538.5240 1258903.9720 834547.3088 2923923.2330 2185383.7100 1325107.3960 1168189.7260 2192046.0050 848003.5600 2878199.0960 2527061.8450 1763472.2240 2461276.0150 2099871.0380 2051872.3200 1995129.3540 1995995.2470 1695794.5390 3941578.4140 3067008.1300 1539137.8180 3163696.3230 3062081.0800 769777.4611 3635880.6690 1509618.9640 1130883.7880 1832571.7040 1106907.8160 1921988.5060 2383037.9090 2164221.8980 1756471.4350 2930015.7210 2078364.3770 2486512.9310 1859610.8560 1707376.8100 1633499.3610 2475638.9340 1652252.6630 1499322.3410 3170898.8100 1217428.5030 1339223.0980 3042705.3310 1646948.0830 1282098.0980 1073884.8900 1634184.7580 2279251.5460 1736286.0800 1506493.6990 3735965.4580 3790472.1370 3538908.2210 1246762.5530 2220479.7450 2407913.5430 2493808.7100 1563660.1020 1600854.2250 735168.8726 856674.0543 5012669.9120 2371357.7470 2507838.4350 986981.2141 1677708.2660 3994896.0930 2689264.1060 1544100.3540 1631652.4630 3181889.1990 2458907.4850 1298526.4860 686337.6765 1303224.9610 1683367.0190 1000259.5670 1343010.4900 2025383.1610 1543491.4250 1279068.7910 2123702.6650 1460158.5820 1497680.6650 2293857.9520 2290087.7040 1042095.6470 1512135.5300 2330227.9650 1044213.3020 1854818.1130 4074717.7160 1482440.0270 1435975.1770 1427049.0500 1596075.9330 1531517.8150 1847293.9590 2173396.0910 954107.1968 1636568.1500 1111231.7330 2120540.4930 3670938.3680 2542606.5790 2450813.7170 1459477.1340 1619344.4070 3510431.1270 1337595.3770 1562693.8370 2753228.9650 1911937.7250 1364339.1710 1985049.2620 2420762.2410 768538.7159 1495994.0320 2953168.9180 1119210.7530 2863836.1310 593619.4679 1610219.6300 3075925.8810 1188203.1460 1512749.1370 1468007.5110 1409587.8800 1427251.8510 1441812.0620 1276469.4560 1240214.7980 1254353.5640 1192721.8370 1086390.3920 1082778.7490 1040261.8620 1098183.2540 1366791.7210 1275297.5280 1151293.1970 1100232.8420 1523602.2300 1456400.9430 1525476.1080 1327872.7380 1304698.7480 1289987.2100 1197005.8300 1271994.0950 1261985.2700 2114655.4790 2076380.8430 2112790.0730 2044490.7780 2067692.6050 2148120.6910 1835608.9060 1760669.7940 1739311.1080 2001964.0890 2147754.6140 1770314.6850 1769813.6310 1628196.9550 1747170.0420 1696659.9500 1741153.9540 1944397.5650 2066391.9120 2011088.0370 2051479.7910 1978380.2270 1649058.5860 1684530.5630 Xanthosine_R1 Xanthosine 127654.7193 209665.4365 143694.8121 278449.5620 110458.1393 124726.0664 200593.2354 144413.6499 138225.7500 142836.7480 93789.7215 91051.7933 183562.6861 169016.2924 121950.5890 196263.5679 116654.9374 166030.4950 134035.8627 212817.1689 176086.5554 211536.4480 223879.6261 102285.8443 174381.9381 192329.1002 134881.1863 260402.4584 166856.1474 151673.5708 141727.7828 93104.0415 100558.8917 123408.8846 96514.5629 161107.2007 110898.9793 238344.7458 89268.9226 279130.1099 129473.9062 103855.5652 136789.3422 177143.3399 65406.8893 151868.7794 155062.5541 118078.2343 164238.5166 141563.8012 175053.5680 283130.3724 164638.5148 93988.0281 147985.8731 150654.7243 211332.2917 226668.5500 180327.5480 133009.6782 157640.7462 217694.4713 182706.6699 159242.8073 96118.7026 140532.1485 171738.8841 116672.7808 83963.5978 145335.7000 163116.3881 248859.7915 196643.3014 141032.7255 262513.4257 193795.9327 160751.3836 99086.0980 192196.9597 90701.4387 117699.2752 222991.3342 109617.0976 118334.3671 168198.4320 227067.8212 208461.9535 113361.1129 94974.9567 201993.7169 199179.3792 137819.3330 148408.9515 140500.4896 237015.5678 139586.9389 143576.7127 156267.1614 159288.1649 117640.5880 210277.5395 117982.2351 136371.6851 177459.5439 139333.1755 232303.0727 190750.4294 356128.9033 183051.0866 173387.9922 121998.4517 103788.2580 110628.5345 72029.3689 252894.8760 88824.4021 194515.2284 210939.4195 153834.2235 263178.8851 114149.9741 166644.3945 152671.2351 153470.7036 234247.6300 203501.6183 149247.4045 151259.5098 129795.9831 190682.9768 176925.1046 104984.2078 149626.0094 137663.7819 129175.5603 142507.4986 105622.8681 195440.7671 103057.0014 136890.9263 134036.3366 136879.0423 182658.4099 193332.8847 147055.6693 108221.7185 86557.8735 191599.9471 207512.4771 203761.3187 144136.9414 122559.1280 153064.5281 141639.8672 168428.1361 119138.7945 156781.4066 174852.5539 279329.1223 217765.3661 91374.3003 109107.3129 181395.2872 228752.1891 126399.8253 167642.0160 165503.6384 203268.0770 199257.5340 167344.9692 167295.8267 169383.1183 170438.5928 165419.8055 158201.0013 151850.8506 159899.7693 176365.8441 171639.9937 157803.6017 156577.7456 139846.3461 143266.4390 140010.9925 144968.0580 156804.8360 153822.4238 140098.0409 147935.0456 142145.7487 150804.2241 145613.9130 181066.1849 179837.7560 178189.9322 172634.7679 143691.3683 140661.8086 141841.2233 194899.0707 204103.7386 177246.6048 172694.5010 151242.2365 163211.0893 135479.3140 147720.2221 149606.7177 189159.4748 184379.4190 187043.1663 183852.5534 169964.8353 161076.4756 Xanthosine_R2 Xanthosine 93235.0921 163176.6256 109537.6508 243139.0787 82010.1543 99994.4221 181049.3212 120914.9221 100676.3938 118739.7329 66657.3825 80211.5047 151928.9092 138199.2564 90745.6672 153844.8694 88654.3479 128944.0033 102112.5181 214276.3639 141305.0060 168074.5170 179123.4774 78691.9851 164953.4477 203834.4162 104464.4158 235702.9797 134925.0939 121843.4426 111564.6555 73864.7842 75494.6833 92707.4499 67617.2290 123334.4858 107094.8257 201644.1259 64778.7295 226523.9275 96499.9624 96437.4818 103570.5847 137560.0161 48259.9666 119234.1736 120455.8064 92280.2455 164352.7129 133980.4957 129516.3393 261898.7284 132524.3408 89089.1443 107868.0861 115317.0237 170582.8405 204047.2165 160152.2761 125293.3660 151599.0169 114638.9490 148439.6232 151880.8180 69705.8429 102813.3887 153570.2583 87224.0712 62622.7939 109169.7158 143761.7360 232337.3665 158661.9526 115428.6295 217293.8128 149510.2187 119809.3378 72554.5881 183430.8866 62468.7467 91312.5486 171989.5983 80360.3237 82366.3143 128055.3783 194253.3515 165545.5387 85510.5101 69884.9908 167284.8277 155532.4021 100764.1279 116454.3330 105633.6971 193061.3477 100149.5488 109288.5470 149766.2991 132773.1645 93069.3061 169496.1906 86641.5240 96870.4824 147602.0393 115849.1909 188621.4408 155710.1151 323571.1642 157788.9341 183891.2114 90949.0935 110721.3950 104379.0480 58156.6358 189594.2031 62146.1468 160295.5679 165088.3935 122963.4070 226732.2829 116295.8115 145208.1904 120003.4684 117889.7700 186759.3163 168027.6458 117445.2792 114407.6079 112656.3730 149559.0260 135761.7110 96022.8641 120751.1175 105061.8409 99372.2920 108573.3941 74808.5192 191502.9634 79244.4396 91931.5854 104922.9005 98040.9065 140387.1261 150709.8820 112092.8468 115557.3581 63366.7110 156298.7183 172996.5643 195367.0717 111907.4351 92197.1538 120332.3367 106413.0990 138275.6143 95106.9729 120880.6996 145140.5409 256768.1067 211974.5685 80870.8324 108685.3555 148572.8625 203085.6992 94432.4697 158751.2060 140677.0032 163790.7649 160088.9897 136272.3948 139189.0053 139243.4438 140101.6896 131782.3476 142230.0484 128809.9642 128176.0635 144902.6960 143978.7060 131152.0473 129559.2605 136559.9966 115343.7704 115094.9142 120658.7139 144311.9672 126960.3765 118639.2711 124065.8615 120717.0089 119502.5208 118150.8979 140079.0271 132899.9696 136873.2852 128615.9114 108751.1210 109961.0436 111526.3775 190806.7432 159411.6477 140487.2019 133856.9330 140820.5914 151365.4792 131278.1827 141780.5468 114195.9187 151715.5649 149556.0963 149876.7817 143943.2871 137338.8490 127663.2214 Xanthurenate Xanthurenic acid 334516.6085 874862.6496 333517.3351 200025.5597 276508.5528 319296.1863 494512.4604 324572.1991 203024.3397 320035.9524 622642.0166 709345.1112 158561.0584 367829.0778 182377.1392 174096.9453 212938.6099 269906.1951 687431.8310 190039.9538 124595.0052 444111.9616 428512.6568 271012.1216 438435.2851 267342.6523 686300.0281 240870.0739 341564.7971 275327.5523 236437.5392 237030.1508 297301.4864 347741.8158 350753.5644 581881.1675 167008.8223 370312.8412 165967.2707 380821.4799 773660.2524 606071.5670 263201.6985 307314.2912 367310.5816 368994.1049 223035.6266 433760.8590 461918.3627 395078.6418 444443.5790 241567.4630 298413.5025 239741.3163 310386.6509 246841.9289 576552.9596 287717.0066 343502.7144 211025.6825 416906.3396 246123.5277 236473.2851 158360.2092 558586.8603 208133.0844 407859.0671 418798.4964 304141.9197 404461.5530 373972.1012 502444.2924 331367.4685 170624.1615 513260.2515 570061.1282 293962.0584 323555.7464 249040.5424 273371.7695 480242.4437 555241.8100 349247.0026 1120242.3860 315597.7445 308417.6429 447499.4788 385007.8419 177892.3304 312993.3262 360838.7751 293969.6284 339796.5491 198963.2795 516623.5396 303286.9284 448450.6176 226590.0376 374137.8357 354401.2551 404135.4598 312763.6852 240721.9130 513053.2584 171325.4052 333995.7851 189186.0699 560129.7946 278041.3362 195345.3772 471562.0088 723481.5479 1107294.5150 428033.8975 249284.4062 623677.7974 512736.2546 199398.4170 285286.2195 408988.0663 158646.8796 676518.9567 552623.7058 251349.0507 376166.3717 481230.6143 230868.1725 233235.6883 191689.2945 254351.1110 162823.3406 562980.4367 207083.9737 420665.9416 216550.5953 309325.7795 246311.2864 417525.6539 944969.8129 472811.1607 302367.8405 275155.2822 201672.1238 230599.8003 347179.6152 544560.9356 176013.1705 222297.0440 660292.9635 296138.3063 155227.0534 282341.2690 560342.6713 187962.9300 109025.9397 280654.8573 370382.2386 449307.6424 544107.6903 371157.3425 599936.7376 316485.6512 603717.1369 365327.9536 251512.7068 427145.8001 441004.3299 425682.9207 474341.8274 372558.6986 339815.5656 378667.9817 332928.1893 390984.7037 393266.9592 385782.8331 395595.7507 406039.9103 342600.4083 337458.5416 316381.3594 397943.5638 398133.0383 399836.5829 303048.8624 343970.6013 314137.1689 296527.1027 291034.1122 321749.3998 347184.3492 355316.2178 372906.0772 344199.0424 357168.1151 396982.3552 346068.6962 319267.4708 291118.5109 390341.2919 371232.7100 360728.8414 373657.4788 316647.2196 351116.7540 360944.5931 328064.6507 383650.6616 318273.2846 314343.6436 311953.3688 306667.4745 278451.7151 314886.3810