#METABOLOMICS WORKBENCH RCulpHill_20210108_135718 DATATRACK_ID:2387 STUDY_ID:ST001644 ANALYSIS_ID:AN002690 PROJECT_ID:PR001052 VERSION 1 CREATED_ON January 12, 2021, 12:16 pm #PROJECT PR:PROJECT_TITLE In Vitro Characterization and Metabolomic Analysis of Cold-Stored Platelets PR:PROJECT_SUMMARY Platelet concentrates are currently stored at room temperature (RPs) under PR:PROJECT_SUMMARY constant agitation for up to 5-7 days depending on national regulations. PR:PROJECT_SUMMARY However, platelet quality deteriorates during storage and room temperature PR:PROJECT_SUMMARY storage also increases the risk of bacterial growth. Previous studies have shown PR:PROJECT_SUMMARY that cold-stored platelets (CPs) have higher hemostatic function and can be PR:PROJECT_SUMMARY stored for up to three weeks. While these studies have compared the metabolic PR:PROJECT_SUMMARY phenotypes of CPs and RPs, they have not compared the impact of storage PR:PROJECT_SUMMARY temperature and cold agitation (CPAs) on platelet function, nor have they PR:PROJECT_SUMMARY identified metabolic correlates to such parameters. In vitro analysis showed PR:PROJECT_SUMMARY CPAs and CPs had reduced count, faster CD62P expression and increased PR:PROJECT_SUMMARY lactadherin binding. Furthermore, CPAs and CPs had higher maximal aggregation PR:PROJECT_SUMMARY and a reduced aggregation lag phase compared to RPs. Metabolomic analysis PR:PROJECT_SUMMARY revealed CPAs and CPs exhibited lower oxidative stress shown by preserved PR:PROJECT_SUMMARY glutathione and pentose phosphate pools. CPAs and CPs also had reduced markers PR:PROJECT_SUMMARY of beta-oxidation and amino acid catabolism demonstrating reduced needs for PR:PROJECT_SUMMARY energy. Agitation did not significantly impact in vitro function or metabolomic PR:PROJECT_SUMMARY parameters of cold-stored platelets. Correlation of in vitro and metabolomic PR:PROJECT_SUMMARY results highlighted important metabolites that may contribute to stored platelet PR:PROJECT_SUMMARY functions. PR:INSTITUTE University of Colorado Anschutz Medical Campus PR:DEPARTMENT Biochemistry and Molecular Genetics PR:LABORATORY Angelo D'Alessandro PR:LAST_NAME D'Alessandro PR:FIRST_NAME Angelo PR:ADDRESS 12801 E 17th Ave L18-9403D, Aurora, Colorado, 80045, USA PR:EMAIL angelo.dalessandro@cuanschutz.edu PR:PHONE 303-724-5798 #STUDY ST:STUDY_TITLE In Vitro Characterization and Metabolomic Analysis of Cold-Stored Platelets ST:STUDY_SUMMARY Platelet concentrates are currently stored at room temperature (RPs) under ST:STUDY_SUMMARY constant agitation for up to 5-7 days depending on national regulations. ST:STUDY_SUMMARY However, platelet quality deteriorates during storage and room temperature ST:STUDY_SUMMARY storage also increases the risk of bacterial growth. Previous studies have shown ST:STUDY_SUMMARY that cold-stored platelets (CPs) have higher hemostatic function and can be ST:STUDY_SUMMARY stored for up to three weeks. While these studies have compared the metabolic ST:STUDY_SUMMARY phenotypes of CPs and RPs, they have not compared the impact of storage ST:STUDY_SUMMARY temperature and cold agitation (CPAs) on platelet function, nor have they ST:STUDY_SUMMARY identified metabolic correlates to such parameters. In vitro analysis showed ST:STUDY_SUMMARY CPAs and CPs had reduced count, faster CD62P expression and increased ST:STUDY_SUMMARY lactadherin binding. Furthermore, CPAs and CPs had higher maximal aggregation ST:STUDY_SUMMARY and a reduced aggregation lag phase compared to RPs. Metabolomic analysis ST:STUDY_SUMMARY revealed CPAs and CPs exhibited lower oxidative stress shown by preserved ST:STUDY_SUMMARY glutathione and pentose phosphate pools. CPAs and CPs also had reduced markers ST:STUDY_SUMMARY of beta-oxidation and amino acid catabolism demonstrating reduced needs for ST:STUDY_SUMMARY energy. Agitation did not significantly impact in vitro function or metabolomic ST:STUDY_SUMMARY parameters of cold-stored platelets. Correlation of in vitro and metabolomic ST:STUDY_SUMMARY results highlighted important metabolites that may contribute to stored platelet ST:STUDY_SUMMARY functions. ST:INSTITUTE University of Colorado Anschutz Medical Campus ST:DEPARTMENT Biochemistry and Molecular Genetics ST:LABORATORY Angelo D'Alessandro ST:LAST_NAME D'Alessandro ST:FIRST_NAME Angelo ST:ADDRESS 12801 E 17th Ave L18-9403D ST:EMAIL angelo.dalessandro@cuanschutz.edu ST:PHONE 3037245798 ST:NUM_GROUPS 3 ST:TOTAL_SUBJECTS 8 #SUBJECT SU:SUBJECT_TYPE Human SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS B1 1_B1_D1_RT+ Treatment:RT | Day:1 RAW_FILE_NAME=1_B1_D1_RT+ SUBJECT_SAMPLE_FACTORS B2 11_B2_D1_RT+ Treatment:RT | Day:1 RAW_FILE_NAME=11_B2_D1_RT+ SUBJECT_SAMPLE_FACTORS B3 21_B3_D1_RT+ Treatment:RT | Day:1 RAW_FILE_NAME=21_B3_D1_RT+ SUBJECT_SAMPLE_FACTORS B4 31_B4_D1_RT+ Treatment:RT | Day:1 RAW_FILE_NAME=31_B4_D1_RT+ SUBJECT_SAMPLE_FACTORS B5 41_B5_D1_RT+ Treatment:RT | Day:1 RAW_FILE_NAME=41_B5_D1_RT+ 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RAW_FILE_NAME=67_B7_D7_4NS- SUBJECT_SAMPLE_FACTORS B8 77_B8_D7_4NS- Treatment:4NS | Day:7 RAW_FILE_NAME=77_B8_D7_4NS- SUBJECT_SAMPLE_FACTORS B1 10_B1_D14_4NS- Treatment:4NS | Day:14 RAW_FILE_NAME=10_B1_D14_4NS- SUBJECT_SAMPLE_FACTORS B2 20_B2_D14_4NS- Treatment:4NS | Day:14 RAW_FILE_NAME=20_B2_D14_4NS- SUBJECT_SAMPLE_FACTORS B3 30_B3_D14_4NS- Treatment:4NS | Day:14 RAW_FILE_NAME=30_B3_D14_4NS- SUBJECT_SAMPLE_FACTORS B4 40_B4_D14_4NS- Treatment:4NS | Day:14 RAW_FILE_NAME=40_B4_D14_4NS- SUBJECT_SAMPLE_FACTORS B5 50_B5_D14_4NS- Treatment:4NS | Day:14 RAW_FILE_NAME=50_B5_D14_4NS- SUBJECT_SAMPLE_FACTORS B6 60_B6_D14_4NS- Treatment:4NS | Day:14 RAW_FILE_NAME=60_B6_D14_4NS- SUBJECT_SAMPLE_FACTORS B7 70_B7_D14_4NS- Treatment:4NS | Day:14 RAW_FILE_NAME=70_B7_D14_4NS- SUBJECT_SAMPLE_FACTORS B8 80_B8_D14_4NS- Treatment:4NS | Day:14 RAW_FILE_NAME=80_B8_D14_4NS- #COLLECTION CO:COLLECTION_SUMMARY Whole blood was collected by Canadian Blood Services from donors providing CO:COLLECTION_SUMMARY signed informed consent. Buffy coat platelet concentrates suspended in plasma CO:COLLECTION_SUMMARY were produced by the Canadian Blood Services Blood4Research Facility in CO:COLLECTION_SUMMARY Vancouver, Canada. For each biological replicate, three buffy coat platelet CO:COLLECTION_SUMMARY units were pooled and split into three identical platelet units to minimize the CO:COLLECTION_SUMMARY effect of donor variability. One unit (RP) was stored at 22°C under constant CO:COLLECTION_SUMMARY agitation (Helmer Scientific, PC1200-Pro Platelet Incubator, Noblesville, IN). CO:COLLECTION_SUMMARY One unit (CPA) was stored in a walk-in fridge (4°C) in a platelet agitator CO:COLLECTION_SUMMARY (Forma platelet agitator, Thermo Electron Corporation. Waltham, MA). The last CO:COLLECTION_SUMMARY unit (CP) was stored in walk-in fridge (4°C) without agitation. Platelet units CO:COLLECTION_SUMMARY were sampled through a coupling port (Fresenius Kabi, Bad Homburg, Germany) CO:COLLECTION_SUMMARY using a sterile syringe in a biosafety cabinet. Platelet units were sampled on CO:COLLECTION_SUMMARY days 1, 2, 4, 7, 9, 11, and 14 of storage. This study was approved by both the CO:COLLECTION_SUMMARY University of British Columbia Ethics Committee (H17-02708) and the Canadian CO:COLLECTION_SUMMARY Blood Services Ethics Board (2018-003). CO:SAMPLE_TYPE Platelets #TREATMENT TR:TREATMENT_SUMMARY Whole blood was collected by Canadian Blood Services from donors providing TR:TREATMENT_SUMMARY signed informed consent. Buffy coat platelet concentrates suspended in plasma TR:TREATMENT_SUMMARY were produced by the Canadian Blood Services Blood4Research Facility in TR:TREATMENT_SUMMARY Vancouver, Canada. For each biological replicate, three buffy coat platelet TR:TREATMENT_SUMMARY units were pooled and split into three identical platelet units to minimize the TR:TREATMENT_SUMMARY effect of donor variability. One unit (RP) was stored at 22°C under constant TR:TREATMENT_SUMMARY agitation (Helmer Scientific, PC1200-Pro Platelet Incubator, Noblesville, IN). TR:TREATMENT_SUMMARY One unit (CPA) was stored in a walk-in fridge (4°C) in a platelet agitator TR:TREATMENT_SUMMARY (Forma platelet agitator, Thermo Electron Corporation. Waltham, MA). The last TR:TREATMENT_SUMMARY unit (CP) was stored in walk-in fridge (4°C) without agitation. Platelet units TR:TREATMENT_SUMMARY were sampled through a coupling port (Fresenius Kabi, Bad Homburg, Germany) TR:TREATMENT_SUMMARY using a sterile syringe in a biosafety cabinet. Platelet units were sampled on TR:TREATMENT_SUMMARY days 1, 2, 4, 7, 9, 11, and 14 of storage. This study was approved by both the TR:TREATMENT_SUMMARY University of British Columbia Ethics Committee (H17-02708) and the Canadian TR:TREATMENT_SUMMARY Blood Services Ethics Board (2018-003). #SAMPLEPREP SP:SAMPLEPREP_SUMMARY A volume of 50μl of platelet concentrates were extracted at a 1:10 dilution in SP:SAMPLEPREP_SUMMARY methanol:acetonitrile:water (5:3:2, v/v/v). After vortexing at 4°C for 30 min, SP:SAMPLEPREP_SUMMARY extracts were separated from the protein pellet by centrifugation for 10 min at SP:SAMPLEPREP_SUMMARY 10,000g at 4°C and stored at −80°C until analysis. For polar metabolites, SP:SAMPLEPREP_SUMMARY half of the extracts were dried down via SpeedVac prior to resuspension in ddH2O SP:SAMPLEPREP_SUMMARY + 0.1% formic acid, to facilitate ionization and chromatographic resolution of SP:SAMPLEPREP_SUMMARY certain polar metabolites (e.g., betaine, kyurenine, etc.). #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY UHPLC-MS metabolomics analyses were performed as described,(1, 3) using a CH:CHROMATOGRAPHY_SUMMARY Vanquish UHPLC system coupled online to a high-resolution Q Exactive mass CH:CHROMATOGRAPHY_SUMMARY spectrometer (Thermo Fisher, Bremen, Germany). Samples were resolved over a CH:CHROMATOGRAPHY_SUMMARY Kinetex C18 column (2.1x150 mm, 1.7 µm; Phenomenex, Torrance, CA, USA) at CH:CHROMATOGRAPHY_SUMMARY 45°C. A volume of 10 μl of sample extracts was injected into the UHPLC-MS. CH:CHROMATOGRAPHY_SUMMARY Each sample was injected and run with two different chromatographic and MS CH:CHROMATOGRAPHY_SUMMARY conditions, using a 5 minute gradient at 450 µL/minute from 5-95% B (A: CH:CHROMATOGRAPHY_SUMMARY water/0.1% formic acid; B:acetonitrile/0.1% formic acid) and the MS was operated CH:CHROMATOGRAPHY_SUMMARY in positive mode. CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Thermo Vanquish CH:COLUMN_NAME Phenomenex Kinetex C18 (150 x 2.1mm, 2.6 um) #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS The UHPLC system was coupled online with a Q Exactive (Thermo, San Jose, CA, MS:MS_COMMENTS USA) scanning in Full MS mode at 70,000 resolution in the 60-900 m/z range, 4 kV MS:MS_COMMENTS spray voltage, 15 sheath gas and 5 auxiliary gas, operated in negative or MS:MS_COMMENTS positive ion mode (separate runs). #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS Relative Abundance MS_METABOLITE_DATA_START Samples 1_B1_D1_RT+ 11_B2_D1_RT+ 21_B3_D1_RT+ 31_B4_D1_RT+ 41_B5_D1_RT+ 51_B6_D1_RT+ 61_B7_D1_RT+ 71_B8_D1_RT+ 2_B1_D2_RT+ 12_B2_D2_RT+ 22_B3_D2_RT+ 32_B4_D2_RT+ 42_B5_D2_RT+ 52_B6_D2_RT+ 62_B7_D2_RT+ 72_B8_D2_RT+ 5_B1_D7_RT+ 15_B2_D7_RT+ 25_B3_D7_RT+ 35_B4_D7_RT+ 45_B5_D7_RT+ 55_B6_D7_RT+ 65_B7_D7_RT+ 75_B8_D7_RT+ 8_B1_D14_RT+ 18_B2_D14_RT+ 28_B3_D14_RT+ 38_B4_D14_RT+ 48_B5_D14_RT+ 58_B6_D14_RT+ 68_B7_D14_RT+ 78_B8_D14_RT+ 3_B1_D2_4S+ 13_B2_D2_4S+ 23_B3_D2_4S+ 33_B4_D2_4S+ 43_B5_D2_4S+ 53_B6_D2_4S+ 63_B7_D2_4S+ 73_B8_D2_4S+ 6_B1_D7_4S+ 16_B2_D7_4S+ 26_B3_D7_4S+ 36_B4_D7_4S+ 46_B5_D7_4S+ 56_B6_D7_4S+ 66_B7_D7_4S+ 76_B8_D7_4S+ 9_B1_D14_4S+ 19_B2_D14_4S+ 29_B3_D14_4S+ 39_B4_D14_4S+ 49_B5_D14_4S+ 59_B6_D14_4S+ 69_B7_D14_4S+ 79_B8_D14_4S+ 4_B1_D2_4NS+ 14_B2_D2_4NS+ 24_B3_D2_4NS+ 34_B4_D2_4NS+ 44_B5_D2_4NS+ 54_B6_D2_4NS+ 64_B7_D2_4NS+ 74_B8_D2_4NS+ 7_B1_D7_4NS+ 17_B2_D7_4NS+ 27_B3_D7_4NS+ 37_B4_D7_4NS+ 47_B5_D7_4NS+ 57_B6_D7_4NS+ 67_B7_D7_4NS+ 77_B8_D7_4NS+ 10_B1_D14_4NS+ 20_B2_D14_4NS+ 30_B3_D14_4NS+ 40_B4_D14_4NS+ 50_B5_D14_4NS+ 60_B6_D14_4NS+ 70_B7_D14_4NS+ 80_B8_D14_4NS+ Factors Treatment:RT | Day:1 Treatment:RT | Day:1 Treatment:RT | Day:1 Treatment:RT | Day:1 Treatment:RT | Day:1 Treatment:RT | Day:1 Treatment:RT | Day:1 Treatment:RT | Day:1 Treatment:RT | Day:2 Treatment:RT | Day:2 Treatment:RT | Day:2 Treatment:RT | Day:2 Treatment:RT | Day:2 Treatment:RT | Day:2 Treatment:RT | Day:2 Treatment:RT | Day:2 Treatment:RT | Day:7 Treatment:RT | Day:7 Treatment:RT | Day:7 Treatment:RT | Day:7 Treatment:RT | Day:7 Treatment:RT | Day:7 Treatment:RT | Day:7 Treatment:RT | Day:7 Treatment:RT | Day:14 Treatment:RT | Day:14 Treatment:RT | Day:14 Treatment:RT | Day:14 Treatment:RT | Day:14 Treatment:RT | Day:14 Treatment:RT | Day:14 Treatment:RT | Day:14 Treatment:4S | Day:2 Treatment:4S | Day:2 Treatment:4S | Day:2 Treatment:4S | Day:2 Treatment:4S | Day:2 Treatment:4S | Day:2 Treatment:4S | Day:2 Treatment:4S | Day:2 Treatment:4S | Day:7 Treatment:4S | Day:7 Treatment:4S | Day:7 Treatment:4S | Day:7 Treatment:4S | Day:7 Treatment:4S | Day:7 Treatment:4S | Day:7 Treatment:4S | Day:7 Treatment:4S | Day:14 Treatment:4S | Day:14 Treatment:4S | Day:14 Treatment:4S | Day:14 Treatment:4S | Day:14 Treatment:4S | Day:14 Treatment:4S | Day:14 Treatment:4S | Day:14 Treatment:4NS | Day:2 Treatment:4NS | Day:2 Treatment:4NS | Day:2 Treatment:4NS | Day:2 Treatment:4NS | Day:2 Treatment:4NS | Day:2 Treatment:4NS | Day:2 Treatment:4NS | Day:2 Treatment:4NS | Day:7 Treatment:4NS | Day:7 Treatment:4NS | Day:7 Treatment:4NS | Day:7 Treatment:4NS | Day:7 Treatment:4NS | Day:7 Treatment:4NS | Day:7 Treatment:4NS | Day:7 Treatment:4NS | Day:14 Treatment:4NS | Day:14 Treatment:4NS | Day:14 Treatment:4NS | Day:14 Treatment:4NS | Day:14 Treatment:4NS | Day:14 Treatment:4NS | Day:14 Treatment:4NS | Day:14 L-alanine 20800000.00 22900000.00 21100000.00 21400000.00 19100000.00 19900000.00 21100000.00 22300000.00 20600000.00 23500000.00 22400000.00 24700000.00 24000000.00 20500000.00 19500000.00 24100000.00 25700000.00 25800000.00 23900000.00 22000000.00 23400000.00 23700000.00 23700000.00 23900000.00 30400000.00 28300000.00 26200000.00 29800000.00 26100000.00 26500000.00 27900000.00 28100000.00 22900000.00 20900000.00 22400000.00 23500000.00 20700000.00 20700000.00 20300000.00 22600000.00 23000000.00 20500000.00 19900000.00 24200000.00 20900000.00 17600000.00 18600000.00 20400000.00 25500000.00 22900000.00 20700000.00 23300000.00 21200000.00 19100000.00 18200000.00 23300000.00 20200000.00 21300000.00 22900000.00 20700000.00 18600000.00 20800000.00 19300000.00 24900000.00 20800000.00 22200000.00 27200000.00 25200000.00 20700000.00 22300000.00 16300000.00 24100000.00 22100000.00 20200000.00 22900000.00 22300000.00 19200000.00 20000000.00 20400000.00 24700000.00 L-arginine 1360000.00 1700000.00 1690000.00 2410000.00 735000.00 983000.00 1100000.00 1390000.00 1220000.00 2020000.00 2610000.00 2210000.00 1080000.00 1330000.00 1290000.00 1660000.00 2790000.00 1890000.00 2580000.00 2570000.00 1890000.00 2460000.00 1980000.00 2410000.00 3570000.00 3240000.00 3780000.00 3700000.00 2560000.00 2630000.00 3060000.00 3540000.00 1090000.00 1160000.00 1980000.00 2630000.00 1030000.00 1270000.00 1140000.00 1650000.00 1470000.00 1280000.00 1580000.00 2190000.00 1130000.00 1020000.00 1180000.00 1480000.00 2030000.00 1550000.00 2180000.00 2190000.00 1710000.00 1270000.00 1230000.00 1620000.00 992000.00 1480000.00 1730000.00 2070000.00 878000.00 1400000.00 1180000.00 1250000.00 1320000.00 1320000.00 2040000.00 1970000.00 952000.00 1310000.00 967000.00 1650000.00 1620000.00 1560000.00 2020000.00 2640000.00 940000.00 1440000.00 1350000.00 1910000.00 L-asparagine 723000.00 587000.00 525000.00 806000.00 632000.00 735000.00 544000.00 627000.00 635000.00 694000.00 709000.00 752000.00 679000.00 543000.00 562000.00 648000.00 434000.00 494000.00 426000.00 370000.00 430000.00 436000.00 452000.00 434000.00 286000.00 361000.00 334000.00 297000.00 311000.00 245000.00 225000.00 222000.00 598000.00 833000.00 471000.00 749000.00 737000.00 674000.00 475000.00 659000.00 510000.00 551000.00 553000.00 572000.00 632000.00 582000.00 469000.00 492000.00 554000.00 568000.00 509000.00 600000.00 432000.00 536000.00 409000.00 430000.00 552000.00 555000.00 585000.00 746000.00 726000.00 776000.00 643000.00 664000.00 655000.00 743000.00 592000.00 588000.00 688000.00 470000.00 526000.00 635000.00 476000.00 503000.00 530000.00 638000.00 508000.00 562000.00 510000.00 431000.00 L-aspartate 184000.00 133000.00 150000.00 182000.00 136000.00 151000.00 132000.00 176000.00 163000.00 108000.00 151000.00 155000.00 123000.00 177000.00 96900.00 151000.00 116000.00 193000.00 161000.00 148000.00 126000.00 180000.00 142000.00 121000.00 159000.00 116000.00 166000.00 159000.00 117000.00 155000.00 158000.00 190000.00 182000.00 115000.00 162000.00 190000.00 115000.00 153000.00 165000.00 179000.00 195000.00 136000.00 148000.00 189000.00 215000.00 183000.00 180000.00 248000.00 239000.00 209000.00 241000.00 263000.00 260000.00 206000.00 234000.00 279000.00 113000.00 109000.00 168000.00 150000.00 103000.00 159000.00 129000.00 138000.00 193000.00 139000.00 146000.00 285000.00 170000.00 190000.00 224000.00 199000.00 226000.00 229000.00 224000.00 271000.00 223000.00 233000.00 261000.00 223000.00 L-cysteine 315000.00 705000.00 392000.00 390000.00 199000.00 585000.00 585000.00 692000.00 436000.00 462000.00 411000.00 302000.00 391000.00 546000.00 827000.00 955000.00 308000.00 293000.00 759000.00 422000.00 524000.00 504000.00 439000.00 409000.00 566000.00 321000.00 675000.00 384000.00 370000.00 401000.00 509000.00 273000.00 250000.00 468000.00 102000.00 555000.00 619000.00 644000.00 842000.00 480000.00 352000.00 394000.00 805000.00 647000.00 696000.00 710000.00 740000.00 212000.00 405000.00 291000.00 546000.00 376000.00 1000000.00 650000.00 382000.00 300000.00 585000.00 279000.00 275000.00 406000.00 333000.00 843000.00 748000.00 1020000.00 517000.00 389000.00 503000.00 503000.00 276000.00 936000.00 563000.00 644000.00 457000.00 319000.00 530000.00 435000.00 475000.00 626000.00 361000.00 225000.00 L-glutamate 7950000.00 7300000.00 7130000.00 6570000.00 5100000.00 5830000.00 8120000.00 7270000.00 11600000.00 9380000.00 9930000.00 8850000.00 8300000.00 7480000.00 8600000.00 9110000.00 15000000.00 12300000.00 12400000.00 11700000.00 12500000.00 13800000.00 16300000.00 13100000.00 13600000.00 10800000.00 11400000.00 10300000.00 10900000.00 12000000.00 12500000.00 8110000.00 6510000.00 8440000.00 5550000.00 9050000.00 6230000.00 6770000.00 5430000.00 5630000.00 9300000.00 7360000.00 8280000.00 7190000.00 9390000.00 6770000.00 8950000.00 8240000.00 13200000.00 10400000.00 10200000.00 9900000.00 11200000.00 9550000.00 10200000.00 9620000.00 6610000.00 5310000.00 5200000.00 7050000.00 7000000.00 7850000.00 5990000.00 8140000.00 8970000.00 9070000.00 7900000.00 10300000.00 7280000.00 8250000.00 8300000.00 8220000.00 10500000.00 8280000.00 8540000.00 10700000.00 8440000.00 9140000.00 11500000.00 8760000.00 L-glutamine 23700000.00 23800000.00 20400000.00 21300000.00 20700000.00 22200000.00 21800000.00 20000000.00 20200000.00 19100000.00 19400000.00 20500000.00 22900000.00 17700000.00 16900000.00 19000000.00 7970000.00 5940000.00 6050000.00 7150000.00 8260000.00 6870000.00 8100000.00 7130000.00 1190000.00 760000.00 1290000.00 1340000.00 1500000.00 1070000.00 1090000.00 917000.00 22300000.00 20700000.00 20500000.00 26200000.00 21000000.00 21800000.00 16800000.00 17500000.00 20700000.00 17000000.00 17800000.00 18900000.00 21300000.00 15600000.00 14900000.00 16800000.00 17600000.00 15900000.00 15900000.00 16500000.00 14900000.00 13700000.00 14000000.00 12900000.00 21000000.00 17500000.00 20300000.00 22000000.00 21700000.00 19400000.00 18000000.00 22100000.00 19900000.00 21700000.00 17500000.00 15000000.00 18900000.00 18400000.00 15600000.00 16200000.00 15400000.00 13900000.00 15000000.00 18500000.00 15500000.00 15300000.00 15700000.00 13000000.00 glycine 1360000.00 1440000.00 1140000.00 1190000.00 1340000.00 1210000.00 1260000.00 1050000.00 1420000.00 1460000.00 1130000.00 1300000.00 1560000.00 1150000.00 1360000.00 983000.00 1320000.00 1750000.00 1490000.00 1230000.00 1250000.00 1240000.00 1520000.00 1160000.00 1860000.00 1780000.00 1500000.00 1500000.00 1700000.00 1680000.00 1650000.00 1420000.00 1250000.00 1440000.00 1260000.00 1020000.00 1220000.00 1220000.00 1160000.00 1020000.00 1300000.00 1640000.00 1170000.00 1130000.00 1170000.00 1120000.00 1110000.00 1150000.00 1350000.00 1790000.00 1300000.00 1180000.00 1250000.00 1420000.00 1290000.00 1090000.00 1320000.00 1320000.00 1170000.00 958000.00 1260000.00 1100000.00 1100000.00 1260000.00 1070000.00 1740000.00 1500000.00 1730000.00 1470000.00 1220000.00 1220000.00 1220000.00 1370000.00 1550000.00 1280000.00 1200000.00 1260000.00 1100000.00 1210000.00 1100000.00 L-histidine 3690000.00 4470000.00 3950000.00 4020000.00 3920000.00 4150000.00 3600000.00 4560000.00 4150000.00 4190000.00 3910000.00 4010000.00 4870000.00 4350000.00 3290000.00 3560000.00 4500000.00 4090000.00 4550000.00 4720000.00 4440000.00 5070000.00 3150000.00 4660000.00 5460000.00 5520000.00 5410000.00 4230000.00 5490000.00 4620000.00 4580000.00 4980000.00 3530000.00 4400000.00 4040000.00 4390000.00 3620000.00 4450000.00 2990000.00 3850000.00 4680000.00 4210000.00 4290000.00 3990000.00 4160000.00 4300000.00 3820000.00 4370000.00 4160000.00 4780000.00 3640000.00 3890000.00 4200000.00 4090000.00 3510000.00 4150000.00 4020000.00 3590000.00 4120000.00 3980000.00 3730000.00 4380000.00 2930000.00 4550000.00 3830000.00 4250000.00 4110000.00 4080000.00 4330000.00 4220000.00 3110000.00 3840000.00 4290000.00 4120000.00 3580000.00 4600000.00 4030000.00 3930000.00 3440000.00 3470000.00 L-leucine 134000000.00 126000000.00 113000000.00 138000000.00 101000000.00 112000000.00 172000000.00 116000000.00 162000000.00 90300000.00 149000000.00 150000000.00 126000000.00 119000000.00 137000000.00 100000000.00 153000000.00 146000000.00 93200000.00 132000000.00 124000000.00 138000000.00 163000000.00 145000000.00 191000000.00 159000000.00 118000000.00 192000000.00 129000000.00 130000000.00 175000000.00 158000000.00 107000000.00 138000000.00 97300000.00 150000000.00 108000000.00 105000000.00 117000000.00 101000000.00 149000000.00 107000000.00 116000000.00 112000000.00 90300000.00 111000000.00 126000000.00 123000000.00 149000000.00 159000000.00 174000000.00 139000000.00 88100000.00 102000000.00 191000000.00 157000000.00 127000000.00 100000000.00 85000000.00 139000000.00 111000000.00 135000000.00 119000000.00 140000000.00 147000000.00 153000000.00 121000000.00 128000000.00 106000000.00 109000000.00 152000000.00 114000000.00 155000000.00 118000000.00 135000000.00 143000000.00 97100000.00 118000000.00 174000000.00 128000000.00 L-isoleucine 43000000.00 27400000.00 38500000.00 41200000.00 32800000.00 33200000.00 41500000.00 36700000.00 36800000.00 38100000.00 42000000.00 45700000.00 32200000.00 39400000.00 44400000.00 32300000.00 48500000.00 42600000.00 35400000.00 48600000.00 42200000.00 43100000.00 46200000.00 46100000.00 48400000.00 52500000.00 61100000.00 64900000.00 57200000.00 58600000.00 52800000.00 62900000.00 45300000.00 32200000.00 32200000.00 42800000.00 36600000.00 40700000.00 32000000.00 41100000.00 44700000.00 34200000.00 35700000.00 39900000.00 33000000.00 41200000.00 47500000.00 41400000.00 39900000.00 43900000.00 39000000.00 52800000.00 34000000.00 30600000.00 46200000.00 43500000.00 35600000.00 39100000.00 42000000.00 43000000.00 37800000.00 41100000.00 43100000.00 39200000.00 34600000.00 42100000.00 40000000.00 38100000.00 35400000.00 34900000.00 45800000.00 39700000.00 42100000.00 37800000.00 36600000.00 41700000.00 38500000.00 36600000.00 49300000.00 43600000.00 L-lysine 12100000.00 11600000.00 13400000.00 14800000.00 11000000.00 11000000.00 13600000.00 15000000.00 12000000.00 14100000.00 12200000.00 14300000.00 14300000.00 13100000.00 11600000.00 12500000.00 13800000.00 14700000.00 12600000.00 15000000.00 14400000.00 16100000.00 14300000.00 16500000.00 17200000.00 19100000.00 18800000.00 20300000.00 20800000.00 15700000.00 15500000.00 18300000.00 11500000.00 13100000.00 10200000.00 15000000.00 11100000.00 13700000.00 10300000.00 13900000.00 14500000.00 11800000.00 13000000.00 11000000.00 11500000.00 9700000.00 12300000.00 15000000.00 12500000.00 13200000.00 14400000.00 17100000.00 11800000.00 12300000.00 13000000.00 15400000.00 11800000.00 13800000.00 12400000.00 15200000.00 13200000.00 13000000.00 11900000.00 16200000.00 11600000.00 15200000.00 13200000.00 13700000.00 13400000.00 10700000.00 13100000.00 12900000.00 12700000.00 12200000.00 11100000.00 14300000.00 10400000.00 9880000.00 12100000.00 15200000.00 L-methionine 22900000.00 26800000.00 22000000.00 29100000.00 23000000.00 23800000.00 21300000.00 21600000.00 22000000.00 27400000.00 26900000.00 22400000.00 27400000.00 25700000.00 23100000.00 28400000.00 28900000.00 26100000.00 23900000.00 33800000.00 28700000.00 27300000.00 26000000.00 25700000.00 31900000.00 33200000.00 33200000.00 33200000.00 31500000.00 32800000.00 33400000.00 27200000.00 21900000.00 20600000.00 18400000.00 31000000.00 22900000.00 25100000.00 18800000.00 23400000.00 24400000.00 24400000.00 24800000.00 28200000.00 23100000.00 25100000.00 21800000.00 22400000.00 23300000.00 22300000.00 24100000.00 27900000.00 27300000.00 26300000.00 22500000.00 22700000.00 26200000.00 24500000.00 27100000.00 24200000.00 21100000.00 24400000.00 21500000.00 26000000.00 23900000.00 23200000.00 21300000.00 21100000.00 23100000.00 28300000.00 19800000.00 26100000.00 24700000.00 22400000.00 22300000.00 32100000.00 24600000.00 26800000.00 20300000.00 27200000.00 L-phenylalanine 17500000.00 12100000.00 16400000.00 16700000.00 14100000.00 13300000.00 16200000.00 14600000.00 14700000.00 15500000.00 15500000.00 16100000.00 14500000.00 14200000.00 14200000.00 12300000.00 22700000.00 17700000.00 14800000.00 15500000.00 19200000.00 18200000.00 16700000.00 20900000.00 21100000.00 22100000.00 21600000.00 23900000.00 24300000.00 22100000.00 19000000.00 26100000.00 17200000.00 12800000.00 14500000.00 17000000.00 14300000.00 14800000.00 10600000.00 15400000.00 17900000.00 13500000.00 14100000.00 15100000.00 15100000.00 15200000.00 14100000.00 17300000.00 16300000.00 16500000.00 16000000.00 18700000.00 12400000.00 12200000.00 14800000.00 18500000.00 13100000.00 15300000.00 15800000.00 15700000.00 15300000.00 15800000.00 14600000.00 17500000.00 15600000.00 14800000.00 15800000.00 15300000.00 14400000.00 14100000.00 13600000.00 15400000.00 18000000.00 15800000.00 14800000.00 16000000.00 14400000.00 13500000.00 16400000.00 17100000.00 L-proline 178000000.00 146000000.00 159000000.00 168000000.00 146000000.00 149000000.00 127000000.00 133000000.00 177000000.00 154000000.00 149000000.00 144000000.00 150000000.00 141000000.00 129000000.00 170000000.00 168000000.00 141000000.00 181000000.00 215000000.00 175000000.00 171000000.00 148000000.00 147000000.00 214000000.00 173000000.00 194000000.00 184000000.00 203000000.00 180000000.00 219000000.00 174000000.00 178000000.00 136000000.00 157000000.00 156000000.00 144000000.00 130000000.00 138000000.00 139000000.00 158000000.00 145000000.00 197000000.00 167000000.00 165000000.00 151000000.00 130000000.00 156000000.00 178000000.00 135000000.00 188000000.00 173000000.00 178000000.00 155000000.00 151000000.00 128000000.00 171000000.00 126000000.00 153000000.00 153000000.00 139000000.00 147000000.00 138000000.00 174000000.00 167000000.00 143000000.00 155000000.00 145000000.00 143000000.00 162000000.00 127000000.00 148000000.00 152000000.00 143000000.00 164000000.00 161000000.00 159000000.00 147000000.00 133000000.00 137000000.00 L-serine 1200000.00 1120000.00 1130000.00 1170000.00 1130000.00 1190000.00 1070000.00 1080000.00 1210000.00 1240000.00 1040000.00 1170000.00 1220000.00 1030000.00 1090000.00 881000.00 915000.00 1060000.00 955000.00 837000.00 1160000.00 725000.00 834000.00 819000.00 1160000.00 1050000.00 1030000.00 904000.00 1100000.00 890000.00 930000.00 611000.00 1260000.00 1230000.00 1010000.00 1080000.00 943000.00 1220000.00 805000.00 875000.00 1300000.00 1180000.00 1210000.00 1060000.00 1170000.00 1040000.00 927000.00 1050000.00 1280000.00 1550000.00 1240000.00 1150000.00 1320000.00 1120000.00 1180000.00 1120000.00 1030000.00 1050000.00 958000.00 1270000.00 1330000.00 1020000.00 945000.00 1150000.00 1120000.00 1380000.00 1240000.00 1420000.00 988000.00 955000.00 914000.00 1020000.00 1220000.00 1280000.00 1130000.00 1160000.00 1220000.00 1200000.00 1100000.00 1050000.00 L-threonine 7930000.00 6530000.00 6540000.00 7810000.00 7200000.00 6600000.00 5780000.00 7120000.00 7140000.00 6320000.00 6310000.00 7750000.00 8420000.00 5260000.00 4480000.00 6540000.00 7010000.00 7340000.00 7080000.00 7110000.00 8380000.00 6240000.00 6220000.00 8470000.00 9360000.00 8050000.00 7260000.00 8350000.00 9000000.00 7560000.00 7810000.00 8000000.00 7010000.00 7610000.00 6310000.00 7130000.00 6330000.00 5860000.00 4860000.00 5800000.00 6400000.00 6480000.00 6950000.00 7200000.00 7290000.00 5320000.00 4740000.00 7220000.00 8390000.00 7760000.00 7540000.00 7260000.00 6430000.00 6260000.00 5790000.00 7290000.00 6950000.00 5830000.00 6270000.00 7410000.00 7950000.00 6090000.00 5150000.00 8350000.00 7350000.00 8280000.00 7520000.00 7550000.00 6390000.00 5480000.00 5220000.00 7110000.00 7240000.00 6500000.00 6920000.00 7870000.00 7040000.00 6390000.00 6110000.00 6910000.00 L-tryptophan 88300000.00 71000000.00 95100000.00 88800000.00 85800000.00 99600000.00 87800000.00 101000000.00 91900000.00 81700000.00 103000000.00 102000000.00 111000000.00 115000000.00 88800000.00 84000000.00 135000000.00 101000000.00 75300000.00 85100000.00 131000000.00 130000000.00 110000000.00 125000000.00 108000000.00 130000000.00 120000000.00 123000000.00 121000000.00 147000000.00 98000000.00 145000000.00 100000000.00 80100000.00 92900000.00 97000000.00 100000000.00 120000000.00 76400000.00 120000000.00 118000000.00 74200000.00 88800000.00 96700000.00 97500000.00 110000000.00 81500000.00 124000000.00 102000000.00 104000000.00 107000000.00 119000000.00 88400000.00 97900000.00 94800000.00 121000000.00 87400000.00 93700000.00 87700000.00 123000000.00 111000000.00 120000000.00 101000000.00 122000000.00 87000000.00 96100000.00 98300000.00 96100000.00 109000000.00 96300000.00 87600000.00 98700000.00 117000000.00 87000000.00 94800000.00 98400000.00 96700000.00 95300000.00 95100000.00 108000000.00 L-tyrosine 65200000.00 51000000.00 60600000.00 70500000.00 61100000.00 56900000.00 59500000.00 54500000.00 61900000.00 65900000.00 70100000.00 53300000.00 63400000.00 59600000.00 63200000.00 61100000.00 75600000.00 58300000.00 64000000.00 74200000.00 75600000.00 64500000.00 53900000.00 61200000.00 77300000.00 72600000.00 76100000.00 73400000.00 74900000.00 57500000.00 80600000.00 63100000.00 61600000.00 53300000.00 50300000.00 72300000.00 66100000.00 58500000.00 57100000.00 59300000.00 69800000.00 61700000.00 65900000.00 63100000.00 61700000.00 50000000.00 50300000.00 55200000.00 63700000.00 59500000.00 64800000.00 62600000.00 66100000.00 59200000.00 61300000.00 57300000.00 75300000.00 61600000.00 70400000.00 58900000.00 61400000.00 59300000.00 61700000.00 64900000.00 66300000.00 58400000.00 62900000.00 48100000.00 63200000.00 67900000.00 56800000.00 55700000.00 67700000.00 56800000.00 60000000.00 74300000.00 67400000.00 63600000.00 56300000.00 52100000.00 L-valine 240000000.00 208000000.00 231000000.00 304000000.00 242000000.00 241000000.00 265000000.00 242000000.00 232000000.00 243000000.00 267000000.00 242000000.00 229000000.00 201000000.00 270000000.00 249000000.00 265000000.00 240000000.00 234000000.00 325000000.00 264000000.00 247000000.00 226000000.00 260000000.00 267000000.00 232000000.00 221000000.00 305000000.00 240000000.00 234000000.00 315000000.00 260000000.00 241000000.00 209000000.00 206000000.00 303000000.00 232000000.00 257000000.00 243000000.00 205000000.00 241000000.00 233000000.00 265000000.00 294000000.00 192000000.00 217000000.00 237000000.00 247000000.00 244000000.00 229000000.00 258000000.00 284000000.00 246000000.00 247000000.00 265000000.00 244000000.00 273000000.00 204000000.00 280000000.00 254000000.00 231000000.00 236000000.00 272000000.00 285000000.00 260000000.00 238000000.00 239000000.00 200000000.00 242000000.00 217000000.00 248000000.00 257000000.00 261000000.00 239000000.00 195000000.00 258000000.00 244000000.00 258000000.00 245000000.00 235000000.00 L-cystine 594000.00 503000.00 440000.00 461000.00 498000.00 391000.00 548000.00 407000.00 410000.00 400000.00 535000.00 430000.00 484000.00 436000.00 556000.00 444000.00 237000.00 170000.00 167000.00 106000.00 148000.00 166000.00 143000.00 212000.00 121000.00 145000.00 155000.00 157000.00 146000.00 170000.00 126000.00 148000.00 495000.00 394000.00 640000.00 385000.00 590000.00 509000.00 500000.00 488000.00 381000.00 354000.00 433000.00 288000.00 468000.00 423000.00 523000.00 339000.00 236000.00 166000.00 229000.00 267000.00 272000.00 230000.00 211000.00 325000.00 358000.00 433000.00 474000.00 296000.00 565000.00 497000.00 571000.00 448000.00 362000.00 304000.00 429000.00 163000.00 493000.00 364000.00 414000.00 446000.00 238000.00 276000.00 312000.00 273000.00 317000.00 264000.00 297000.00 366000.00 Adenosine 502000.00 407000.00 369000.00 448000.00 370000.00 413000.00 317000.00 565000.00 762000.00 820000.00 887000.00 741000.00 785000.00 491000.00 647000.00 647000.00 586000.00 537000.00 557000.00 703000.00 445000.00 611000.00 1040000.00 633000.00 157000.00 123000.00 131000.00 138000.00 147000.00 64600.00 271000.00 202000.00 422000.00 668000.00 434000.00 437000.00 617000.00 435000.00 543000.00 413000.00 664000.00 806000.00 362000.00 696000.00 820000.00 628000.00 672000.00 708000.00 402000.00 567000.00 523000.00 583000.00 495000.00 581000.00 714000.00 598000.00 454000.00 432000.00 532000.00 424000.00 540000.00 377000.00 456000.00 602000.00 527000.00 662000.00 663000.00 372000.00 402000.00 710000.00 944000.00 564000.00 584000.00 592000.00 445000.00 442000.00 338000.00 418000.00 520000.00 453000.00 Adenine 826000.00 761000.00 808000.00 768000.00 763000.00 879000.00 818000.00 1170000.00 1040000.00 781000.00 874000.00 717000.00 892000.00 868000.00 949000.00 1170000.00 708000.00 614000.00 1090000.00 912000.00 787000.00 935000.00 904000.00 1010000.00 596000.00 358000.00 537000.00 512000.00 726000.00 855000.00 676000.00 663000.00 707000.00 788000.00 911000.00 865000.00 983000.00 936000.00 959000.00 1170000.00 705000.00 734000.00 891000.00 959000.00 882000.00 1330000.00 936000.00 1070000.00 647000.00 690000.00 774000.00 879000.00 730000.00 707000.00 729000.00 844000.00 880000.00 777000.00 852000.00 922000.00 927000.00 1270000.00 900000.00 1180000.00 677000.00 787000.00 1030000.00 741000.00 783000.00 1090000.00 1330000.00 1120000.00 607000.00 576000.00 633000.00 655000.00 643000.00 654000.00 826000.00 843000.00 GMP 968000.00 741000.00 769000.00 835000.00 660000.00 797000.00 692000.00 994000.00 765000.00 630000.00 825000.00 600000.00 704000.00 720000.00 557000.00 820000.00 436000.00 421000.00 452000.00 451000.00 569000.00 543000.00 805000.00 872000.00 486000.00 290000.00 376000.00 271000.00 303000.00 400000.00 347000.00 467000.00 778000.00 671000.00 814000.00 753000.00 956000.00 850000.00 616000.00 1000000.00 726000.00 780000.00 744000.00 436000.00 499000.00 754000.00 776000.00 807000.00 636000.00 473000.00 690000.00 480000.00 374000.00 450000.00 558000.00 803000.00 664000.00 569000.00 857000.00 715000.00 682000.00 983000.00 677000.00 781000.00 668000.00 678000.00 912000.00 275000.00 439000.00 609000.00 883000.00 783000.00 537000.00 493000.00 490000.00 379000.00 382000.00 342000.00 654000.00 774000.00 Guanine 664000.00 1000000.00 751000.00 1150000.00 812000.00 800000.00 754000.00 882000.00 883000.00 1010000.00 945000.00 1010000.00 979000.00 726000.00 759000.00 744000.00 1030000.00 817000.00 922000.00 1320000.00 1050000.00 898000.00 821000.00 939000.00 1280000.00 1210000.00 941000.00 1230000.00 986000.00 1290000.00 1320000.00 1300000.00 728000.00 770000.00 731000.00 1110000.00 825000.00 682000.00 749000.00 721000.00 887000.00 800000.00 864000.00 1170000.00 594000.00 791000.00 674000.00 678000.00 819000.00 830000.00 793000.00 961000.00 962000.00 930000.00 838000.00 755000.00 897000.00 856000.00 896000.00 850000.00 763000.00 944000.00 757000.00 995000.00 813000.00 893000.00 753000.00 874000.00 780000.00 977000.00 648000.00 867000.00 912000.00 858000.00 677000.00 1060000.00 901000.00 873000.00 680000.00 955000.00 Cytidine 20100.00 27700.00 19600.00 14600.00 35700.00 20600.00 22200.00 26000.00 70500.00 49300.00 65400.00 58700.00 14100.00 42600.00 16400.00 40500.00 610000.00 436000.00 423000.00 560000.00 284000.00 228000.00 173000.00 176000.00 861000.00 862000.00 837000.00 1020000.00 446000.00 323000.00 432000.00 339000.00 31700.00 8130.00 38200.00 10900.00 25100.00 22900.00 7200.00 16100.00 37600.00 48100.00 80100.00 21900.00 35400.00 28800.00 13500.00 32800.00 139000.00 181000.00 160000.00 41200.00 81000.00 57100.00 65100.00 80700.00 23100.00 20400.00 17100.00 9990.00 15300.00 5650.00 38300.00 22000.00 45500.00 22500.00 19700.00 79600.00 22700.00 29600.00 23800.00 16600.00 30500.00 72400.00 61700.00 22900.00 23400.00 27200.00 18300.00 21200.00 IMP 476000.00 358000.00 548000.00 453000.00 430000.00 462000.00 450000.00 754000.00 374000.00 232000.00 331000.00 177000.00 240000.00 427000.00 211000.00 423000.00 248000.00 206000.00 208000.00 273000.00 261000.00 326000.00 211000.00 486000.00 272000.00 379000.00 300000.00 375000.00 233000.00 259000.00 242000.00 506000.00 746000.00 576000.00 803000.00 719000.00 696000.00 770000.00 586000.00 1010000.00 813000.00 714000.00 810000.00 500000.00 429000.00 968000.00 716000.00 945000.00 816000.00 479000.00 705000.00 358000.00 383000.00 455000.00 548000.00 723000.00 672000.00 656000.00 728000.00 730000.00 570000.00 842000.00 785000.00 1050000.00 659000.00 746000.00 795000.00 313000.00 577000.00 593000.00 713000.00 760000.00 958000.00 633000.00 826000.00 497000.00 425000.00 441000.00 981000.00 1090000.00 Hypoxanthine 5840000.00 5270000.00 4270000.00 5180000.00 6460000.00 3970000.00 5360000.00 6110000.00 7660000.00 8250000.00 8680000.00 7320000.00 8650000.00 5400000.00 7270000.00 8420000.00 24400000.00 23200000.00 23300000.00 22500000.00 25100000.00 19000000.00 23300000.00 23000000.00 64600000.00 68400000.00 67500000.00 61600000.00 53400000.00 54100000.00 65500000.00 61900000.00 7990000.00 10000000.00 7840000.00 9960000.00 12300000.00 6290000.00 9260000.00 12200000.00 28500000.00 26300000.00 24600000.00 23400000.00 28700000.00 24800000.00 24200000.00 27200000.00 59400000.00 50600000.00 47300000.00 51100000.00 46000000.00 55500000.00 52300000.00 57600000.00 9440000.00 8830000.00 10400000.00 8460000.00 11100000.00 8340000.00 9760000.00 12000000.00 24000000.00 24800000.00 26000000.00 52700000.00 24700000.00 23900000.00 24500000.00 27200000.00 52600000.00 46900000.00 38800000.00 51000000.00 49500000.00 48700000.00 45600000.00 53600000.00 Xanthine 309000.00 288000.00 313000.00 311000.00 312000.00 270000.00 327000.00 338000.00 578000.00 510000.00 719000.00 404000.00 533000.00 476000.00 354000.00 264000.00 2050000.00 1550000.00 1290000.00 1080000.00 1700000.00 1570000.00 1480000.00 1590000.00 3090000.00 4170000.00 3700000.00 3790000.00 3040000.00 2940000.00 2720000.00 3310000.00 340000.00 409000.00 270000.00 429000.00 498000.00 274000.00 293000.00 385000.00 1000000.00 865000.00 697000.00 500000.00 806000.00 842000.00 700000.00 817000.00 1910000.00 1870000.00 1720000.00 1850000.00 1120000.00 1440000.00 1780000.00 1720000.00 393000.00 545000.00 335000.00 311000.00 484000.00 406000.00 343000.00 441000.00 785000.00 1010000.00 839000.00 1460000.00 577000.00 516000.00 653000.00 790000.00 1790000.00 1640000.00 1480000.00 1290000.00 1500000.00 1100000.00 1530000.00 1740000.00 5-Hydroxyisourate 153000.00 127000.00 170000.00 129000.00 111000.00 119000.00 167000.00 142000.00 88300.00 170000.00 155000.00 116000.00 166000.00 154000.00 101000.00 94600.00 75500.00 30700.00 39600.00 24700.00 52400.00 23200.00 47800.00 38100.00 18300.00 0.00 0.00 0.00 0.00 0.00 5880.00 0.00 142000.00 99400.00 138000.00 187000.00 163000.00 145000.00 141000.00 143000.00 168000.00 50300.00 102000.00 141000.00 137000.00 96600.00 96800.00 109000.00 81800.00 94400.00 79300.00 57100.00 130000.00 60900.00 105000.00 73000.00 107000.00 151000.00 129000.00 92700.00 86300.00 170000.00 139000.00 89500.00 153000.00 106000.00 183000.00 98300.00 66800.00 129000.00 152000.00 120000.00 96100.00 86000.00 58700.00 172000.00 80900.00 92400.00 84900.00 80500.00 Nicotinamide 4860000.00 3610000.00 4200000.00 3870000.00 4470000.00 5450000.00 4350000.00 5300000.00 4200000.00 4440000.00 4590000.00 3870000.00 3940000.00 4030000.00 4990000.00 5880000.00 4280000.00 3760000.00 5120000.00 4410000.00 4840000.00 3900000.00 4390000.00 4430000.00 5100000.00 3630000.00 4960000.00 4000000.00 4730000.00 4850000.00 5730000.00 4690000.00 5570000.00 3250000.00 4420000.00 3620000.00 4790000.00 4140000.00 5020000.00 5110000.00 4330000.00 3150000.00 5560000.00 4250000.00 4260000.00 3830000.00 4290000.00 4780000.00 3860000.00 4620000.00 4600000.00 3780000.00 6150000.00 4940000.00 3710000.00 4870000.00 5020000.00 3380000.00 4130000.00 3970000.00 3930000.00 3410000.00 4390000.00 5600000.00 3930000.00 3710000.00 4240000.00 3560000.00 4190000.00 5380000.00 3740000.00 5120000.00 4100000.00 2930000.00 4200000.00 3620000.00 3870000.00 3880000.00 3710000.00 5380000.00 Glutathione 582000.00 578000.00 556000.00 621000.00 480000.00 671000.00 474000.00 583000.00 277000.00 332000.00 216000.00 215000.00 339000.00 318000.00 284000.00 357000.00 43000.00 62400.00 65400.00 44300.00 138000.00 78600.00 112000.00 108000.00 60300.00 89700.00 0.00 99700.00 78000.00 0.00 43000.00 90300.00 464000.00 378000.00 283000.00 442000.00 511000.00 482000.00 549000.00 357000.00 496000.00 459000.00 329000.00 350000.00 331000.00 430000.00 403000.00 244000.00 247000.00 233000.00 357000.00 302000.00 344000.00 345000.00 270000.00 184000.00 687000.00 402000.00 447000.00 418000.00 357000.00 588000.00 338000.00 516000.00 342000.00 398000.00 342000.00 145000.00 462000.00 571000.00 377000.00 309000.00 330000.00 324000.00 314000.00 400000.00 479000.00 355000.00 345000.00 255000.00 5-Oxoproline 19100000.00 19900000.00 16200000.00 17300000.00 16600000.00 17700000.00 16900000.00 16800000.00 16200000.00 15800000.00 15200000.00 15800000.00 18100000.00 15300000.00 15200000.00 15700000.00 10500000.00 20500000.00 7880000.00 7860000.00 8900000.00 8530000.00 9870000.00 8150000.00 15300000.00 26400000.00 17500000.00 28200000.00 23000000.00 17300000.00 3630000.00 21500000.00 17500000.00 14900000.00 14300000.00 17200000.00 16300000.00 13500000.00 14000000.00 15200000.00 17300000.00 14700000.00 14000000.00 14900000.00 14300000.00 12600000.00 12600000.00 13200000.00 14700000.00 13200000.00 13200000.00 13800000.00 15000000.00 11400000.00 12700000.00 11900000.00 16800000.00 13600000.00 15700000.00 16500000.00 17100000.00 19700000.00 14100000.00 16200000.00 16800000.00 17400000.00 14200000.00 12800000.00 13800000.00 15100000.00 13300000.00 13600000.00 13300000.00 11100000.00 13000000.00 16500000.00 12900000.00 13200000.00 14200000.00 11500000.00 gamma-L-Glutamyl-D-alanine 1280000.00 1150000.00 964000.00 1010000.00 911000.00 1180000.00 612000.00 1100000.00 573000.00 548000.00 618000.00 532000.00 520000.00 404000.00 424000.00 480000.00 262000.00 189000.00 262000.00 298000.00 266000.00 287000.00 326000.00 338000.00 167000.00 74400.00 117000.00 106000.00 155000.00 69300.00 153000.00 73600.00 628000.00 739000.00 586000.00 613000.00 590000.00 517000.00 565000.00 553000.00 503000.00 349000.00 409000.00 427000.00 407000.00 461000.00 430000.00 422000.00 557000.00 315000.00 303000.00 607000.00 362000.00 454000.00 433000.00 387000.00 783000.00 688000.00 720000.00 825000.00 673000.00 835000.00 479000.00 561000.00 359000.00 401000.00 536000.00 294000.00 320000.00 389000.00 344000.00 482000.00 473000.00 419000.00 330000.00 366000.00 288000.00 392000.00 396000.00 387000.00 (5-L-Glutamyl)-L-glutamine 789000.00 868000.00 623000.00 758000.00 629000.00 776000.00 610000.00 588000.00 408000.00 286000.00 267000.00 224000.00 305000.00 270000.00 247000.00 231000.00 74700.00 63600.00 32700.00 29700.00 73500.00 42100.00 67600.00 58800.00 0.00 0.00 0.00 0.00 15700.00 0.00 17300.00 17500.00 321000.00 450000.00 382000.00 378000.00 353000.00 288000.00 278000.00 398000.00 329000.00 222000.00 192000.00 288000.00 236000.00 260000.00 294000.00 362000.00 226000.00 138000.00 181000.00 253000.00 199000.00 173000.00 177000.00 142000.00 345000.00 278000.00 283000.00 374000.00 382000.00 427000.00 190000.00 350000.00 285000.00 327000.00 209000.00 167000.00 248000.00 228000.00 330000.00 290000.00 255000.00 204000.00 165000.00 245000.00 223000.00 108000.00 277000.00 180000.00 L-Homocysteine 854000.00 1230000.00 810000.00 910000.00 1090000.00 1220000.00 741000.00 1230000.00 984000.00 1150000.00 637000.00 962000.00 1050000.00 1010000.00 870000.00 1400000.00 834000.00 1260000.00 912000.00 943000.00 999000.00 1010000.00 874000.00 971000.00 1200000.00 1200000.00 715000.00 1150000.00 1130000.00 1080000.00 1120000.00 1190000.00 1130000.00 1210000.00 876000.00 841000.00 944000.00 848000.00 966000.00 1030000.00 833000.00 926000.00 917000.00 1080000.00 861000.00 1010000.00 825000.00 1170000.00 832000.00 1180000.00 917000.00 947000.00 901000.00 1000000.00 901000.00 1110000.00 1060000.00 1180000.00 871000.00 829000.00 1060000.00 828000.00 811000.00 1190000.00 918000.00 1250000.00 769000.00 1010000.00 941000.00 1150000.00 851000.00 1210000.00 1000000.00 1290000.00 690000.00 856000.00 997000.00 951000.00 886000.00 1010000.00 Dimethylglycine 4360000.00 3790000.00 4040000.00 4360000.00 3860000.00 3520000.00 4890000.00 4520000.00 4760000.00 3850000.00 3860000.00 3690000.00 4300000.00 3840000.00 4400000.00 5820000.00 4340000.00 3040000.00 4050000.00 4670000.00 4330000.00 3800000.00 4530000.00 4410000.00 4490000.00 3650000.00 3840000.00 3800000.00 4180000.00 3550000.00 5240000.00 4210000.00 4480000.00 3760000.00 4060000.00 4510000.00 4110000.00 3780000.00 4930000.00 4530000.00 4300000.00 3650000.00 4870000.00 4390000.00 4600000.00 3800000.00 4400000.00 4440000.00 4290000.00 3070000.00 4380000.00 4120000.00 5470000.00 3740000.00 4600000.00 3730000.00 4260000.00 3100000.00 3670000.00 4090000.00 4170000.00 4010000.00 5000000.00 5000000.00 3950000.00 3570000.00 3680000.00 3430000.00 4270000.00 4490000.00 4270000.00 4520000.00 3590000.00 3410000.00 3990000.00 4430000.00 3960000.00 3360000.00 4440000.00 4380000.00 S-Adenosyl-L-homocysteine 836000.00 863000.00 525000.00 775000.00 791000.00 854000.00 737000.00 882000.00 757000.00 814000.00 818000.00 764000.00 824000.00 788000.00 886000.00 787000.00 656000.00 646000.00 623000.00 669000.00 823000.00 727000.00 706000.00 597000.00 499000.00 390000.00 398000.00 179000.00 405000.00 363000.00 448000.00 505000.00 707000.00 435000.00 822000.00 780000.00 755000.00 788000.00 759000.00 706000.00 681000.00 711000.00 762000.00 729000.00 683000.00 727000.00 708000.00 290000.00 282000.00 739000.00 560000.00 737000.00 762000.00 612000.00 733000.00 393000.00 765000.00 719000.00 684000.00 585000.00 794000.00 787000.00 825000.00 809000.00 660000.00 596000.00 748000.00 637000.00 787000.00 696000.00 537000.00 822000.00 549000.00 635000.00 462000.00 463000.00 718000.00 647000.00 648000.00 606000.00 Ornithine 6680000.00 5230000.00 6620000.00 7050000.00 6300000.00 5540000.00 7090000.00 6450000.00 5590000.00 6430000.00 5760000.00 6850000.00 7010000.00 6190000.00 6590000.00 5200000.00 7260000.00 6220000.00 5630000.00 6830000.00 7130000.00 8210000.00 6600000.00 6600000.00 7790000.00 7490000.00 8210000.00 8300000.00 9200000.00 6940000.00 6570000.00 6970000.00 6880000.00 6170000.00 5140000.00 7840000.00 5950000.00 7320000.00 5190000.00 6350000.00 8520000.00 5610000.00 5210000.00 5180000.00 5870000.00 6240000.00 6580000.00 6120000.00 6730000.00 6060000.00 7280000.00 7880000.00 5450000.00 6280000.00 6480000.00 6050000.00 6960000.00 6580000.00 6390000.00 7280000.00 6790000.00 6590000.00 6410000.00 7010000.00 6920000.00 6680000.00 6620000.00 6170000.00 7420000.00 5880000.00 6490000.00 5770000.00 5660000.00 5690000.00 4990000.00 7440000.00 5310000.00 5120000.00 6290000.00 6670000.00 L-Citrulline 2420000.00 2780000.00 2630000.00 2290000.00 1690000.00 2220000.00 2190000.00 2280000.00 2450000.00 2350000.00 2460000.00 2600000.00 2060000.00 1950000.00 1890000.00 2040000.00 2120000.00 1860000.00 1900000.00 1960000.00 1610000.00 2020000.00 2110000.00 2360000.00 1840000.00 1670000.00 1600000.00 1740000.00 1390000.00 1600000.00 1600000.00 1640000.00 2110000.00 2130000.00 1970000.00 2320000.00 1770000.00 1760000.00 1620000.00 2130000.00 2230000.00 2020000.00 2030000.00 2240000.00 1450000.00 1720000.00 1770000.00 2130000.00 2310000.00 2130000.00 2140000.00 2190000.00 1710000.00 1820000.00 1700000.00 1860000.00 2140000.00 1810000.00 2070000.00 2410000.00 1960000.00 2570000.00 1980000.00 2560000.00 2140000.00 2520000.00 2050000.00 2120000.00 1590000.00 2110000.00 1870000.00 2360000.00 2070000.00 1840000.00 1920000.00 2540000.00 1620000.00 1900000.00 2280000.00 1910000.00 Spermidine 1170000.00 1100000.00 1310000.00 990000.00 1130000.00 1120000.00 1660000.00 1210000.00 1230000.00 1430000.00 1380000.00 1080000.00 1520000.00 1130000.00 1570000.00 1510000.00 1380000.00 1160000.00 1680000.00 1440000.00 1680000.00 1520000.00 1330000.00 1360000.00 1750000.00 1360000.00 1400000.00 1420000.00 1870000.00 1680000.00 1770000.00 2070000.00 1160000.00 1000000.00 1280000.00 1100000.00 1310000.00 1130000.00 1270000.00 1100000.00 1330000.00 1010000.00 1450000.00 1130000.00 1080000.00 1300000.00 1430000.00 1040000.00 1140000.00 1260000.00 1360000.00 1040000.00 1660000.00 1220000.00 1350000.00 1240000.00 1230000.00 977000.00 1280000.00 978000.00 1290000.00 1120000.00 1450000.00 1570000.00 1100000.00 1210000.00 1240000.00 976000.00 1340000.00 1130000.00 1610000.00 1140000.00 1050000.00 1030000.00 1310000.00 924000.00 1020000.00 864000.00 1300000.00 1440000.00 Spermine 372000.00 280000.00 408000.00 350000.00 391000.00 395000.00 386000.00 326000.00 215000.00 300000.00 330000.00 283000.00 350000.00 312000.00 362000.00 548000.00 271000.00 248000.00 353000.00 373000.00 241000.00 242000.00 243000.00 379000.00 336000.00 273000.00 283000.00 284000.00 248000.00 259000.00 294000.00 313000.00 383000.00 227000.00 373000.00 276000.00 498000.00 375000.00 433000.00 386000.00 242000.00 284000.00 303000.00 308000.00 249000.00 336000.00 363000.00 228000.00 181000.00 254000.00 295000.00 261000.00 390000.00 253000.00 259000.00 391000.00 425000.00 396000.00 427000.00 301000.00 437000.00 303000.00 481000.00 473000.00 221000.00 268000.00 357000.00 209000.00 254000.00 425000.00 294000.00 295000.00 280000.00 279000.00 305000.00 227000.00 253000.00 232000.00 310000.00 371000.00 Creatine 63500000.00 86900000.00 66100000.00 83200000.00 56600000.00 82200000.00 73100000.00 78100000.00 60400000.00 81000000.00 71900000.00 74700000.00 56600000.00 65800000.00 72700000.00 97400000.00 58200000.00 72100000.00 70300000.00 94500000.00 61500000.00 72200000.00 74000000.00 81900000.00 60500000.00 75200000.00 63600000.00 72300000.00 57600000.00 76300000.00 89800000.00 78200000.00 69100000.00 71000000.00 66200000.00 80200000.00 49100000.00 64400000.00 72400000.00 74200000.00 58300000.00 78100000.00 80600000.00 78800000.00 59100000.00 75500000.00 73200000.00 80600000.00 61500000.00 67200000.00 72200000.00 81200000.00 70400000.00 74600000.00 75600000.00 72800000.00 60800000.00 69400000.00 58500000.00 81400000.00 55500000.00 69600000.00 75900000.00 93400000.00 62400000.00 85200000.00 66000000.00 73100000.00 60200000.00 85000000.00 74400000.00 82200000.00 53300000.00 71300000.00 70800000.00 80100000.00 59300000.00 62700000.00 74800000.00 69500000.00 Creatinine 53700000.00 59000000.00 59600000.00 62000000.00 47600000.00 63100000.00 66500000.00 59500000.00 57200000.00 57000000.00 55800000.00 53200000.00 56600000.00 64300000.00 65700000.00 69200000.00 55100000.00 50200000.00 46400000.00 65000000.00 54800000.00 65400000.00 62200000.00 54000000.00 55300000.00 51400000.00 52700000.00 57900000.00 50900000.00 65700000.00 65700000.00 55700000.00 56900000.00 55600000.00 56100000.00 65100000.00 54600000.00 63600000.00 58600000.00 55000000.00 56600000.00 53600000.00 59300000.00 60900000.00 61300000.00 66300000.00 62300000.00 53900000.00 52100000.00 46500000.00 49100000.00 56500000.00 60500000.00 60300000.00 53000000.00 44200000.00 54700000.00 51500000.00 52900000.00 61900000.00 55100000.00 69600000.00 65100000.00 61000000.00 51800000.00 54900000.00 53700000.00 56100000.00 56500000.00 71400000.00 58000000.00 59600000.00 45000000.00 48200000.00 57400000.00 65000000.00 52300000.00 59700000.00 53600000.00 52400000.00 4-Acetamidobutanoate 819000.00 4550000.00 2020000.00 1680000.00 1360000.00 713000.00 2360000.00 792000.00 939000.00 3750000.00 1980000.00 1610000.00 1390000.00 708000.00 2080000.00 888000.00 988000.00 3410000.00 1420000.00 1530000.00 1370000.00 634000.00 2000000.00 630000.00 908000.00 2980000.00 1440000.00 1440000.00 1230000.00 573000.00 1830000.00 722000.00 878000.00 3130000.00 1750000.00 2140000.00 1220000.00 579000.00 1480000.00 719000.00 869000.00 3610000.00 1630000.00 1550000.00 1580000.00 645000.00 1610000.00 609000.00 823000.00 3520000.00 1580000.00 1640000.00 1460000.00 559000.00 1640000.00 580000.00 760000.00 3320000.00 1580000.00 1590000.00 1410000.00 722000.00 1810000.00 699000.00 788000.00 4050000.00 1790000.00 3280000.00 1230000.00 747000.00 1640000.00 747000.00 759000.00 3200000.00 1360000.00 1770000.00 1280000.00 682000.00 2200000.00 544000.00 N-Acetylornithine 940000.00 1870000.00 2300000.00 1130000.00 1200000.00 1120000.00 1350000.00 1660000.00 929000.00 1900000.00 2310000.00 1000000.00 1270000.00 1110000.00 1620000.00 1790000.00 742000.00 1460000.00 2280000.00 1260000.00 1200000.00 988000.00 1410000.00 1390000.00 908000.00 1220000.00 1440000.00 1020000.00 1110000.00 1070000.00 1330000.00 1360000.00 933000.00 1730000.00 2410000.00 1060000.00 1360000.00 1020000.00 1570000.00 1410000.00 797000.00 1720000.00 2270000.00 1140000.00 1130000.00 950000.00 1410000.00 1550000.00 747000.00 1440000.00 2130000.00 1210000.00 1310000.00 1220000.00 1320000.00 1430000.00 948000.00 1570000.00 2610000.00 1090000.00 1210000.00 1110000.00 1340000.00 2030000.00 803000.00 1580000.00 2050000.00 1180000.00 1190000.00 1170000.00 1480000.00 1760000.00 858000.00 1550000.00 1840000.00 1180000.00 1190000.00 965000.00 1610000.00 1370000.00 Guanidinoacetate 936000.00 793000.00 710000.00 654000.00 844000.00 742000.00 692000.00 671000.00 806000.00 915000.00 627000.00 725000.00 815000.00 577000.00 626000.00 524000.00 694000.00 635000.00 564000.00 656000.00 657000.00 547000.00 477000.00 397000.00 831000.00 672000.00 469000.00 718000.00 481000.00 435000.00 548000.00 433000.00 929000.00 709000.00 651000.00 845000.00 696000.00 605000.00 613000.00 582000.00 784000.00 790000.00 748000.00 970000.00 846000.00 523000.00 572000.00 701000.00 976000.00 891000.00 733000.00 743000.00 731000.00 584000.00 592000.00 556000.00 835000.00 735000.00 716000.00 814000.00 931000.00 657000.00 632000.00 825000.00 923000.00 959000.00 821000.00 869000.00 816000.00 674000.00 591000.00 620000.00 795000.00 792000.00 669000.00 758000.00 792000.00 658000.00 629000.00 668000.00 Pantothenol 30300.00 37500.00 43200.00 73100.00 33700.00 45000.00 55400.00 87200.00 35400.00 39800.00 48000.00 73900.00 39900.00 47100.00 68400.00 58100.00 55200.00 40300.00 64900.00 110000.00 50500.00 71900.00 72300.00 97300.00 60700.00 49500.00 72700.00 88400.00 61300.00 66100.00 66800.00 114000.00 39600.00 36100.00 53400.00 64300.00 41600.00 45900.00 62900.00 88900.00 36300.00 34300.00 60100.00 84100.00 29900.00 40200.00 63900.00 79300.00 37300.00 39900.00 47100.00 82200.00 31300.00 50700.00 56100.00 90900.00 23600.00 34300.00 57100.00 69400.00 34000.00 43600.00 60300.00 75900.00 43400.00 42000.00 47500.00 34300.00 38000.00 46500.00 61600.00 85500.00 38700.00 34600.00 50300.00 69900.00 47200.00 51500.00 62400.00 89900.00 5-6-Dihydrouracil 133000.00 76000.00 153000.00 145000.00 102000.00 45900.00 202000.00 107000.00 228000.00 143000.00 264000.00 254000.00 242000.00 226000.00 242000.00 97200.00 681000.00 632000.00 230000.00 269000.00 465000.00 345000.00 469000.00 482000.00 526000.00 962000.00 782000.00 696000.00 712000.00 517000.00 439000.00 630000.00 146000.00 169000.00 127000.00 90900.00 169000.00 178000.00 103000.00 187000.00 224000.00 171000.00 101000.00 133000.00 212000.00 154000.00 178000.00 237000.00 200000.00 374000.00 268000.00 192000.00 121000.00 172000.00 304000.00 209000.00 151000.00 177000.00 153000.00 143000.00 116000.00 149000.00 171000.00 122000.00 201000.00 261000.00 187000.00 198000.00 99000.00 106000.00 161000.00 104000.00 240000.00 354000.00 234000.00 162000.00 123000.00 181000.00 258000.00 238000.00 Hypotaurine 148000.00 207000.00 130000.00 104000.00 143000.00 130000.00 141000.00 176000.00 98300.00 140000.00 63400.00 133000.00 129000.00 105000.00 137000.00 207000.00 139000.00 85900.00 119000.00 68300.00 117000.00 54900.00 123000.00 127000.00 99500.00 88400.00 84200.00 56800.00 41200.00 63200.00 107000.00 111000.00 130000.00 102000.00 128000.00 83100.00 34200.00 56900.00 97700.00 121000.00 115000.00 105000.00 75200.00 26300.00 119000.00 69400.00 19900.00 91000.00 151000.00 38400.00 42200.00 46600.00 82800.00 98200.00 99100.00 50700.00 110000.00 38600.00 121000.00 106000.00 34600.00 161000.00 94900.00 90300.00 110000.00 105000.00 74100.00 68700.00 90400.00 58300.00 111000.00 107000.00 55800.00 56600.00 71100.00 54000.00 76700.00 74700.00 79300.00 50400.00 L-Methionine S-oxide 1720000.00 1040000.00 1650000.00 1170000.00 877000.00 693000.00 1320000.00 517000.00 1950000.00 1060000.00 2110000.00 1700000.00 1120000.00 1000000.00 828000.00 541000.00 1560000.00 1850000.00 1180000.00 831000.00 1190000.00 1670000.00 1460000.00 1580000.00 879000.00 1970000.00 1530000.00 1970000.00 1440000.00 1190000.00 1300000.00 1750000.00 1250000.00 1040000.00 918000.00 2060000.00 1610000.00 1430000.00 1090000.00 953000.00 1330000.00 484000.00 796000.00 645000.00 548000.00 1180000.00 1470000.00 1270000.00 993000.00 2460000.00 1730000.00 990000.00 671000.00 1120000.00 1040000.00 1450000.00 878000.00 1600000.00 858000.00 1260000.00 1860000.00 1070000.00 1360000.00 1790000.00 902000.00 1760000.00 1440000.00 789000.00 856000.00 1110000.00 839000.00 1140000.00 1370000.00 1350000.00 1320000.00 1170000.00 749000.00 841000.00 1540000.00 1130000.00 Indoxyl 14300.00 10600.00 18100.00 10000.00 8680.00 8570.00 14500.00 11100.00 30200.00 27300.00 42900.00 31400.00 26500.00 21800.00 24800.00 22800.00 83700.00 111000.00 49000.00 67200.00 63400.00 84600.00 104000.00 89400.00 95800.00 135000.00 104000.00 149000.00 86300.00 85500.00 78400.00 107000.00 19500.00 15200.00 11400.00 19600.00 12300.00 16700.00 9920.00 14900.00 38000.00 25700.00 27000.00 21800.00 21600.00 29700.00 29600.00 31600.00 47200.00 43200.00 64200.00 44000.00 33100.00 28500.00 43500.00 55300.00 12500.00 14500.00 15000.00 18900.00 19100.00 20600.00 17400.00 15300.00 18700.00 36700.00 34600.00 37200.00 22100.00 19100.00 26600.00 31500.00 32400.00 36000.00 37400.00 32900.00 44400.00 33000.00 52500.00 36400.00 kynurenine 213000.00 187000.00 255000.00 183000.00 180000.00 186000.00 216000.00 195000.00 165000.00 212000.00 218000.00 191000.00 190000.00 205000.00 200000.00 139000.00 240000.00 211000.00 179000.00 130000.00 227000.00 222000.00 194000.00 242000.00 177000.00 243000.00 239000.00 235000.00 235000.00 236000.00 186000.00 258000.00 209000.00 198000.00 200000.00 204000.00 196000.00 197000.00 148000.00 204000.00 215000.00 181000.00 215000.00 157000.00 191000.00 224000.00 201000.00 212000.00 184000.00 215000.00 246000.00 208000.00 147000.00 146000.00 198000.00 256000.00 165000.00 239000.00 247000.00 173000.00 199000.00 239000.00 211000.00 231000.00 197000.00 228000.00 226000.00 186000.00 187000.00 178000.00 169000.00 195000.00 204000.00 219000.00 226000.00 187000.00 186000.00 161000.00 247000.00 229000.00 Serotonin 3990000.00 544000.00 0.00 1220000.00 56600.00 64800.00 846000.00 56600.00 3510000.00 649000.00 55900.00 1090000.00 41400.00 48200.00 992000.00 70300.00 3540000.00 492000.00 0.00 2030000.00 58800.00 56900.00 597000.00 0.00 4800000.00 472000.00 58600.00 1560000.00 44400.00 76600.00 1240000.00 55800.00 4630000.00 451000.00 0.00 1450000.00 56000.00 64900.00 1010000.00 46100.00 3820000.00 618000.00 63800.00 1610000.00 56700.00 46000.00 887000.00 43500.00 3750000.00 504000.00 42900.00 1380000.00 52900.00 43600.00 902000.00 37000.00 4540000.00 536000.00 0.00 1270000.00 0.00 43700.00 817000.00 50000.00 4270000.00 556000.00 41400.00 504000.00 47400.00 72000.00 863000.00 53700.00 3500000.00 375000.00 0.00 1380000.00 0.00 66400.00 744000.00 0.00 Ectoine 209000.00 136000.00 88900.00 126000.00 158000.00 93400.00 304000.00 423000.00 237000.00 170000.00 108000.00 127000.00 118000.00 97400.00 268000.00 495000.00 212000.00 121000.00 158000.00 119000.00 107000.00 72800.00 329000.00 432000.00 247000.00 126000.00 69900.00 92700.00 104000.00 87000.00 306000.00 346000.00 207000.00 155000.00 132000.00 113000.00 92400.00 73000.00 352000.00 446000.00 239000.00 155000.00 118000.00 143000.00 148000.00 120000.00 280000.00 484000.00 230000.00 102000.00 95800.00 105000.00 154000.00 130000.00 301000.00 409000.00 270000.00 102000.00 124000.00 144000.00 128000.00 144000.00 272000.00 527000.00 230000.00 156000.00 104000.00 121000.00 110000.00 88800.00 310000.00 412000.00 229000.00 141000.00 110000.00 142000.00 109000.00 89700.00 308000.00 403000.00 N-Methylethanolamine phosphate 219000.00 200000.00 218000.00 381000.00 275000.00 321000.00 156000.00 232000.00 163000.00 332000.00 262000.00 179000.00 220000.00 378000.00 514000.00 272000.00 169000.00 198000.00 316000.00 336000.00 295000.00 423000.00 41400.00 274000.00 190000.00 165000.00 258000.00 295000.00 195000.00 206000.00 276000.00 251000.00 310000.00 179000.00 306000.00 264000.00 401000.00 285000.00 300000.00 414000.00 220000.00 319000.00 419000.00 327000.00 280000.00 294000.00 295000.00 288000.00 255000.00 321000.00 317000.00 361000.00 371000.00 430000.00 254000.00 314000.00 214000.00 235000.00 289000.00 310000.00 325000.00 211000.00 270000.00 300000.00 276000.00 241000.00 283000.00 224000.00 427000.00 487000.00 290000.00 274000.00 265000.00 311000.00 252000.00 281000.00 417000.00 435000.00 247000.00 229000.00 Sphingosine 62900.00 51100.00 82400.00 54700.00 58300.00 39500.00 93400.00 51900.00 152000.00 87100.00 154000.00 100000.00 93300.00 87800.00 91200.00 51900.00 433000.00 279000.00 98700.00 100000.00 173000.00 176000.00 286000.00 209000.00 293000.00 562000.00 362000.00 510000.00 256000.00 236000.00 195000.00 245000.00 84400.00 83800.00 76100.00 90300.00 58500.00 73100.00 42400.00 82500.00 272000.00 103000.00 109000.00 84900.00 104000.00 133000.00 127000.00 152000.00 244000.00 186000.00 235000.00 184000.00 63400.00 77000.00 224000.00 196000.00 64700.00 84000.00 67200.00 77500.00 105000.00 82100.00 94900.00 80400.00 128000.00 140000.00 149000.00 129000.00 95800.00 67900.00 89300.00 83000.00 219000.00 185000.00 136000.00 95500.00 125000.00 101000.00 232000.00 126000.00 Choline 75600000.00 72800000.00 71300000.00 65800000.00 71900000.00 70900000.00 75500000.00 68100000.00 83200000.00 87300000.00 71300000.00 75300000.00 83000000.00 70900000.00 77400000.00 78800000.00 193000000.00 176000000.00 165000000.00 151000000.00 179000000.00 173000000.00 187000000.00 165000000.00 367000000.00 328000000.00 309000000.00 315000000.00 322000000.00 310000000.00 375000000.00 350000000.00 81200000.00 67800000.00 72600000.00 69100000.00 76700000.00 67900000.00 71400000.00 72400000.00 90000000.00 76400000.00 80400000.00 86600000.00 90100000.00 81200000.00 83500000.00 90500000.00 125000000.00 106000000.00 113000000.00 110000000.00 109000000.00 98100000.00 116000000.00 119000000.00 75900000.00 72300000.00 74700000.00 67400000.00 75400000.00 67800000.00 77200000.00 89100000.00 82000000.00 93900000.00 90400000.00 132000000.00 79300000.00 84600000.00 80000000.00 91100000.00 103000000.00 95200000.00 103000000.00 96300000.00 111000000.00 96500000.00 109000000.00 113000000.00 L-Carnitine 139000000.00 188000000.00 185000000.00 134000000.00 131000000.00 191000000.00 172000000.00 240000000.00 153000000.00 177000000.00 177000000.00 154000000.00 179000000.00 158000000.00 147000000.00 232000000.00 119000000.00 145000000.00 141000000.00 101000000.00 119000000.00 129000000.00 120000000.00 186000000.00 89700000.00 105000000.00 97100000.00 92700000.00 73500000.00 100000000.00 102000000.00 126000000.00 124000000.00 179000000.00 172000000.00 154000000.00 158000000.00 161000000.00 155000000.00 198000000.00 139000000.00 142000000.00 144000000.00 154000000.00 176000000.00 160000000.00 156000000.00 211000000.00 114000000.00 130000000.00 135000000.00 151000000.00 148000000.00 145000000.00 142000000.00 184000000.00 110000000.00 172000000.00 159000000.00 131000000.00 147000000.00 171000000.00 166000000.00 188000000.00 124000000.00 156000000.00 160000000.00 162000000.00 149000000.00 156000000.00 164000000.00 220000000.00 102000000.00 125000000.00 160000000.00 143000000.00 126000000.00 127000000.00 149000000.00 192000000.00 acyl-C2 50300000.00 49900000.00 49700000.00 57500000.00 55100000.00 58100000.00 108000000.00 71400000.00 45700000.00 46900000.00 58200000.00 46400000.00 55000000.00 45400000.00 86700000.00 72500000.00 47200000.00 48700000.00 58900000.00 53000000.00 58600000.00 42700000.00 96400000.00 65700000.00 46700000.00 46200000.00 44200000.00 50900000.00 51400000.00 45200000.00 106000000.00 66500000.00 48900000.00 51300000.00 53400000.00 47900000.00 48700000.00 44600000.00 112000000.00 55200000.00 52800000.00 41900000.00 44800000.00 52500000.00 50900000.00 53000000.00 101000000.00 66700000.00 49900000.00 52700000.00 58200000.00 55100000.00 45000000.00 56500000.00 106000000.00 69600000.00 55400000.00 51500000.00 54700000.00 50500000.00 54200000.00 56800000.00 105000000.00 75600000.00 34300000.00 51600000.00 58700000.00 43900000.00 43900000.00 45600000.00 114000000.00 71600000.00 50800000.00 52800000.00 47900000.00 47700000.00 61400000.00 54300000.00 104000000.00 67500000.00 acyl-C3 2390000.00 2780000.00 2300000.00 2440000.00 2370000.00 1980000.00 2280000.00 3840000.00 2750000.00 3050000.00 2880000.00 2490000.00 2630000.00 2430000.00 2360000.00 4200000.00 2760000.00 3030000.00 2830000.00 2670000.00 2610000.00 2590000.00 2660000.00 2680000.00 2920000.00 2790000.00 2650000.00 2810000.00 2450000.00 2220000.00 2030000.00 3420000.00 1830000.00 3100000.00 2700000.00 2550000.00 2320000.00 2340000.00 2630000.00 2990000.00 2880000.00 2920000.00 2770000.00 2390000.00 2410000.00 1860000.00 2190000.00 3440000.00 1950000.00 2980000.00 2250000.00 2670000.00 2380000.00 2030000.00 1750000.00 3240000.00 2700000.00 2880000.00 3000000.00 2120000.00 2130000.00 2370000.00 2210000.00 2980000.00 2470000.00 2940000.00 2590000.00 2440000.00 2260000.00 2660000.00 2470000.00 3620000.00 2230000.00 2290000.00 2540000.00 2600000.00 2250000.00 2340000.00 2480000.00 3430000.00 acyl-C4 1930000.00 2310000.00 2490000.00 2300000.00 2810000.00 2020000.00 2390000.00 2980000.00 1840000.00 3190000.00 2420000.00 2430000.00 2650000.00 2030000.00 2960000.00 3190000.00 2370000.00 2450000.00 2770000.00 2700000.00 2720000.00 2590000.00 2250000.00 2690000.00 1820000.00 2350000.00 2720000.00 2390000.00 2850000.00 2430000.00 2410000.00 3480000.00 2940000.00 2460000.00 2920000.00 2540000.00 3060000.00 2040000.00 2350000.00 3230000.00 2280000.00 3090000.00 2960000.00 3120000.00 3170000.00 2220000.00 2880000.00 2940000.00 2080000.00 2540000.00 2070000.00 2860000.00 2840000.00 2210000.00 2380000.00 2870000.00 2440000.00 2700000.00 2640000.00 2480000.00 2860000.00 1780000.00 2490000.00 3370000.00 2330000.00 2540000.00 2800000.00 2500000.00 3680000.00 2610000.00 2450000.00 3610000.00 2390000.00 2540000.00 2670000.00 2740000.00 2820000.00 2490000.00 2240000.00 2840000.00 acyl-C4-OH (Hydroxybutyrylcarnitine) 862000.00 878000.00 966000.00 1130000.00 709000.00 1270000.00 1060000.00 1120000.00 763000.00 863000.00 877000.00 999000.00 812000.00 1230000.00 1110000.00 1200000.00 917000.00 854000.00 980000.00 1120000.00 834000.00 1200000.00 1140000.00 1140000.00 1050000.00 914000.00 1070000.00 1200000.00 881000.00 1370000.00 1190000.00 1370000.00 982000.00 835000.00 999000.00 1070000.00 813000.00 1220000.00 1190000.00 998000.00 815000.00 1010000.00 1120000.00 1030000.00 852000.00 1180000.00 1250000.00 1190000.00 826000.00 877000.00 896000.00 954000.00 840000.00 1160000.00 1160000.00 1010000.00 822000.00 1000000.00 1050000.00 1030000.00 653000.00 1010000.00 1110000.00 1180000.00 868000.00 800000.00 882000.00 946000.00 834000.00 1140000.00 1030000.00 1250000.00 921000.00 822000.00 988000.00 1150000.00 797000.00 1180000.00 994000.00 1260000.00 acyl-C5 1460000.00 1750000.00 2050000.00 2330000.00 1850000.00 2210000.00 1980000.00 2470000.00 1730000.00 1930000.00 1910000.00 2340000.00 2010000.00 2200000.00 1860000.00 2370000.00 2210000.00 2020000.00 1730000.00 2220000.00 2140000.00 2580000.00 2040000.00 2500000.00 2010000.00 2070000.00 2420000.00 2640000.00 2250000.00 2540000.00 1910000.00 3480000.00 2140000.00 1600000.00 2060000.00 2160000.00 1810000.00 2520000.00 1800000.00 2530000.00 1960000.00 1910000.00 1990000.00 2260000.00 1820000.00 2030000.00 2130000.00 2730000.00 1730000.00 2030000.00 1990000.00 2110000.00 2040000.00 2170000.00 2070000.00 2650000.00 1890000.00 1770000.00 1590000.00 2160000.00 1880000.00 2200000.00 2000000.00 2640000.00 1770000.00 1820000.00 2210000.00 1910000.00 2190000.00 2160000.00 1800000.00 2830000.00 2030000.00 1720000.00 2210000.00 1990000.00 1840000.00 2260000.00 2010000.00 2700000.00 acyl-C5:1 (Tiglylcarnitine) 257000.00 223000.00 238000.00 288000.00 276000.00 313000.00 379000.00 503000.00 211000.00 221000.00 235000.00 262000.00 329000.00 344000.00 377000.00 523000.00 284000.00 260000.00 290000.00 342000.00 329000.00 306000.00 401000.00 479000.00 298000.00 254000.00 324000.00 330000.00 305000.00 329000.00 424000.00 621000.00 256000.00 185000.00 301000.00 312000.00 273000.00 331000.00 381000.00 458000.00 244000.00 246000.00 293000.00 344000.00 326000.00 267000.00 406000.00 440000.00 219000.00 252000.00 267000.00 297000.00 310000.00 309000.00 414000.00 490000.00 246000.00 221000.00 277000.00 303000.00 263000.00 295000.00 358000.00 443000.00 259000.00 208000.00 232000.00 220000.00 328000.00 331000.00 331000.00 472000.00 262000.00 199000.00 276000.00 281000.00 308000.00 308000.00 318000.00 477000.00 acyl-C5-OH 44000.00 55900.00 56400.00 56500.00 50000.00 71000.00 71800.00 53400.00 49600.00 59900.00 59400.00 41900.00 70900.00 62000.00 64300.00 72900.00 69600.00 92300.00 73200.00 80500.00 77900.00 89600.00 78000.00 82900.00 71800.00 99500.00 84900.00 60900.00 105000.00 100000.00 101000.00 90600.00 66100.00 64300.00 66600.00 54900.00 64500.00 65500.00 62500.00 69100.00 57700.00 77200.00 68400.00 74300.00 63400.00 71100.00 78000.00 78600.00 66200.00 80800.00 74100.00 76200.00 84300.00 74800.00 86600.00 76400.00 56100.00 63900.00 54000.00 62200.00 53100.00 62300.00 72700.00 77400.00 58600.00 76100.00 62200.00 81600.00 76600.00 83200.00 79100.00 86500.00 74500.00 80300.00 59200.00 68200.00 75000.00 85500.00 72200.00 93800.00 acyl-C6 (hexanoyl-l-carnitine) 368000.00 348000.00 372000.00 311000.00 459000.00 316000.00 558000.00 360000.00 446000.00 446000.00 392000.00 377000.00 509000.00 329000.00 668000.00 464000.00 396000.00 382000.00 481000.00 351000.00 481000.00 399000.00 561000.00 399000.00 422000.00 321000.00 402000.00 296000.00 374000.00 382000.00 584000.00 444000.00 486000.00 345000.00 483000.00 348000.00 477000.00 363000.00 691000.00 421000.00 490000.00 471000.00 514000.00 426000.00 534000.00 385000.00 564000.00 455000.00 387000.00 393000.00 449000.00 359000.00 471000.00 332000.00 575000.00 437000.00 451000.00 373000.00 545000.00 402000.00 491000.00 335000.00 590000.00 533000.00 474000.00 429000.00 444000.00 326000.00 511000.00 445000.00 572000.00 460000.00 444000.00 365000.00 445000.00 332000.00 487000.00 297000.00 548000.00 383000.00 acyl-C6-DC 55500.00 38600.00 27500.00 57400.00 39700.00 131000.00 43300.00 27900.00 62900.00 25900.00 22100.00 64200.00 16900.00 126000.00 43200.00 47200.00 55900.00 42400.00 16900.00 56000.00 41800.00 109000.00 17900.00 30000.00 93400.00 78400.00 28200.00 66800.00 55800.00 76500.00 37100.00 57800.00 53900.00 20900.00 16700.00 56800.00 53300.00 104000.00 46900.00 26700.00 45300.00 18200.00 35500.00 75800.00 28000.00 139000.00 24100.00 31300.00 67500.00 32700.00 22700.00 70400.00 38800.00 94500.00 35800.00 42600.00 64300.00 27400.00 36000.00 70400.00 29300.00 84800.00 41700.00 38100.00 79700.00 34100.00 42000.00 32900.00 15800.00 91000.00 27700.00 33500.00 70800.00 24800.00 21200.00 67800.00 12600.00 87700.00 33300.00 43000.00 acyl-C8 (L-octanoylcarnitine 2770000.00 2480000.00 2500000.00 2380000.00 3420000.00 1820000.00 4060000.00 2960000.00 3190000.00 3260000.00 2190000.00 2200000.00 3490000.00 2580000.00 3740000.00 2820000.00 3740000.00 3180000.00 2690000.00 2720000.00 4300000.00 3290000.00 4410000.00 3030000.00 3770000.00 2310000.00 2420000.00 2430000.00 4220000.00 2840000.00 3700000.00 2880000.00 3370000.00 2810000.00 2410000.00 2520000.00 3600000.00 2150000.00 4340000.00 3090000.00 3400000.00 2710000.00 2810000.00 2510000.00 3300000.00 1970000.00 4370000.00 2810000.00 2800000.00 3080000.00 2370000.00 2410000.00 3050000.00 2010000.00 3940000.00 2570000.00 3610000.00 2530000.00 2950000.00 2860000.00 3450000.00 2200000.00 4100000.00 3200000.00 3660000.00 3030000.00 2320000.00 2820000.00 3340000.00 2160000.00 4340000.00 2840000.00 3060000.00 2830000.00 2250000.00 2670000.00 2990000.00 2170000.00 4010000.00 2480000.00 acyl-C8:1 (octenoyl-l-carnitine) 5100000.00 5760000.00 6050000.00 4460000.00 7400000.00 5660000.00 9370000.00 7420000.00 4740000.00 6850000.00 5550000.00 4040000.00 8420000.00 5540000.00 13500000.00 8310000.00 5540000.00 6190000.00 5440000.00 5740000.00 6770000.00 7290000.00 8810000.00 7200000.00 5850000.00 6160000.00 5830000.00 5220000.00 6830000.00 6200000.00 11800000.00 7660000.00 5480000.00 5020000.00 6410000.00 4320000.00 7110000.00 5850000.00 10300000.00 7560000.00 5580000.00 6720000.00 6480000.00 4710000.00 7250000.00 5970000.00 10700000.00 8380000.00 4860000.00 5260000.00 4920000.00 4410000.00 7950000.00 6540000.00 9670000.00 6160000.00 5590000.00 6310000.00 7110000.00 5190000.00 7050000.00 5530000.00 12400000.00 8190000.00 6150000.00 5220000.00 5600000.00 6370000.00 7460000.00 6630000.00 9690000.00 9520000.00 4860000.00 6590000.00 5600000.00 4870000.00 8040000.00 6630000.00 10500000.00 8040000.00 acyl-C10 (O-Decanoyl-L-carnitine) 2560000.00 2500000.00 2300000.00 2030000.00 2590000.00 1430000.00 3450000.00 1980000.00 2940000.00 2110000.00 1900000.00 2490000.00 2970000.00 2070000.00 3580000.00 1240000.00 2630000.00 2330000.00 1290000.00 1580000.00 2960000.00 2280000.00 3100000.00 2610000.00 1420000.00 1710000.00 921000.00 1420000.00 1840000.00 1240000.00 1180000.00 1980000.00 2810000.00 2200000.00 1930000.00 2130000.00 2880000.00 1880000.00 2900000.00 2140000.00 3080000.00 2210000.00 1920000.00 1880000.00 2500000.00 1770000.00 3210000.00 2260000.00 2530000.00 2340000.00 1950000.00 2000000.00 1590000.00 1240000.00 2960000.00 2090000.00 2240000.00 2590000.00 1840000.00 2510000.00 3220000.00 1780000.00 3390000.00 2850000.00 2610000.00 2600000.00 2250000.00 1680000.00 2580000.00 1400000.00 3230000.00 2400000.00 2500000.00 2390000.00 2090000.00 1720000.00 2270000.00 1360000.00 3230000.00 2030000.00 acyl-C10:1 (O-Decenoyl-L-carnitine) 1180000.00 1150000.00 1160000.00 1240000.00 1430000.00 992000.00 2280000.00 1560000.00 1250000.00 1360000.00 1330000.00 1400000.00 1720000.00 1060000.00 2230000.00 1380000.00 1280000.00 1480000.00 1010000.00 1280000.00 1940000.00 1160000.00 1910000.00 1740000.00 1030000.00 1580000.00 1090000.00 1320000.00 2200000.00 1020000.00 1690000.00 1460000.00 1330000.00 1180000.00 1150000.00 1500000.00 1900000.00 1110000.00 1920000.00 1480000.00 1280000.00 1310000.00 1180000.00 1350000.00 1470000.00 1140000.00 1850000.00 1790000.00 1290000.00 1290000.00 1150000.00 1290000.00 1270000.00 826000.00 1910000.00 1440000.00 1230000.00 1390000.00 1070000.00 1610000.00 1590000.00 1140000.00 2140000.00 1710000.00 1130000.00 1250000.00 1110000.00 1250000.00 1530000.00 971000.00 1650000.00 1400000.00 1180000.00 1320000.00 1010000.00 1300000.00 1240000.00 914000.00 2060000.00 1420000.00 acyl-C12 (O-dodecanoyl-carnitine) 187000.00 270000.00 279000.00 206000.00 293000.00 243000.00 487000.00 256000.00 319000.00 384000.00 261000.00 288000.00 370000.00 223000.00 602000.00 271000.00 383000.00 331000.00 186000.00 207000.00 375000.00 367000.00 575000.00 372000.00 304000.00 394000.00 268000.00 350000.00 393000.00 304000.00 541000.00 319000.00 317000.00 331000.00 252000.00 264000.00 329000.00 281000.00 541000.00 366000.00 324000.00 353000.00 336000.00 264000.00 347000.00 279000.00 608000.00 322000.00 281000.00 266000.00 269000.00 295000.00 305000.00 209000.00 545000.00 338000.00 305000.00 327000.00 254000.00 268000.00 329000.00 267000.00 487000.00 400000.00 288000.00 359000.00 298000.00 343000.00 351000.00 311000.00 427000.00 354000.00 284000.00 299000.00 275000.00 216000.00 391000.00 261000.00 452000.00 327000.00 acyl-C12:1 (O-dodecenoyl-carnitine) 104000.00 89500.00 98700.00 88700.00 121000.00 109000.00 198000.00 81900.00 125000.00 101000.00 81500.00 143000.00 121000.00 79300.00 187000.00 111000.00 164000.00 142000.00 73500.00 117000.00 105000.00 90000.00 172000.00 118000.00 82600.00 141000.00 64700.00 117000.00 92200.00 61800.00 163000.00 108000.00 86700.00 87100.00 86000.00 133000.00 121000.00 77700.00 174000.00 101000.00 181000.00 114000.00 87800.00 114000.00 98900.00 80700.00 170000.00 142000.00 103000.00 125000.00 125000.00 124000.00 134000.00 90600.00 158000.00 157000.00 87200.00 111000.00 76200.00 159000.00 168000.00 126000.00 202000.00 128000.00 82700.00 163000.00 79800.00 85800.00 96500.00 108000.00 141000.00 113000.00 107000.00 94300.00 68400.00 87300.00 117000.00 92700.00 215000.00 86200.00 acyl-C14 (O-tetradecanoyl-L-carnitine) 170000.00 253000.00 181000.00 151000.00 233000.00 194000.00 281000.00 240000.00 196000.00 277000.00 229000.00 201000.00 304000.00 194000.00 253000.00 107000.00 185000.00 281000.00 133000.00 57900.00 294000.00 183000.00 237000.00 225000.00 171000.00 238000.00 178000.00 195000.00 220000.00 161000.00 144000.00 217000.00 237000.00 229000.00 220000.00 172000.00 295000.00 252000.00 208000.00 284000.00 254000.00 254000.00 225000.00 319000.00 240000.00 288000.00 322000.00 397000.00 221000.00 236000.00 236000.00 223000.00 117000.00 234000.00 343000.00 267000.00 228000.00 274000.00 266000.00 213000.00 222000.00 208000.00 279000.00 330000.00 243000.00 311000.00 257000.00 225000.00 306000.00 255000.00 313000.00 237000.00 256000.00 255000.00 265000.00 239000.00 176000.00 209000.00 360000.00 265000.00 acyl-C14:1 (Tetradecenoyl Carnitine) 237000.00 213000.00 259000.00 331000.00 249000.00 235000.00 487000.00 256000.00 245000.00 229000.00 249000.00 261000.00 308000.00 288000.00 445000.00 188000.00 338000.00 234000.00 157000.00 226000.00 295000.00 249000.00 373000.00 252000.00 153000.00 225000.00 206000.00 295000.00 314000.00 285000.00 269000.00 275000.00 320000.00 177000.00 244000.00 310000.00 328000.00 323000.00 294000.00 282000.00 315000.00 195000.00 227000.00 225000.00 240000.00 253000.00 495000.00 284000.00 216000.00 258000.00 240000.00 243000.00 250000.00 162000.00 549000.00 267000.00 274000.00 246000.00 252000.00 331000.00 295000.00 260000.00 408000.00 338000.00 323000.00 246000.00 194000.00 258000.00 299000.00 203000.00 403000.00 279000.00 204000.00 200000.00 260000.00 285000.00 253000.00 188000.00 459000.00 346000.00 acyl-C16 1650000.00 1180000.00 2140000.00 1780000.00 736000.00 402000.00 1290000.00 1270000.00 2030000.00 610000.00 1890000.00 1790000.00 1410000.00 1850000.00 595000.00 528000.00 1540000.00 1490000.00 474000.00 554000.00 1140000.00 1110000.00 1740000.00 1260000.00 433000.00 1420000.00 1070000.00 1540000.00 993000.00 1360000.00 393000.00 1580000.00 1340000.00 1530000.00 754000.00 2170000.00 1770000.00 1490000.00 416000.00 1570000.00 2050000.00 689000.00 289000.00 372000.00 413000.00 1430000.00 795000.00 1560000.00 1930000.00 1880000.00 1840000.00 1830000.00 445000.00 424000.00 1730000.00 1600000.00 818000.00 1620000.00 1590000.00 1830000.00 1460000.00 1470000.00 1550000.00 1280000.00 1730000.00 2010000.00 1570000.00 1840000.00 492000.00 368000.00 1300000.00 574000.00 1450000.00 1920000.00 2040000.00 1090000.00 455000.00 347000.00 1980000.00 1620000.00 acyl-C16:1 (Hexadecenoyl-carnitine) 152000.00 143000.00 168000.00 163000.00 230000.00 38300.00 172000.00 220000.00 186000.00 245000.00 168000.00 114000.00 190000.00 145000.00 249000.00 44200.00 138000.00 134000.00 35700.00 22300.00 191000.00 135000.00 178000.00 145000.00 61800.00 109000.00 92700.00 123000.00 135000.00 79800.00 58900.00 190000.00 217000.00 149000.00 162000.00 137000.00 231000.00 123000.00 81100.00 231000.00 192000.00 262000.00 63100.00 82100.00 113000.00 138000.00 218000.00 224000.00 144000.00 173000.00 178000.00 153000.00 54100.00 44100.00 206000.00 180000.00 205000.00 172000.00 173000.00 142000.00 185000.00 134000.00 201000.00 261000.00 164000.00 172000.00 181000.00 153000.00 291000.00 51800.00 172000.00 216000.00 143000.00 166000.00 163000.00 159000.00 126000.00 89900.00 212000.00 194000.00 acyl-C18 (Octadecanoyl-L-carnitine) 216000.00 206000.00 276000.00 260000.00 123000.00 180000.00 176000.00 189000.00 243000.00 224000.00 303000.00 213000.00 184000.00 260000.00 177000.00 224000.00 182000.00 254000.00 218000.00 264000.00 259000.00 158000.00 187000.00 146000.00 108000.00 213000.00 155000.00 197000.00 104000.00 174000.00 182000.00 175000.00 195000.00 217000.00 97000.00 213000.00 232000.00 217000.00 245000.00 190000.00 285000.00 235000.00 192000.00 147000.00 216000.00 220000.00 79700.00 286000.00 161000.00 303000.00 246000.00 208000.00 199000.00 154000.00 209000.00 196000.00 168000.00 134000.00 288000.00 245000.00 156000.00 185000.00 193000.00 143000.00 235000.00 289000.00 172000.00 218000.00 235000.00 280000.00 241000.00 112000.00 146000.00 239000.00 162000.00 139000.00 107000.00 210000.00 328000.00 178000.00 acyl-C18:1 (O-octadecenoyl-L-carnitine) 1370000.00 610000.00 1680000.00 480000.00 494000.00 562000.00 829000.00 673000.00 1030000.00 771000.00 1140000.00 1710000.00 558000.00 825000.00 616000.00 630000.00 1830000.00 1630000.00 446000.00 544000.00 472000.00 693000.00 1250000.00 1190000.00 832000.00 1780000.00 696000.00 1550000.00 590000.00 650000.00 561000.00 942000.00 614000.00 918000.00 556000.00 1580000.00 701000.00 762000.00 460000.00 891000.00 1530000.00 642000.00 605000.00 565000.00 424000.00 914000.00 664000.00 1140000.00 1080000.00 1640000.00 1550000.00 1160000.00 689000.00 557000.00 520000.00 1690000.00 568000.00 1210000.00 492000.00 1730000.00 1380000.00 1660000.00 880000.00 579000.00 732000.00 1530000.00 951000.00 785000.00 496000.00 648000.00 343000.00 675000.00 1270000.00 1160000.00 880000.00 756000.00 650000.00 532000.00 1310000.00 781000.00 acyl-C18:2 (Linoleoyl-CoA) 870000.00 752000.00 1330000.00 942000.00 678000.00 948000.00 1220000.00 822000.00 908000.00 373000.00 1290000.00 802000.00 1000000.00 1150000.00 476000.00 1100000.00 831000.00 909000.00 777000.00 1040000.00 601000.00 736000.00 928000.00 1100000.00 1010000.00 641000.00 506000.00 604000.00 872000.00 463000.00 916000.00 809000.00 618000.00 1020000.00 796000.00 1150000.00 978000.00 1310000.00 926000.00 949000.00 577000.00 451000.00 1170000.00 871000.00 484000.00 1390000.00 839000.00 1250000.00 846000.00 804000.00 1120000.00 1250000.00 1010000.00 1120000.00 1140000.00 1100000.00 678000.00 1390000.00 588000.00 842000.00 1190000.00 1040000.00 1550000.00 1070000.00 687000.00 743000.00 1270000.00 626000.00 604000.00 1230000.00 573000.00 557000.00 1010000.00 1160000.00 1420000.00 635000.00 734000.00 927000.00 1100000.00 1190000.00 acyl-C20:4 81800.00 117000.00 125000.00 112000.00 134000.00 25000.00 92500.00 141000.00 87100.00 109000.00 140000.00 99400.00 84400.00 106000.00 86900.00 15200.00 78600.00 98600.00 29700.00 16300.00 134000.00 120000.00 101000.00 119000.00 50900.00 93000.00 113000.00 88400.00 119000.00 81900.00 18800.00 176000.00 111000.00 95200.00 152000.00 87300.00 122000.00 99700.00 26600.00 122000.00 99700.00 159000.00 55400.00 50700.00 42400.00 114000.00 117000.00 156000.00 78900.00 100000.00 138000.00 102000.00 17400.00 15600.00 107000.00 118000.00 101000.00 119000.00 163000.00 97700.00 112000.00 92000.00 104000.00 214000.00 79200.00 104000.00 130000.00 96900.00 123000.00 22300.00 89500.00 95300.00 79700.00 111000.00 106000.00 111000.00 29600.00 26800.00 110000.00 115000.00 Nicotinic acid 7420000.00 5700000.00 7140000.00 5420000.00 5800000.00 5690000.00 7280000.00 5940000.00 7450000.00 5050000.00 6250000.00 6790000.00 6320000.00 5300000.00 5770000.00 4730000.00 6410000.00 5660000.00 4350000.00 4620000.00 5390000.00 5730000.00 7120000.00 5710000.00 5790000.00 6240000.00 6050000.00 6570000.00 5980000.00 6170000.00 5270000.00 6500000.00 5870000.00 5890000.00 5380000.00 6560000.00 6010000.00 6300000.00 4600000.00 6590000.00 6470000.00 5830000.00 5070000.00 5190000.00 5230000.00 7090000.00 7020000.00 6260000.00 6750000.00 5350000.00 6400000.00 6820000.00 4550000.00 4840000.00 6540000.00 6460000.00 6140000.00 5870000.00 5940000.00 5770000.00 7180000.00 8040000.00 6240000.00 6100000.00 6260000.00 6630000.00 6640000.00 6430000.00 5450000.00 5740000.00 6240000.00 5800000.00 6110000.00 6460000.00 6640000.00 5850000.00 5630000.00 5210000.00 5310000.00 6940000.00 Biliverdin 17200.00 25900.00 25900.00 39300.00 26600.00 14600.00 15800.00 27300.00 25200.00 31800.00 25800.00 46000.00 44800.00 25800.00 35800.00 33800.00 58200.00 63700.00 22800.00 42500.00 69000.00 32200.00 46500.00 43300.00 47400.00 57700.00 30400.00 79300.00 84700.00 55600.00 37500.00 49400.00 19300.00 28200.00 16200.00 26700.00 40800.00 21100.00 11100.00 46100.00 31200.00 22200.00 31200.00 36300.00 42800.00 22200.00 11000.00 37500.00 35200.00 25100.00 32800.00 65000.00 47300.00 24200.00 39400.00 53700.00 22900.00 26000.00 22900.00 43500.00 45200.00 30300.00 21900.00 39200.00 48800.00 54800.00 46500.00 87200.00 63200.00 22000.00 32700.00 51200.00 76700.00 75900.00 83200.00 65000.00 77000.00 43800.00 68400.00 72000.00 Bilirubin 242000.00 306000.00 221000.00 377000.00 263000.00 234000.00 248000.00 314000.00 451000.00 519000.00 305000.00 490000.00 455000.00 235000.00 466000.00 358000.00 516000.00 454000.00 198000.00 485000.00 881000.00 356000.00 482000.00 517000.00 282000.00 329000.00 237000.00 349000.00 578000.00 239000.00 299000.00 392000.00 403000.00 348000.00 243000.00 372000.00 446000.00 228000.00 287000.00 299000.00 408000.00 397000.00 301000.00 461000.00 579000.00 278000.00 359000.00 432000.00 543000.00 378000.00 254000.00 733000.00 542000.00 380000.00 456000.00 452000.00 682000.00 445000.00 421000.00 776000.00 483000.00 254000.00 382000.00 859000.00 931000.00 744000.00 942000.00 1710000.00 1180000.00 315000.00 319000.00 534000.00 1430000.00 1830000.00 1330000.00 1200000.00 1220000.00 928000.00 1160000.00 935000.00 Ergothioneine 1150000.00 1190000.00 900000.00 1280000.00 799000.00 1140000.00 1020000.00 1750000.00 1070000.00 1160000.00 749000.00 1020000.00 819000.00 1010000.00 1160000.00 2090000.00 930000.00 1040000.00 1130000.00 1440000.00 978000.00 847000.00 1010000.00 1420000.00 1350000.00 797000.00 785000.00 952000.00 766000.00 901000.00 986000.00 1310000.00 1370000.00 995000.00 1030000.00 1170000.00 922000.00 600000.00 1310000.00 1310000.00 1040000.00 1310000.00 1160000.00 1460000.00 895000.00 837000.00 843000.00 1300000.00 1120000.00 929000.00 871000.00 1230000.00 918000.00 1000000.00 1140000.00 1250000.00 1290000.00 892000.00 983000.00 1190000.00 533000.00 740000.00 810000.00 1530000.00 1320000.00 891000.00 892000.00 816000.00 856000.00 1020000.00 1090000.00 1820000.00 1030000.00 856000.00 770000.00 1110000.00 919000.00 948000.00 829000.00 1450000.00 Methylenediurea 628000.00 665000.00 544000.00 708000.00 567000.00 720000.00 624000.00 652000.00 521000.00 651000.00 616000.00 635000.00 442000.00 630000.00 645000.00 813000.00 491000.00 618000.00 610000.00 813000.00 504000.00 780000.00 543000.00 696000.00 472000.00 677000.00 616000.00 586000.00 509000.00 722000.00 844000.00 641000.00 637000.00 652000.00 649000.00 690000.00 486000.00 588000.00 611000.00 794000.00 499000.00 654000.00 634000.00 659000.00 573000.00 653000.00 663000.00 754000.00 582000.00 540000.00 606000.00 712000.00 563000.00 638000.00 646000.00 606000.00 614000.00 661000.00 481000.00 682000.00 471000.00 592000.00 685000.00 816000.00 502000.00 748000.00 543000.00 712000.00 529000.00 787000.00 656000.00 756000.00 484000.00 637000.00 629000.00 646000.00 585000.00 705000.00 609000.00 585000.00 cis-p-Coumarate 17000000.00 15800000.00 12000000.00 17200000.00 15100000.00 14400000.00 15300000.00 14400000.00 15000000.00 16000000.00 17700000.00 12900000.00 18500000.00 15200000.00 15500000.00 15500000.00 19700000.00 14200000.00 17300000.00 19600000.00 19000000.00 16900000.00 13500000.00 16000000.00 20600000.00 18300000.00 19300000.00 18500000.00 19200000.00 16900000.00 19500000.00 16100000.00 14400000.00 13600000.00 12800000.00 19000000.00 17000000.00 15300000.00 15000000.00 14600000.00 18600000.00 15500000.00 16400000.00 14800000.00 15300000.00 13200000.00 13300000.00 13900000.00 16700000.00 14600000.00 16300000.00 16200000.00 13300000.00 15500000.00 15000000.00 14700000.00 19400000.00 15900000.00 17200000.00 15300000.00 15400000.00 15900000.00 14300000.00 16000000.00 16700000.00 14500000.00 16600000.00 12200000.00 16400000.00 12600000.00 14500000.00 15900000.00 15700000.00 13700000.00 15500000.00 19000000.00 17600000.00 16100000.00 13400000.00 13200000.00 N6-Methyl-L-lysine 604000.00 597000.00 596000.00 879000.00 415000.00 280000.00 406000.00 315000.00 621000.00 598000.00 652000.00 847000.00 397000.00 336000.00 372000.00 285000.00 552000.00 490000.00 568000.00 877000.00 449000.00 330000.00 290000.00 324000.00 627000.00 518000.00 580000.00 786000.00 393000.00 288000.00 393000.00 297000.00 462000.00 505000.00 564000.00 824000.00 365000.00 320000.00 320000.00 355000.00 630000.00 560000.00 642000.00 799000.00 404000.00 310000.00 397000.00 411000.00 641000.00 597000.00 559000.00 949000.00 384000.00 303000.00 311000.00 365000.00 597000.00 482000.00 621000.00 768000.00 372000.00 280000.00 363000.00 326000.00 628000.00 566000.00 487000.00 487000.00 356000.00 292000.00 385000.00 335000.00 557000.00 533000.00 505000.00 950000.00 375000.00 227000.00 395000.00 343000.00 Pyridoxamine 1100000.00 1280000.00 1190000.00 1340000.00 1190000.00 1080000.00 938000.00 1240000.00 1140000.00 1300000.00 1190000.00 1470000.00 1280000.00 1150000.00 1230000.00 1340000.00 1250000.00 1330000.00 1240000.00 1680000.00 1150000.00 1220000.00 1180000.00 1480000.00 1530000.00 1360000.00 1620000.00 1770000.00 1480000.00 1390000.00 1500000.00 1380000.00 978000.00 1200000.00 1260000.00 1400000.00 921000.00 1190000.00 959000.00 1060000.00 947000.00 1330000.00 1270000.00 1430000.00 1160000.00 1030000.00 1080000.00 1340000.00 1200000.00 1250000.00 1200000.00 1370000.00 1220000.00 1150000.00 1100000.00 1290000.00 878000.00 1240000.00 1080000.00 1430000.00 1160000.00 1200000.00 929000.00 1230000.00 1250000.00 1240000.00 1020000.00 1190000.00 1230000.00 1170000.00 1020000.00 1250000.00 1150000.00 1260000.00 1240000.00 1580000.00 1210000.00 1210000.00 1020000.00 1360000.00 N-Amidino-L-aspartate 489000.00 341000.00 449000.00 561000.00 414000.00 420000.00 471000.00 482000.00 419000.00 416000.00 417000.00 526000.00 428000.00 466000.00 476000.00 480000.00 459000.00 461000.00 515000.00 615000.00 521000.00 555000.00 522000.00 614000.00 541000.00 501000.00 763000.00 752000.00 735000.00 720000.00 741000.00 753000.00 531000.00 340000.00 456000.00 543000.00 435000.00 444000.00 465000.00 407000.00 493000.00 427000.00 431000.00 488000.00 382000.00 499000.00 492000.00 477000.00 444000.00 517000.00 418000.00 622000.00 465000.00 433000.00 589000.00 444000.00 390000.00 451000.00 506000.00 522000.00 475000.00 403000.00 484000.00 423000.00 435000.00 449000.00 482000.00 516000.00 417000.00 460000.00 507000.00 432000.00 468000.00 405000.00 469000.00 484000.00 471000.00 445000.00 522000.00 536000.00 2-Oxo-7-methylthioheptanoic acid 3330000.00 3620000.00 3330000.00 3460000.00 2920000.00 2640000.00 2610000.00 3260000.00 3430000.00 3470000.00 3160000.00 4480000.00 3390000.00 3440000.00 3050000.00 3860000.00 3420000.00 3940000.00 3070000.00 4250000.00 3750000.00 3190000.00 3260000.00 3860000.00 4600000.00 3470000.00 3980000.00 5000000.00 4440000.00 3520000.00 4020000.00 4060000.00 2540000.00 3470000.00 3430000.00 3800000.00 3020000.00 3300000.00 3080000.00 3840000.00 2840000.00 3550000.00 3430000.00 3720000.00 3330000.00 3060000.00 3170000.00 3460000.00 3070000.00 3050000.00 3150000.00 3880000.00 3450000.00 2820000.00 3110000.00 4080000.00 2990000.00 3220000.00 2670000.00 3700000.00 2820000.00 3170000.00 2680000.00 3330000.00 3210000.00 3860000.00 3100000.00 3400000.00 3450000.00 3490000.00 2960000.00 3220000.00 3150000.00 3260000.00 3130000.00 4300000.00 3500000.00 3240000.00 2660000.00 3700000.00 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name CmpdID quantitated m/z retention times L-alanine C00041 90.0557 0.66 L-arginine C00062 175.1190 0.65 L-asparagine C00152 133.0607 0.66 L-aspartate C00049 134.0448 0.67 L-cysteine C00097 122.0273 0.66 L-glutamate C00025 148.0605 0.66 L-glutamine C00064 147.0762 0.66 glycine C00037 76.0401 0.67 L-histidine C00135 156.0768 0.61 L-leucine C00123 132.1018 0.71 L-isoleucine C00407 132.1019 0.97 L-lysine C00047 147.1126 0.61 L-methionine C00073 150.0582 0.69 L-phenylalanine C00079 166.0861 1.42 L-proline C00148 116.0709 0.67 L-serine C00065 106.0503 0.65 L-threonine C00188 120.0657 0.65 L-tryptophan C00078 205.0970 1.72 L-tyrosine C00082 182.0807 0.69 L-valine C00183 118.0866 0.69 L-cystine C00491 241.0302 0.66 Adenosine C00212 268.1035 0.71 Adenine C00147 136.0618 0.68 GMP C00144 364.0643 0.68 Guanine C00242 152.0543 0.69 Cytidine C00475 244.0959 1.77 IMP C00130 349.0534 0.68 Hypoxanthine C00262 137.0458 0.69 Xanthine C00385 153.0405 0.69 5-Hydroxyisourate C11821 185.0319 0.65 Nicotinamide C00153 123.0556 0.81 Glutathione C00051 308.0908 0.68 5-Oxoproline C01879 130.0499 0.66 gamma-L-Glutamyl-D-alanine C03738 219.0976 0.68 (5-L-Glutamyl)-L-glutamine C05283 276.1183 0.66 L-Homocysteine C00155 136.0428 0.69 Dimethylglycine C01026 104.0711 0.67 S-Adenosyl-L-homocysteine C00021 385.1206 0.65 Ornithine C01602 133.0975 0.61 L-Citrulline C00327 176.1027 0.66 Spermidine C00315 146.1651 0.59 Spermine C00750 203.2227 0.58 Creatine C00300 132.0771 0.67 Creatinine C00791 114.0664 0.66 4-Acetamidobutanoate C02946 146.0811 0.66 N-Acetylornithine C00437 175.1075 0.68 Guanidinoacetate C00581 118.0615 0.65 Pantothenol C00864 220.1176 1.6600 5-6-Dihydrouracil C00429 115.0506 0.6876 Hypotaurine C00519 110.0273 0.6566 L-Methionine S-oxide C02989 166.0532 0.8030 Indoxyl C05658 132.6187 2.1649 kynurenine C00328 209.0917 1.4000 Serotonin C00780 177.1023 0.8773 Ectoine C06231 143.0814 0.6783 N-Methylethanolamine phosphate C01210 156.0420 0.6489 Sphingosine C00319 300.2891 2.6176 Choline C00114 104.1074 0.6544 L-Carnitine C00318 162.1123 0.6579 acyl-C2 HMDB00201 204.1230 0.6873 acyl-C3 HMDB00824 218.1386 0.6904 acyl-C4 HMDB00736 232.1541 1.7128 acyl-C4-OH (Hydroxybutyrylcarnitine) HMDB13127 248.1480 1.7367 acyl-C5 HMDB00688 246.1698 1.7454 acyl-C5:1 (Tiglylcarnitine) HMDB02366 244.1542 1.7324 acyl-C5-OH ac107 262.1642 1.0943 acyl-C6 (hexanoyl-l-carnitine) HMDB00756 260.1855 1.7840 acyl-C6-DC ac109 290.1601 1.7305 acyl-C8 (L-octanoylcarnitine HMDB00791 288.2166 1.8684 acyl-C8:1 (octenoyl-l-carnitine) ac111 286.2010 1.8216 acyl-C10 (O-Decanoyl-L-carnitine) HMDB00651 316.2480 1.9914 acyl-C10:1 (O-Decenoyl-L-carnitine) CID57357170 314.2320 1.9290 acyl-C12 (O-dodecanoyl-carnitine) HMDB02250 344.2791 2.6575 acyl-C12:1 (O-dodecenoyl-carnitine) HMDB13326 342.2636 2.2381 acyl-C14 (O-tetradecanoyl-L-carnitine) HMDB05066 372.3101 3.4498 acyl-C14:1 (Tetradecenoyl Carnitine) HMDB13329 370.2946 2.9483 acyl-C16 HMDB00222 400.3413 2.0778 acyl-C16:1 (Hexadecenoyl-carnitine) HMDB06317 398.3259 3.6130 acyl-C18 (Octadecanoyl-L-carnitine) HMDB00848 428.3724 3.1572 acyl-C18:1 (O-octadecenoyl-L-carnitine) HMDB06351 426.3567 2.2497 acyl-C18:2 (Linoleoyl-CoA) HMDB01064 424.3408 3.2899 acyl-C20:4 ac125 448.3418 3.6340 Nicotinic acid C00253 124.0406 0.5917 Biliverdin C00500 583.2541 1.9941 Bilirubin C00486 585.2696 1.9267 Ergothioneine C02732 230.0957 0.6812 Methylenediurea C06381 133.0739 0.6659 cis-p-Coumarate C06738 165.0545 0.6954 N6-Methyl-L-lysine C02728 161.1285 0.6162 Pyridoxamine C00534 169.0959 0.6186 N-Amidino-L-aspartate C03139 176.0656 1.0033 2-Oxo-7-methylthioheptanoic acid C17220 191.0762 0.6228 METABOLITES_END #END