#METABOLOMICS WORKBENCH alanyl_20251203_122032 DATATRACK_ID:6822 STUDY_ID:ST004417 ANALYSIS_ID:AN007389 PROJECT_ID:PR002390 VERSION 1 CREATED_ON December 3, 2025, 12:40 pm #PROJECT PR:PROJECT_TITLE In vivo CRISPR screen identifies copper metabolism as a vulnerability in acute PR:PROJECT_TITLE lymphoblastic leukemia PR:PROJECT_SUMMARY The nutrient-sparse cerebrospinal fluid (CSF) poses a significant challenge to PR:PROJECT_SUMMARY spreading cancer cells. Despite this challenge, leukemia often spreads to the PR:PROJECT_SUMMARY CSF and represents a significant clinical complication. To uncover nutritional PR:PROJECT_SUMMARY dependencies of leukemia cells in the CSF that could be targeted PR:PROJECT_SUMMARY therapeutically, we conducted an in vivo targeted CRISPR screen in a xenograft PR:PROJECT_SUMMARY model of leukemia. We found that SLC31A1, the primary cell surface copper PR:PROJECT_SUMMARY importer, is a genetic dependency of leukemia in both the central nervous system PR:PROJECT_SUMMARY as well as in the hematopoietic organs. Perturbation of copper metabolism leads PR:PROJECT_SUMMARY to complex IV deficiency, perturbed nucleotide metabolism and slowed leukemia PR:PROJECT_SUMMARY cell proliferation. Furthermore, nutritional copper depletion reduced cancer PR:PROJECT_SUMMARY progression in cell line based and patient-derived xenograft models of leukemia. PR:PROJECT_SUMMARY Copper thus appears to be an actionable micronutrient in leukemia. PR:INSTITUTE Boston Children's Hospital PR:DEPARTMENT Pathology PR:LABORATORY Naama Kanarek PR:LAST_NAME Wong PR:FIRST_NAME Alan PR:ADDRESS 300 Longwood Avenue, Boston, MA, 02115, USA PR:EMAIL alan.wong@childrens.harvard.edu PR:PHONE (617) 355-7433 PR:FUNDING_SOURCE NCI 1R01CA282477-01A1 #STUDY ST:STUDY_TITLE Polar metabolite profiling of NALM6, REH, or MOLT16 cells treated with BCS or ST:STUDY_TITLE copper chloride. ST:STUDY_SUMMARY We investigated the effects of bathocuproinedisulfonic acid (BCS) treatment (a ST:STUDY_SUMMARY copper chelator) on steady state metabolite levels with or without rescue with ST:STUDY_SUMMARY 50uM copper (II) chloride. Cells were treated for 6-8 days with vehicle or 50uM ST:STUDY_SUMMARY BCS, and vehicle or 50uM copper (II) chloride. Cells were seeded at 0.125 ST:STUDY_SUMMARY million/mL (if passaged after 3 days) or 0.25 million/mL (if passaged after 2 ST:STUDY_SUMMARY days). This experiment revealed similar trends of nucleotide changes across cell ST:STUDY_SUMMARY lines. ST:INSTITUTE Boston Childrens Hospital ST:LAST_NAME Wong ST:FIRST_NAME Alan ST:ADDRESS 300 Longwood Avenue ST:EMAIL alan.wong@childrens.harvard.edu ST:PHONE (617) 355-7433 ST:NUM_GROUPS 4 #SUBJECT SU:SUBJECT_TYPE Cultured cells SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 SU:CELL_STRAIN_DETAILS SEM leukemia cells #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 - 20250828_QE2_HILIC_NALM6trac_AYW1487 Sample source:NALM6 leukemia cells | treatment:Vehicle RAW_FILE_NAME(raw file name)=20250828_QE2_HILIC_NALM6trac_AYW1487.raw SUBJECT_SAMPLE_FACTORS - 20250828_QE2_HILIC_NALM6trac_AYW1488 Sample source:NALM6 leukemia cells | treatment:Vehicle RAW_FILE_NAME(raw file name)=20250828_QE2_HILIC_NALM6trac_AYW1488.raw SUBJECT_SAMPLE_FACTORS - 20250828_QE2_HILIC_NALM6trac_AYW1489 Sample source:NALM6 leukemia cells | treatment:Vehicle RAW_FILE_NAME(raw file name)=20250828_QE2_HILIC_NALM6trac_AYW1489.raw SUBJECT_SAMPLE_FACTORS - 20250828_QE2_HILIC_NALM6trac_AYW1490 Sample source:NALM6 leukemia cells | treatment:BCS RAW_FILE_NAME(raw file name)=20250828_QE2_HILIC_NALM6trac_AYW1490.raw SUBJECT_SAMPLE_FACTORS - 20250828_QE2_HILIC_NALM6trac_AYW1491 Sample source:NALM6 leukemia cells | treatment:BCS RAW_FILE_NAME(raw file name)=20250828_QE2_HILIC_NALM6trac_AYW1491.raw SUBJECT_SAMPLE_FACTORS - 20250828_QE2_HILIC_NALM6trac_AYW1492 Sample source:NALM6 leukemia cells | treatment:BCS RAW_FILE_NAME(raw file name)=20250828_QE2_HILIC_NALM6trac_AYW1492.raw SUBJECT_SAMPLE_FACTORS - 20250828_QE2_HILIC_NALM6trac_AYW1493 Sample source:NALM6 leukemia cells | treatment:BCS and CuCl2 RAW_FILE_NAME(raw file name)=20250828_QE2_HILIC_NALM6trac_AYW1493.raw SUBJECT_SAMPLE_FACTORS - 20250828_QE2_HILIC_NALM6trac_AYW1494 Sample source:NALM6 leukemia cells | treatment:BCS and CuCl2 RAW_FILE_NAME(raw file name)=20250828_QE2_HILIC_NALM6trac_AYW1494.raw SUBJECT_SAMPLE_FACTORS - 20250828_QE2_HILIC_NALM6trac_AYW1495 Sample source:NALM6 leukemia cells | treatment:BCS and CuCl2 RAW_FILE_NAME(raw file name)=20250828_QE2_HILIC_NALM6trac_AYW1495.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1535 Sample source:MOLT16 leukemia cells | treatment:Vehicle RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1535.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1536 Sample source:MOLT16 leukemia cells | treatment:Vehicle RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1536.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1537 Sample source:MOLT16 leukemia cells | treatment:Vehicle RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1537.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1538 Sample source:MOLT16 leukemia cells | treatment:BCS RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1538.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1539 Sample source:MOLT16 leukemia cells | treatment:BCS RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1539.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1540 Sample source:MOLT16 leukemia cells | treatment:BCS RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1540.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1541 Sample source:MOLT16 leukemia cells | treatment:BCS and CuCl2 RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1541.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1542 Sample source:MOLT16 leukemia cells | treatment:BCS and CuCl2 RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1542.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1543 Sample source:MOLT16 leukemia cells | treatment:BCS and CuCl2 RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1543.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1511 Sample source:REH leukemia cells | treatment:Vehicle RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1511.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1512 Sample source:REH leukemia cells | treatment:Vehicle RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1512.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1513 Sample source:REH leukemia cells | treatment:Vehicle RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1513.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1514 Sample source:REH leukemia cells | treatment:BCS RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1514.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1515 Sample source:REH leukemia cells | treatment:BCS RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1515.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1516 Sample source:REH leukemia cells | treatment:BCS RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1516.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1517 Sample source:REH leukemia cells | treatment:BCS and CuCl2 RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1517.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1518 Sample source:REH leukemia cells | treatment:BCS and CuCl2 RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1518.raw SUBJECT_SAMPLE_FACTORS - 20250829_QE2_HILIC_REHMOLTtrac_AYW1519 Sample source:REH leukemia cells | treatment:BCS and CuCl2 RAW_FILE_NAME(raw file name)=20250829_QE2_HILIC_REHMOLTtrac_AYW1519.raw #COLLECTION CO:COLLECTION_SUMMARY 1-1.5 million cells from culture were collected via centrifugation for 20 CO:COLLECTION_SUMMARY seconds at 18,000xG at 4C, washed once with ice-cold 0.9% NaCl, and collected CO:COLLECTION_SUMMARY via centrifugation for 20 seconds at 18,000xG at 4C. Cells were cultured in CO:COLLECTION_SUMMARY RPMI-1640 with 10% FBS and penicillin/streptomycin in a 37C incubator with 5% CO:COLLECTION_SUMMARY CO2. CO:SAMPLE_TYPE Leukemia cells #TREATMENT TR:TREATMENT_SUMMARY Cells were treated for 6-8 days with vehicle or 50uM BCS or 50uM BCS and CuCl2. TR:TREATMENT_SUMMARY Culture media was RPMI-1640 containing 10% FBS and penicillin and streptomycin TR:TREATMENT_SUMMARY in 6-well plates. Cells were seeded at 0.125-0.25 million/mL and counted and TR:TREATMENT_SUMMARY passaged every 2-3 days. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Cell pellet was resuspended in 400uL of 100% LC-MS grade methanol supplemented SP:SAMPLEPREP_SUMMARY with isotopically-labelled amino acid standards [Cambridge Isotope Laboratories, SP:SAMPLEPREP_SUMMARY MSK-A2-1.2], aminopterin, and reduced glutathione standard [Cambridge Isotope SP:SAMPLEPREP_SUMMARY Laboratories, CNLM-6245-10]). with repeated pipetting up and down and vortexing SP:SAMPLEPREP_SUMMARY for 10 seconds. Then, 100uL of LCMS-grade water containing 125 mM Ammonium SP:SAMPLEPREP_SUMMARY Acetate, 10 mM Na-Ascorbate, and 7.9 mg/mL 5,5-dithio-bis-(2-nitrobenzoic acid SP:SAMPLEPREP_SUMMARY (Ellman's reagent) was added, and the sample vortex for another 10 seconds. SP:SAMPLEPREP_SUMMARY Samples were then centrifuged for 10 minutes at 18,000 g to pellet cell debris. SP:SAMPLEPREP_SUMMARY The supernatant was transferred to a new tube and dried on ice using a liquid SP:SAMPLEPREP_SUMMARY nitrogen dryer. The dried metabolites were then resuspended in 30uL and 2uL was SP:SAMPLEPREP_SUMMARY injected. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY 2 μL of each sample was injected into a ZIC-pHILIC 150 x 2.1 mm (5 μm particle CH:CHROMATOGRAPHY_SUMMARY size) column (EMD Millipore) operated on a Vanquish™ Flex UHPLC system (Thermo CH:CHROMATOGRAPHY_SUMMARY Fisher Scientific). Chromatographic separation was achieved using the following CH:CHROMATOGRAPHY_SUMMARY conditions: buffer A was 95% acetonitrile and 5% 20 mM ammonium carbonate, 0.1% CH:CHROMATOGRAPHY_SUMMARY ammonium hydroxide in water; buffer B was 95% 20 mM ammonium carbonate, 0.1% CH:CHROMATOGRAPHY_SUMMARY ammonium hydroxide in water and 5% acetonitrile. Gradient conditions used were: CH:CHROMATOGRAPHY_SUMMARY 0-17.5 min: linear gradient from 16.6% to 75.0% B; 17.5-18.0 min: linear CH:CHROMATOGRAPHY_SUMMARY gradient from 75.0% to 85.0% B; 18-20.0 min: hold at 85.0% B; 20.0-20.5 min: CH:CHROMATOGRAPHY_SUMMARY from 85.0% to 16.6% B; 20.5-24 min: hold at 16.6% B at 0.150 mL/min flow rate. CH:CHROMATOGRAPHY_SUMMARY The column oven and autosampler tray were held at 25 °C and 4 °C, CH:CHROMATOGRAPHY_SUMMARY respectively. CH:CHROMATOGRAPHY_TYPE HILIC CH:INSTRUMENT_NAME Thermo Vanquish CH:COLUMN_NAME SeQuant ZIC-HILIC (150 x 2.1mm,5um) CH:SOLVENT_A 95% acetonitrile/5% water; 20mM ammonium carbonate; 0.1% ammonium hydroxide CH:SOLVENT_B 95% water/5% acetonitrile; 20mM ammonium carbonate; 0.1% ammonium hydroxide CH:FLOW_GRADIENT 0-17.5 min: linear gradient from 16.6% to 75.0% B; 17.5-18.0 min: linear CH:FLOW_GRADIENT gradient from 75.0% to 85.0% B; 18-20.0 min: hold at 85.0% B; 20.0-20.5 min: CH:FLOW_GRADIENT from 85.0% to 16.6% B; 20.5-24 min: hold at 16.6% B CH:FLOW_RATE 0.15 mL/min CH:COLUMN_TEMPERATURE 25 #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE UNSPECIFIED MS:MS_COMMENTS MS data acquisition was performed using a QExactive benchtop orbitrap mass MS:MS_COMMENTS spectrometer equipped with an Ion Max source and a HESI II probe (Thermo Fisher MS:MS_COMMENTS Scientific) and polarity switching was used. Four scans were used: full scans in MS:MS_COMMENTS both positive and negative ionization mode in a range of m/z = 70–1000, with MS:MS_COMMENTS the resolution set at 70,000, the AGC target at 1 × 10e6, and the maximum MS:MS_COMMENTS injection time (Max IT) at 20 msec from 0-20 minutes.. Tune file parameters MS:MS_COMMENTS were: spray voltage = 3.5kV, capillary temperature = 320C, S-lens RF = 50, MS:MS_COMMENTS auxillary gas temperature = 350C. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS Normalized Peak Area MS_METABOLITE_DATA_START Samples 20250828_QE2_HILIC_NALM6trac_AYW1487 20250828_QE2_HILIC_NALM6trac_AYW1488 20250828_QE2_HILIC_NALM6trac_AYW1489 20250828_QE2_HILIC_NALM6trac_AYW1490 20250828_QE2_HILIC_NALM6trac_AYW1491 20250828_QE2_HILIC_NALM6trac_AYW1492 20250828_QE2_HILIC_NALM6trac_AYW1493 20250828_QE2_HILIC_NALM6trac_AYW1494 20250828_QE2_HILIC_NALM6trac_AYW1495 20250829_QE2_HILIC_REHMOLTtrac_AYW1511 20250829_QE2_HILIC_REHMOLTtrac_AYW1512 20250829_QE2_HILIC_REHMOLTtrac_AYW1513 20250829_QE2_HILIC_REHMOLTtrac_AYW1514 20250829_QE2_HILIC_REHMOLTtrac_AYW1515 20250829_QE2_HILIC_REHMOLTtrac_AYW1516 20250829_QE2_HILIC_REHMOLTtrac_AYW1517 20250829_QE2_HILIC_REHMOLTtrac_AYW1518 20250829_QE2_HILIC_REHMOLTtrac_AYW1519 20250829_QE2_HILIC_REHMOLTtrac_AYW1535 20250829_QE2_HILIC_REHMOLTtrac_AYW1536 20250829_QE2_HILIC_REHMOLTtrac_AYW1537 20250829_QE2_HILIC_REHMOLTtrac_AYW1538 20250829_QE2_HILIC_REHMOLTtrac_AYW1539 20250829_QE2_HILIC_REHMOLTtrac_AYW1540 20250829_QE2_HILIC_REHMOLTtrac_AYW1541 20250829_QE2_HILIC_REHMOLTtrac_AYW1542 20250829_QE2_HILIC_REHMOLTtrac_AYW1543 Factors Sample source:NALM6 leukemia cells | treatment:Vehicle Sample source:NALM6 leukemia cells | treatment:Vehicle Sample source:NALM6 leukemia cells | treatment:Vehicle Sample source:NALM6 leukemia cells | treatment:BCS Sample source:NALM6 leukemia cells | treatment:BCS Sample source:NALM6 leukemia cells | treatment:BCS Sample source:NALM6 leukemia cells | treatment:BCS and CuCl2 Sample source:NALM6 leukemia cells | treatment:BCS and CuCl2 Sample source:NALM6 leukemia cells | treatment:BCS and CuCl2 Sample source:REH leukemia cells | treatment:Vehicle Sample source:REH leukemia cells | treatment:Vehicle Sample source:REH leukemia cells | treatment:Vehicle Sample source:REH leukemia cells | treatment:BCS Sample source:REH leukemia cells | treatment:BCS Sample source:REH leukemia cells | treatment:BCS Sample source:REH leukemia cells | treatment:BCS and CuCl2 Sample source:REH leukemia cells | treatment:BCS and CuCl2 Sample source:REH leukemia cells | treatment:BCS and CuCl2 Sample source:MOLT16 leukemia cells | treatment:Vehicle Sample source:MOLT16 leukemia cells | treatment:Vehicle Sample source:MOLT16 leukemia cells | treatment:Vehicle Sample source:MOLT16 leukemia cells | treatment:BCS Sample source:MOLT16 leukemia cells | treatment:BCS Sample source:MOLT16 leukemia cells | treatment:BCS Sample source:MOLT16 leukemia cells | treatment:BCS and CuCl2 Sample source:MOLT16 leukemia cells | treatment:BCS and CuCl2 Sample source:MOLT16 leukemia cells | treatment:BCS and CuCl2 2.oxobutyric acid 65734810.97 59596946.57 52920471.48 45273455.59 51038453.24 56394110.38 63823056.46 64083622.77 66833507.5 72686832.09 67396621.57 68071843.36 46453182.27 41092248.42 40592326.56 63353062.03 53264127.6 48098180.75 46510857.96 45203454.22 45846276.36 60083195.91 49957757.3 41033236 77663661.36 70120087.72 67648401.49 3.phosphoglycerate 38866313.97 40559166.22 35369423.46 10419720.72 10725283.13 10777002.61 35731907.88 35096988.61 36830225.94 7808285.819 7359003.603 0 4336827.42 4447212.929 4684346.863 7014738.974 9736119.31 8339943.494 9852437.446 8779440.14 9922795.936 4005426.423 8008292.656 7733802.589 7155034.266 8680829.221 8473476.293 Acetyl.CoA 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5856052.144 11377744.88 6553093.036 5048126.423 2880190.02 2795717.393 8268245.717 4659464.428 3505182.315 acetylcarnitine 0 0 0 0 0 0 0 0 0 3684172.47 1403572.221 3362610.265 14960141.23 16139905.2 18441063.86 5918813.074 4611597.451 1731079.355 63283013.17 92505949.38 75302017.5 69643876.29 47238705.83 45050962.32 90849787.56 82394223.6 83484789.02 adenine 0 0 0 0 0 0 0 0 0 314893416.1 296691203.2 285772230.3 170953971.2 190117567 183557825.2 388282103.2 248433177.7 217760055.3 390788173.9 384124516.3 456226627.8 0 180875442.1 203457106.3 309159472 270918856.6 256891085.7 AICAR 848304.5698 671982.1013 370604.69 7511579.09 7810902.643 7097445.931 8120119.729 8764576.892 7904745.624 39306338.23 42366759.79 41617450.52 46174209.58 28544345.58 44213516.87 25025693.23 30446536.81 28298799.2 0 473877.3744 151860.8816 1925829.429 7098680.788 8067989.696 6051152.661 5121455.317 5617105.568 alanine 117490695.7 119074196.5 151349011.5 60770415.07 40283634.89 26798026.86 76666078.66 83333216.87 97949312.8 1105778299 765941972 1258774364 584595794.5 403140168.1 754841157.9 662822928.2 1124431543 1003648867 25334036.53 29374707.85 29252256.69 28139978.26 17153606.54 18908476.67 30265219.71 18808920.48 33404807.32 arginine 1845819073 1973306289 1957630284 2047493144 2248578964 2209685957 2093787726 2134434389 2218566320 2824108002 2843351579 2695596748 2121124924 2300593195 2098609077 2138461919 2614950976 2332554089 0 0 0 0 0 0 0 0 0 argininosuccinate 30067935.09 31114436.15 32355384.71 31655588.35 35044922.81 36154033.92 38386619.39 32321205.31 35581554 19917876.44 19782284.05 18662708.07 13842304.11 15357942.83 13396624.05 17175342.95 19911927.76 18402214.97 821510377.4 468975808.4 789400602.1 531216710 588057310.8 579444497.9 669001132 764760231.2 788706051.2 ascorbate 92943856498 50982699403 70987534357 89721661214 74980412021 84665559187 78833215652 96022303223 73454835582 76156501461 81995641924 1.14169E+11 71757714407 30462083726 80669882830 97867098367 83591904788 1.00707E+11 88609661114 75945940880 54064401541 83714978718 53777380738 64528465279 99201091496 68341923959 64239579336 asparagine 1050830813 1031904582 1241981320 854889165.8 753061227.7 792260252.2 849852547.5 1191390189 1160059771 368070501 399473374.1 449434766.1 108271623.8 85748784.85 98497329.34 330682929.5 412242050.9 366958677.7 82573775.78 66619337.89 84060947.41 15670857.93 12230569.27 12910125.2 72477607.73 89001483.91 85271716.43 aspartate 174464573.3 172650226.2 179669360.2 11574932.31 12425005.87 14915311.3 257063556.9 230178593.7 230937878.2 3002656.974 2923536.908 2828860.19 3207879.847 3411947.899 3134759.298 2527582.869 3180474.372 2647804.206 2186415.515 2181018.745 2411175.475 1968357.665 2245887.628 2269012.479 2410136.73 3445957.755 3032450.874 asymmetric.dimethylarginine 3949872.312 4566832.661 3679464.382 3679550.566 4074952.323 3932773.568 3553734.058 3366288.085 3721700.53 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ATP 569518446.8 650297022.2 546536686.1 260104214.4 251001992 236226641.7 611048873.6 540189801.1 556692555 535064344.8 534667606.5 558255940.6 331075685.6 359147110.1 336062916.7 378378543.7 489265529.2 408389283.5 448371274.5 384063056.2 473713075.6 76957840.85 238679447.5 223174696.2 278387354.3 402053777.6 404538901.4 Butyrylcarnitine 30989821.47 32271704.92 28826211.64 5587564.053 5370363.151 5202245.849 30511518.48 29607664.2 32962073.66 5718299.718 4985760.587 5271900.377 6650241.533 7522402.145 6300427.262 5341205.997 5940626.494 4437661.962 52993745.98 60740585.21 58657938.75 36136750.7 28913338.95 30347215.02 48073680.97 57200360.8 51332002.24 C5.Carnitines 10726578.29 10622378.36 11099034.64 211864.5474 95918.56306 56208.71437 11269608.73 11035325.89 11692982.52 9534962.533 9762972.751 9385402.587 1059350.463 1283865.117 1172142.217 13257800.72 14724154.79 13197687.23 43359272 50530443.72 53992715.66 28494930.31 22205507.49 21225165.35 66938669.65 64459648.67 68572769.68 carnitine 58371041.53 63101579.17 57575876.33 45464545.02 31201424.69 29528792.51 57361738.79 57103909.18 61490268.5 78098113.5 71994983.59 69686614.72 58155376.55 61399362.31 59055378.99 96946986.35 84093875.58 81796066.64 101898900.1 161181674.8 121870959 97724368.16 70517140.2 73457759.69 149689127.9 149623830.5 137425781.9 CDP 4602441.116 4662843.164 4784195.191 2095005.852 2323920.472 2199657.013 4947115.634 4488997.722 4594954.777 2258806.383 2515633.223 2194163.91 4112107.956 4255645.987 3792450.977 1710417.872 1723398.679 1786362.704 0 0 0 0 0 0 0 0 0 cis.aconitate 15318781.45 12873804.98 10529059.13 2966523.875 5475047.789 3817838.995 10728874.84 13502311.2 9824822.54 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 CDP.choline 0 0 0 0 0 0 0 0 0 2519882.721 2610785.789 3041878.787 6019239.937 5756252.527 5842531.192 1736017.162 2056635.731 1860953.413 0 0 0 0 0 0 0 0 0 citrate 584052958.1 532000861.4 581641535.4 124074839.4 150275933.4 166171153.6 651354555.9 597256854.6 612518625.4 197854761.2 194475240.4 193455301.6 47563705.28 42430882.86 37925677.81 126575575.1 164310031.8 151112727.9 470562126.8 447556817 516086982.2 318961399.9 215834714.8 215795014 447816518.2 581562755.5 545946109.5 CMP 608490.0563 598455.4636 693839.829 374181.2527 367887.6636 377215.1356 633870.4958 564004.7078 630451.7289 67808.05819 142715.5283 50876.33365 445004.0319 497563.2624 480055.3276 76298.17462 177809.6192 97461.83883 103484.0497 74503.36163 158530.5815 668827.3383 148814.4234 136440.8536 208314.0261 72529.30333 176484.976 creatine 3267468459 2311105851 2849111765 3579969424 2260176411 1634033473 1656551896 2177497926 1600732491 71710774.18 64456029.08 91395732.15 85665822.07 46521612.49 91170091.09 124114762.4 92105030.44 117095730.8 83883185.13 110028528.6 59882814.37 144180364.2 64147680.66 67718445.77 84045293.09 56136174.6 77872759.67 CTP 73408329.61 84729391.25 71013259.54 13564021.28 13429595.73 12329463.62 81065186.12 72113627.13 73792490.33 44233331.16 46903285.33 47206760.13 40519867.01 43770834.28 41140668.61 30564423.84 43409073.94 35380475.37 55013659.87 46439778.61 58032703.55 11132261.69 32906126.32 32426105.88 34974494.2 50341788.54 48569813.46 cystathionine 5470630.479 5966980.654 6346296.775 1056352.275 1388335.737 1666407.333 6315231.977 4905703.176 5624012.251 0 0 0 0 0 0 0 0 0 44736782.17 37177710.48 50086658.46 22662048.27 36144020.79 32646039.77 32488543.03 45502286.33 40752481.96 Cysteine-Ellmans 0 0 0 0 0 0 0 0 0 21025820.72 13135523.15 27556019.63 25506337.97 18596069.45 13492670.92 55180879.57 29651784.75 33104695.44 0 0 0 0 0 0 0 0 0 dihydroxyacetone phosphate 4872779.339 6222893.094 6713200.432 4619800.36 4778778.672 7267980.99 7947831.891 5191948.077 5131592.596 0 0 0 0 0 0 0 0 0 6358452.271 4392078.224 7082253.563 4253028.174 11210987.93 12641415.68 5153509.069 6439216.958 6720083.418 dihydroorotate 171760.5212 80336.48039 46714.55216 17402203.55 10672495.35 11532870.69 339105.4903 37956.08054 32993.52648 27555.16367 236308.7913 84307.84006 6260469.159 11178114.8 5657725.964 145089.3335 6477590.193 10347125.61 9580299.787 8410729.444 10471238.05 40257814.52 38200835.63 34436450.8 9511424.463 14247567.84 11853945.26 F6P.G1P 7638141.956 7409666.877 7775620.058 19590390.43 21988317 21718554.97 6397841.396 7329547.538 6701614.5 3050221.941 3441517.32 3154688.398 10608514.77 9846027.39 10319516.14 3899162.49 4541638.44 3790749.624 0 0 0 0 0 0 0 0 0 FAD 1944802.576 1470390.45 1981719.119 2010029.823 942627.8157 913026.0349 952601.944 1404690.076 1114027.512 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 formyl methionine 3261723.874 3790442.459 3386930.138 761230.5811 1949269.37 1414342.263 3710379.821 4010790.435 4934560.866 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Fructose.1.6.bisphosphate 12864303.95 14708508.22 13545956.5 32413704.48 35498444.05 35703972.43 11460871.82 12276915.69 13338841.04 4982813.142 4682383.518 5772616.746 7903699.031 9455255.444 9258167.695 5455028.639 6752985.147 5866208.944 14407996.58 12256856.99 13462762.66 19279829.89 44148513.4 41898085.25 13572200.23 19483773.43 19064989.26 fumarate 77639462.8 74704141.93 77938245.81 29078739.23 29156747.97 27250418.42 67968953.64 67590203.36 72698260.84 14181291.53 15947547.42 15644433.9 8427941.669 15599952.8 10091388.07 11475092.85 16234011.11 13972857.19 39325502.27 34237837.28 39199862.74 21609222.83 23197500.14 22407235.47 28567197.62 40175897.54 36686762.95 GDP 10376131.46 11361362.72 9948989.117 13937516.07 14347831.8 13880867.82 10511367.49 9970627.146 10856620.64 7378725.535 7248953.519 6718056.054 8094744.65 8089939.651 7586596.279 5289123.784 6211550.705 5312944.123 0 0 0 0 0 0 0 0 0 Glucose.6.phosphate 5037027.893 5288549.21 5294628.597 11887736.4 13152622.49 13743811.76 4142233.721 4640920.364 5447920.072 0 0 0 0 0 0 0 0 0 6347071.653 5826693.324 6792307.128 7018801.413 9239178.12 8452746.93 6122279.974 9144896.042 7783799.609 glutamate 5439861153 4525796587 4452391636 5628794009 5815393756 5949336962 4444579981 6355788610 5101705912 4299914341 3576266792 5412537651 3470900050 2687021016 3584172685 3677230566 3885930797 3755635297 4955110078 4627724036 4164051991 4787020026 4134262346 4013829614 4938549226 4751299436 4444779284 glutamine 7546131689 5025751426 8513534640 7383856963 6675658733 5252573823 8401591999 8410258695 7318426257 8964268771 8042703600 10795390101 7021229784 3558126800 7848294544 8928689051 8096149529 9291171519 0 0 0 0 0 0 0 0 0 Glycerol.3.Phosphate 24574850.48 22797901.07 24060860.7 387916666 419473705.1 440821343.4 23360884.97 21371434.01 21084650.79 22722848.41 25919761.31 30763418.58 123969111.2 105106035.3 126671959.1 17167700.89 22315567.45 19839448.84 137073182.1 112945751.2 147643736.4 147213087.4 318402635.2 316560513 95414812.45 114748719.5 110934408.2 Glycerophosphocholine 6957289356 4771524324 6512961414 5236207023 3248320272 2237986119 3494311531 5482902307 5030194305 4393184007 4859326921 6247038451 4071054443 1936713634 4358281342 4814233504 3027315033 4390848408 4813523078 5527670185 3899674362 5287520461 2097173447 2522501333 3940672067 2100138972 3220262908 glycine 30575957.87 143528735 25821025.03 32937386.89 33010377.01 29170184.66 46539576.03 44055407.8 19365542.56 21917508.57 20265947.17 25017037.64 20085908.76 13965613.37 23167678.48 18264861.56 21528009.62 20408053.4 71387334.86 27620364.66 28086934.66 18142765.34 15441188.41 25853818.17 9037553.96 8374976.101 9168989.903 GMP 1983682.549 2269023.897 2419238.021 6385450.854 6948720.787 6566867.166 1625550.65 725535.4192 1238171.777 775268.6017 1061948.748 673872.1298 2665647.108 2362533.818 2108757.4 1283250.156 839003.9997 336512.3974 868084.9544 653224.4981 1004976.048 1320640.279 2129241.083 1769538.649 888500.2531 2102970.431 1706540.037 GSH Ellmans 731254075.4 699400482.3 643211732.5 581263299.9 601476693.1 585959223.4 486632091.8 650840654.2 598627428.4 467719679.4 450637266.8 628141959.1 497710076.6 333422950.7 486279727.8 598217958.9 493349873.1 663301887 1227828632 1114968929 1306379576 1101347840 779632049.1 1117427404 1114911209 1016585102 1366269615 GSSG 7785026.782 9022516.374 7858569.182 5613446.01 6233987.376 6834501.312 6292841.98 6146267.142 6600238.854 5920623.289 5933638.995 5779417.364 4928926.671 5540203.875 5131417.663 6135821.972 7452473.243 6474097.43 12126592.1 11696258.8 14497628.85 12546945.59 13332687.61 12756870.51 10851684.01 15927832.15 13540423.84 GTP 57243933.12 67916187.99 53155543.59 48248889.04 42713129.95 41936241.58 55478474.87 53512440.92 51225916.75 44805302.96 43955754.5 49046162.32 31534358.35 33152982.01 32791909.01 30884322.84 43289652.06 37329540.88 37855911.05 29852021.06 39032593.26 9614739.98 34127030.73 31706700.8 23414639.97 35268119.43 34736257.42 guanidinoacetate 22361734.21 18342666.69 17809215.12 34905832.97 39124214.99 36090263 15669296.5 21415846.01 16587800.78 0 62996.13964 0 0 59626.63929 0 0 0 130911.1563 0 0 0 0 0 0 0 0 0 hypotaurine 16436276.52 10765178.93 18569383.72 23884999.51 21697384.17 18091294.16 21241687.19 14723448.18 17268404.72 0 0 0 0 0 0 0 0 0 18806277.85 16211253.8 17228887.92 29520401.63 18959090.83 22828262.35 28956438.95 22213767.15 23478082.08 guanine 0 0 0 0 0 0 0 0 0 19743659.05 17214900.74 12926215.11 11278675.36 13644322.47 10054261.86 17880583.77 10519563.44 9157262.343 0 0 0 0 0 0 0 0 0 IMP 3051617.345 3642963.137 4060435.056 121392067.1 139760987 147539718.5 4033276.085 3194121.095 3433382.222 216858.9807 271896.527 124100.0761 4462565.416 4559166.619 4809511.861 551980.776 419507.3377 667829.7902 2663172.768 2440297.677 2907654.957 21492063.17 77867023.73 75440446.26 2341902.513 2875289.26 2745106.646 isoleucine 515915279.1 414928040.2 485312269.4 354338322.3 594365927.5 555445330.3 576789089.3 549337346.8 601843361.3 719984576.5 705087028.1 708479890.5 515334423.2 583771487.9 511881798.6 751475938.4 538543159.2 593449845.3 492310493 722164890.4 521016454.2 791791150.8 568580899.2 564618471.9 624793368 507097735.3 584123310 leucine 289133539.6 297805625.2 261095407 113347898.7 280106479.1 291323455.1 263546481.6 268633050.1 310953900.4 313904617.5 319041735.8 272921100.3 260492366 264960245.4 227477815.5 363940112.8 291112342.6 264657415.1 29334456.32 22136488.41 26516804.95 35188463.73 38790383.79 36819955.23 25908495.53 35494503.26 31167928.61 lysine 25950106.02 29047585.92 27128424.83 46463206.04 51782795.46 51987381.06 31723849.65 34889233.5 37806431.09 62660516.61 61112021.51 56642544.86 46713086.58 50673704.19 45047488.6 48800555.77 56806583.92 52129527.59 193130240.8 276363207.1 198784441.9 346616513.4 217458188.7 193086327.6 260315683.5 206531663.9 181573038.1 methionine 210299838.5 212983577.4 203163961 138050557.6 215060354.9 229214291 249924744.1 192952702.8 216515323.3 291543335.3 271164533.6 254324272.3 206308717.2 250559681 189170992.5 370481685 215122893 196915981 0 0 0 0 0 0 0 0 0 methylthioadenosine 55813875.19 53641071.58 55189321.59 9787698.873 16826411.59 16651421 47508512.21 55531313.02 52384229.16 6916795.483 6490137.849 6859246.603 6633381.398 7240147.29 6833402.417 9086865.353 7707609.288 5356792.965 6936330.476 11372895.96 7964265.919 8897184.836 5708120.373 5907694.534 10040619.05 6754851.783 7482404.161 N.acetylglutamate 6637049.386 5961960.378 7002736.947 7058495.858 4440382.071 5816906.05 4576406.232 7730170.047 6474951.868 0 0 0 0 0 0 0 0 0 10580625.82 10581485.46 8401558.958 17855508.25 12887979.64 14084196.29 9732576.464 8517857.234 11157436.78 NAD 189677586.3 93839417.04 182197658.5 128796539.3 98036653.46 84325766 194703035 177623895.3 165951865.2 117448255.5 115594653.2 144090001.7 120939490.9 62253238.33 135214991.3 140848456.1 109271408.1 145859304.3 210877854.5 230845083.8 210049287 182621294.6 109441168.5 129290042.5 202432580.3 146299226 164183750.5 NADH 16533350.84 12034490.14 17539569.12 39073833.37 25695039.22 27265563.4 10800897.86 12761086.12 13536736.66 0 0 0 0 0 0 0 0 0 9280724.311 11282242.45 10620579.26 21215618 10963949.72 11803228.42 10455497.47 6938896.177 7541618.792 NADP 1585093.12 1865823.597 1672511.387 566851.0036 768449.4152 762812.2639 1853965.468 1621232.347 1621660.007 1056414.854 1106902.12 856447.4732 952166.6731 877540.1159 832352.7133 605218.6562 816691.7987 737989.8394 1222995.26 1205611.125 1375913.08 629283.506 753362.0721 788487.5163 919816.9645 1013722.141 1123598.92 NADPH 9493177.259 10797405.8 10403419.16 5052926.256 5969577.47 5736913.75 12347599.93 10001751.8 10833062 7427655.88 6710986.819 6403100.146 4566248.941 5348064.606 4434131.497 5025586.245 6161595.573 5484903.639 7137733.766 5456951.878 7658194.019 3577009.374 3907990.605 3571459.306 5081704.554 7271083.46 5978640.401 niacinamide 48553409.35 48040548.61 49010064.96 17654700.93 43522182.57 44982460.26 49895810.97 56708296.23 61877669.86 26841007.91 26839174.01 34135413.13 28831992.63 38187450.92 39009443.21 37362999.93 26402065.46 28301188.44 24775967.88 40078145.64 28488731.53 42730548.99 31585600.78 36889814.67 41115768.02 40972129.08 37620922.41 ornithine 26562140.74 28355187.23 28835352.64 34433486.11 39578076.72 38961375.61 34290301.28 32657873.92 35478617.39 49385541.36 49826725.49 46191020.17 38888180.3 41497249.42 35702849.26 36613743.42 41373303.26 38491197.41 0 0 0 0 0 0 0 0 0 phosphocholine 19666288567 15965731623 17976657305 5678241754 6227361601 6279583492 17556487363 21457266892 18439681541 296908859.3 360991285.1 229764899 147941373.1 132542374 171057801 254028753.4 255285920.1 171879694.3 115757657.8 109873990.1 98459008.35 180624908.9 110663062.2 97918651.17 219068665.9 177362009.5 123200851.5 phosphocreatine 6271669.257 6288709.499 6464483.481 4310357.056 5146577.046 5997277.561 5111169.901 4107122.262 4357198.58 7233128308 6624318890 8104371404 3758535287 2997848535 3654072926 6340559364 7247491524 6735389089 10529999192 9270295743 9432984353 5374715567 5396231945 5084064644 6941969076 7801520297 7406040904 phosphoenolpyruvate 11431922.97 10398763.51 10033368.03 1033152.789 1041858.923 428493.3813 10949900.89 10399806.15 10683613.45 1818248.65 2293655.44 2146886.785 729192.0863 949416.8413 921456.6235 2083793.991 2459141.433 2087682.487 0 0 0 0 0 0 0 0 0 proline 1841872629 1515060193 2197305622 2286639816 1334904177 1333915422 2168396551 1977144312 2037062826 1367319985 1357265980 1182666427 624786626.1 1005118423 804908410.3 2015711172 983348252 1048742984 1368006858 2866675362 1681797466 2729042108 1725010755 1366429729 2770846274 2030511848 1612542666 PRPP 10230557.9 13434972.76 11398827 13591431.03 12742423.36 12342303.02 11518297.59 9727654.688 10654714.17 5088356.589 4574593.863 5302480.756 3334983.437 3371490.262 3708172.336 2806464.356 4704288.574 4483068.036 11481066.44 7302083.773 11462507.55 8422763.564 24709932.88 25539466.56 4547069.041 7046118.374 8203802.921 Pyridoxine 64388002.39 65837310.15 57723133.2 27080806.79 41614467.18 43269257.55 60694520.49 62279779.05 62989297.54 37395807.76 33608315 32616081.23 23500595.05 26684806.42 22135692.48 36934996.81 28267599.14 23823297.44 47480064.84 52287132.58 42394450.42 53528119.23 38760211.55 35955927.9 49505068.61 45429604.71 46451332.26 Ribose.1.phosphate 3599936.788 3963933.896 4313494.514 13085632.98 14180042.02 12599433.72 4018159.054 3384414.418 3685013.12 3840459.61 2550814.306 3701860.495 5238487.266 4102199.021 5303963.51 4750222.888 5983458.566 5508843.582 4149549.868 2842453.08 3962999.106 14511798.18 31968557.49 30867773.54 3138816.178 4623049.582 3814756.339 S.Adenosyl.L.methionine 229250035.1 162365180.8 198169322.8 112750126.8 122769632.1 127951796.9 213015447.4 261705212.5 231609252.2 106457039.8 96148167.68 134616848.2 112435951.9 74524763.43 105514148.1 102197644.2 114340495.8 110838565.5 169790863.5 151944219.8 145415854.2 140239271.2 124415720.6 117910869.7 149890354.6 145901065.8 163407977.8 saccharopine 1247268.366 1245599.233 1176344.975 11153461.85 11091425.24 12693836.43 1779962.02 1533322.833 1539605.754 3640951.237 3552152.143 3661810.3 416657.6669 104401.7855 100565.9124 4270600.599 5365942.009 4395554.303 0 0 0 0 0 0 0 0 0 sarcosine 117904958.3 119074196.5 151347867.7 60761558.92 40283634.89 27433946.65 76666078.66 83470848.82 98167404.43 0 0 0 0 0 0 0 0 0 25336700.24 29373429.1 29252256.69 27805775.48 18367748.69 18910887.83 30410643.87 18769958.67 33201943.73 Sedoheptulose.7.phosphate 1954620.84 2317671.668 2017268.743 11020873.31 12207005.93 13079623.56 2090258.565 1651677.052 1749251.5 3350775.456 3753295.276 3115667.324 10853501.78 11712168.97 10795726.81 4277949.41 5315667.792 4224253.413 10604296.69 9256709.432 12202132.22 23382803.07 33531582.75 31853598.54 7059721.956 10267885.29 8155211.706 serine 80434466.41 72962058.07 74062786.08 92055710.94 86182007.64 95173037.09 69748498.52 103969058.4 86669389.83 153321586.4 153954418.2 187682444.5 106405733.8 71491030.57 116501202.2 147973109.9 159809971.6 159572204 81024064.92 69950248.68 64747040.58 79961598.45 69770596.25 67981909.23 101612145.3 83494380.41 93782958.11 sorbitol 0 0 0 0 0 0 0 0 0 31654787.52 23910696.97 37118068.57 31302511.35 27711987.66 22800952.14 66094288.09 37376180.98 43208383.18 0 0 0 0 0 0 0 0 0 succinate 68042781.96 81923336.74 91638143.44 134374151.4 137882027.8 150799235.3 120014668.9 104598151.9 95300518.52 130204256.8 111562633.8 99321403.62 70393564.24 60620695.01 57144246.79 75522677.32 94821819.08 77761024.94 0 0 0 0 0 0 0 0 0 tryptophan 48584770.46 46669727.09 45840503.61 29232726.87 48450765.55 52619673.02 56400634.84 47426048.01 51430798.58 61470350.51 56742476.05 53643147.87 45646943.19 52350939.14 40533838.47 80636353.79 44558580.51 43746794.56 42034325.93 60998823.92 44517719.6 75908707.6 49184648.98 44282681.18 61252940.79 48224220.3 41809294.91 tyrosine 100885955.1 96209839.98 119924721.1 204991065.1 117157251.1 99925009.9 118580998.4 98892385.87 122017473.7 243275137 180265071.1 181999508 124920172.5 217963636.6 137701908.6 324836291.7 153677343.9 140049948.6 94788797.76 193562759.5 112778958.7 230480649.8 134301448.5 127016483.5 182762763.5 152465978.2 104267587.3 UDP.GlcNAc 139358314.9 150288933 153326244.2 17167296.19 20640793.45 20402570.37 167992738.1 162984113.5 165188449.2 97832207.75 90191004.52 98542024.84 80072769.17 57779325.59 81372988.4 76863086.71 94418166.33 82146241.03 116552228.9 96859079.54 124849749.7 35956108.95 34743627.02 37118388.05 86552026.59 105408488.4 102123144.3 UDP 13703088.76 13653717.4 11740082.34 6316950.018 6861219.972 7587829.721 13770389.18 12888162.35 13228796.69 5267078.01 5075370.054 4372861.132 11395807.23 11566007.53 10504627.6 2996762.67 4226559.558 3558483.019 0 0 0 0 0 0 0 0 0 UMP 0 0 0 0 0 0 0 0 0 356808.8131 485627.6702 430085.7944 1857995.129 1133819.584 1833687.753 405620.9799 457759.5365 426231.417 0 0 0 0 0 0 0 0 0 Ureidosuccinic acid 2311698.89 2652512.221 2322378.385 153449629.5 168524881.6 165720578.9 1370908.678 1407304.428 1412080.99 0 0 0 88457068.77 95351738.49 89729723.46 0 0 0 0 0 0 0 0 0 0 0 0 UTP 220395693.3 240189807.3 206778732.1 35412756.72 35314965.8 34485803.86 236119274.4 219514979.7 212086913.8 108269095.6 109259971.7 115102399.7 111355288.9 116227252.3 108992802.6 74337770.8 96116861.46 81750932.26 142033538.3 123973587.7 148891987.5 31128878.82 95070768.38 88144824.41 94453042.26 134350021.5 131240754.9 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name 2.oxobutyric acid 3.phosphoglycerate Acetyl.CoA acetylcarnitine adenine AICAR alanine arginine argininosuccinate ascorbate asparagine aspartate asymmetric.dimethylarginine ATP Butyrylcarnitine C5.Carnitines carnitine CDP cis.aconitate CDP.choline citrate CMP creatine CTP cystathionine Cysteine-Ellmans dihydroxyacetone phosphate dihydroorotate F6P.G1P FAD formyl methionine Fructose.1.6.bisphosphate fumarate GDP Glucose.6.phosphate glutamate glutamine Glycerol.3.Phosphate Glycerophosphocholine glycine GMP GSH Ellmans GSSG GTP guanidinoacetate hypotaurine guanine IMP isoleucine leucine lysine methionine methylthioadenosine N.acetylglutamate NAD NADH NADP NADPH niacinamide ornithine phosphocholine phosphocreatine phosphoenolpyruvate proline PRPP Pyridoxine Ribose.1.phosphate S.Adenosyl.L.methionine saccharopine sarcosine Sedoheptulose.7.phosphate serine sorbitol succinate tryptophan tyrosine UDP.GlcNAc UDP UMP Ureidosuccinic acid UTP METABOLITES_END #END