#METABOLOMICS WORKBENCH jsfavate_20221201_115927 DATATRACK_ID:3618 STUDY_ID:ST002431 ANALYSIS_ID:AN003958 PROJECT_ID:PR001564 VERSION 1 CREATED_ON January 5, 2023, 5:29 pm #PROJECT PR:PROJECT_TITLE Linking genetic and phenotypic changes in the long term evolution experiment PR:PROJECT_TITLE using metabolomics PR:PROJECT_TYPE MS PR:PROJECT_SUMMARY The metabolome of a cell is the integration point of an organism's environment, PR:PROJECT_SUMMARY genetics, and gene expression pattern. The metabolic phenotype can be under PR:PROJECT_SUMMARY selection and is known to contribute to adaption. However, the metabolome's PR:PROJECT_SUMMARY inherent networked and convoluted nature makes relating mutations, metabolic PR:PROJECT_SUMMARY changes, and effects on fitness challenging. To overcome this challenge, we use PR:PROJECT_SUMMARY the Long Term Evolution Experiment (LTEE) as a model to understand how mutations PR:PROJECT_SUMMARY can transduce themselves through a cellular network, eventually affecting PR:PROJECT_SUMMARY metabolism and perhaps fitness. We used mass-spectropscopy to broadly survey the PR:PROJECT_SUMMARY metabolomes of both ancestors and all 12 evolved lines and combined this with PR:PROJECT_SUMMARY genomic and expression data to suggest how mutations that alter specific PR:PROJECT_SUMMARY reaction pathways, such as the biosynthesis of nicotinamide adenine PR:PROJECT_SUMMARY dinucleotide, might increase fitness in the system. Our work brings the field PR:PROJECT_SUMMARY closer to a complete genotype-phenotype map for the LTEE and a better PR:PROJECT_SUMMARY understanding of how mutations might affect fitness through the metabolome. PR:INSTITUTE Rutgers University PR:DEPARTMENT Genetics PR:LABORATORY Shah PR:LAST_NAME Favate PR:FIRST_NAME John PR:ADDRESS 145 Bevier Road, Piscataway, NJ, 08854 PR:EMAIL john.favate@rutgers.edu PR:PHONE 7325984642 #STUDY ST:STUDY_TITLE MS profiling of the Long Term Evolution Experiment ST:STUDY_SUMMARY The metabolome of a cell is the integration point of an organism's environment, ST:STUDY_SUMMARY genetics, and gene expression pattern. The metabolic phenotype can be under ST:STUDY_SUMMARY selection and is known to contribute to adaption. However, the metabolome's ST:STUDY_SUMMARY inherent networked and convoluted nature makes relating mutations, metabolic ST:STUDY_SUMMARY changes, and effects on fitness challenging. To overcome this challenge, we use ST:STUDY_SUMMARY the Long Term Evolution Experiment (LTEE) as a model to understand how mutations ST:STUDY_SUMMARY can transduce themselves through a cellular network, eventually affecting ST:STUDY_SUMMARY metabolism and perhaps fitness. We used mass-spectropscopy to broadly survey the ST:STUDY_SUMMARY metabolomes of both ancestors and all 12 evolved lines and combined this with ST:STUDY_SUMMARY genomic and expression data to suggest how mutations that alter specific ST:STUDY_SUMMARY reaction pathways, such as the biosynthesis of nicotinamide adenine ST:STUDY_SUMMARY dinucleotide, might increase fitness in the system. Our work brings the field ST:STUDY_SUMMARY closer to a complete genotype-phenotype map for the LTEE and a better ST:STUDY_SUMMARY understanding of how mutations might affect fitness through the metabolome. We ST:STUDY_SUMMARY used mass-spectroscopy to profile metabolic changes in the Long Term Evolution ST:STUDY_SUMMARY Experiment and link these change to upstream changes in gene expression and ST:STUDY_SUMMARY mutations. ST:INSTITUTE Rutgers University ST:DEPARTMENT Genetics ST:LABORATORY Shah ST:LAST_NAME Favate ST:FIRST_NAME John ST:ADDRESS 145 Bevier Road, Piscataway, NJ, 08854 ST:EMAIL john.favate@rutgers.edu ST:PHONE 7325894642 #SUBJECT SU:SUBJECT_TYPE Bacteria SU:SUBJECT_SPECIES Escherichia coli SU:TAXONOMY_ID 562 #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 - am1_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=am1_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - am1_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=am1_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - am2_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=am2_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - am2_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=am2_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - am3_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=am3_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - am3_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=am3_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - am4_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=am4_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - am4_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=am4_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - am5_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=am5_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - am5_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=am5_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - am6_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=am6_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - am6_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=am6_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap1_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap1_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap1_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap1_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap2_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap2_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap2_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap2_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap3_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap3_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap3_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap3_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap4_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap4_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap4_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap4_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap5_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap5_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap5_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap5_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap6_e_r1 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap6_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap6_e_r2 age:evolved | growth_phase:exponential RAW_FILE_NAME=ap6_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - rel606_e_r1 age:ancestral | growth_phase:exponential RAW_FILE_NAME=rel606_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - rel606_e_r2 age:ancestral | growth_phase:exponential RAW_FILE_NAME=rel606_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - rel607_e_r1 age:ancestral | growth_phase:exponential RAW_FILE_NAME=rel607_e_r1.mzXML SUBJECT_SAMPLE_FACTORS - rel607_e_r2 age:ancestral | growth_phase:exponential RAW_FILE_NAME=rel607_e_r2.mzXML SUBJECT_SAMPLE_FACTORS - am1_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=am1_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - am1_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=am1_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - am2_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=am2_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - am2_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=am2_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - am3_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=am3_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - am3_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=am3_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - am4_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=am4_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - am4_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=am4_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - am5_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=am5_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - am5_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=am5_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - am6_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=am6_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - am6_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=am6_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap1_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap1_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap1_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap1_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap2_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap2_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap2_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap2_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap3_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap3_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap3_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap3_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap4_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap4_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap4_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap4_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap5_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap5_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap5_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap5_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - ap6_s_r1 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap6_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - ap6_s_r2 age:evolved | growth_phase:stationary RAW_FILE_NAME=ap6_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - rel606_s_r1 age:ancestral | growth_phase:stationary RAW_FILE_NAME=rel606_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - rel606_s_r2 age:ancestral | growth_phase:stationary RAW_FILE_NAME=rel606_s_r2.mzXML SUBJECT_SAMPLE_FACTORS - rel607_s_r1 age:ancestral | growth_phase:stationary RAW_FILE_NAME=rel607_s_r1.mzXML SUBJECT_SAMPLE_FACTORS - rel607_s_r2 age:ancestral | growth_phase:stationary RAW_FILE_NAME=rel607_s_r2.mzXML #COLLECTION CO:COLLECTION_SUMMARY Bacterial cells were grown in DM25 medium and collected via vacuum filtration at CO:COLLECTION_SUMMARY 2hr and 24hr timepoints. CO:SAMPLE_TYPE Bacterial cells #TREATMENT TR:TREATMENT_SUMMARY No treatment was applied to the samples. The samples consist of the ancestral TR:TREATMENT_SUMMARY strains of the LTEE, REL606 and REL607, and clones from each of the evolved TR:TREATMENT_SUMMARY lines, designated Ara-1:6 and Ara+1:6 #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Samples were prepared using the 40:40:20 acetonitrile:methanol:water protocol. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE HILIC CH:INSTRUMENT_NAME Thermo Vanquish CH:COLUMN_NAME Waters Acquity BEH Amide (150 x 2.1mm, 1.7um) CH:SOLVENT_A 95% water/5% acetonitrile; 20 mM acetic acid; 40 mM ammonium hydroxide, pH 9.4 CH:SOLVENT_B 20% water/80% acetonitrile; 20 mM acetic acid; 40 mM ammonium hydroxide, pH 9.4 CH:FLOW_GRADIENT 0 min, 100% B; 3 min, 100% B; 3.2 min, 90% B; 6.2 min, 90% B; 6.5 min, 80% B; CH:FLOW_GRADIENT 10.5 min, 80% B; 10.7 min, 70% B; 13.5 min, 70% B; 13.7 min, 45% B; 16 min, 45% CH:FLOW_GRADIENT B; 16.5 min, 100% B; and 22 min, 100% B CH:FLOW_RATE 0.3mL/min CH:COLUMN_TEMPERATURE 25 #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Exactive Plus Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE NEGATIVE MS:MS_COMMENTS EL-MAVEN #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS peak area MS_METABOLITE_DATA_START Samples am1_e_r1 am1_e_r2 am1_s_r1 am1_s_r2 am2_e_r1 am2_e_r2 am2_s_r1 am2_s_r2 am3_e_r1 am3_e_r2 am3_s_r1 am3_s_r2 am4_e_r1 am4_e_r2 am4_s_r1 am4_s_r2 am5_e_r1 am5_e_r2 am5_s_r1 am5_s_r2 am6_e_r1 am6_e_r2 am6_s_r1 am6_s_r2 ap1_e_r1 ap1_e_r2 ap1_s_r1 ap1_s_r2 ap2_e_r1 ap2_e_r2 ap2_s_r1 ap2_s_r2 ap3_e_r1 ap3_e_r2 ap3_s_r1 ap3_s_r2 ap4_e_r1 ap4_e_r2 ap4_s_r1 ap4_s_r2 ap5_e_r1 ap5_e_r2 ap5_s_r1 ap5_s_r2 ap6_e_r1 ap6_e_r2 ap6_s_r1 ap6_s_r2 rel606_e_r1 rel606_e_r2 rel606_s_r1 rel606_s_r2 rel607_e_r1 rel607_e_r2 rel607_s_r1 rel607_s_r2 Factors age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:evolved | growth_phase:exponential age:evolved | growth_phase:exponential age:evolved | growth_phase:stationary age:evolved | growth_phase:stationary age:ancestral | growth_phase:exponential age:ancestral | growth_phase:exponential age:ancestral | growth_phase:stationary age:ancestral | growth_phase:stationary age:ancestral | growth_phase:exponential age:ancestral | growth_phase:exponential age:ancestral | growth_phase:stationary age:ancestral | growth_phase:stationary GTP 24172.3780350277 28765.5940379946 1574.95489603079 5296.76738345232 2458.73714280972 25306.4011488871 5150.38142500773 11884.4721119639 25415.2849317678 26907.5386494605 2008.14485393011 3683.69230101276 2817.54390015391 12314.2971472567 2924.17715421568 2036.0530778521 18650.0731811184 26566.7475542966 2292.04486842341 3370.12858061742 2097.91050297 2393.21473915176 6988.87805363734 6471.05080362603 26836.325894122 33780.8903842691 1444.21125594304 1869.81503110561 9554.83066811747 85323.8705032875 9424.3685204346 23052.0534447407 12743.6020274737 245284.510653388 3999.57150754673 4047.7005540066 22783.5455628649 18401.0979908043 2495.6786406038 56704.6002076527 7248.65384585408 21665.1997120128 2194.95881391688 2463.79426100538 16925.7861261398 18962.2488039449 4189.20038857934 6872.72112128749 2110.7377041249 12765.6345543165 1296.23261131334 1586.26527527868 7994.29494313115 10819.7367807943 2828.37665846729 3341.01226501516 CTP 19444.3044094357 41981.9151346668 1592.50294289951 7073.78920295699 10758.9445378568 46101.1909577379 29652.1368299906 49156.420002218 33734.009376079 45952.5832661768 1357.07414821254 2365.31393951037 1851.51210486307 12744.6281305312 6037.02019936145 9524.82801908356 14224.421425281 32416.2251626856 1638.87371129027 1764.35208915489 6368.85157150413 4104.28614279322 11118.4589939745 11395.0673717358 43959.7259436622 44925.3212702118 0 2403.8019569968 13796.205189916 69918.675305852 10371.5741013846 10513.1532886645 23087.920431583 216796.141540474 5756.25690254997 10964.3670641915 24236.1875964051 20734.6191836563 1440.20847569347 0 16973.7813585152 45899.7167144493 0 1765.6050539832 33918.071408508 35544.9493331903 14111.9554548108 17125.5685913175 8713.34106148573 25058.4231842725 979.48069952453 0 12996.541787963 18659.7682890596 0 1945.22043531956 UTP 76712.8406344822 121749.279414645 7977.20589688108 26817.6900611894 22191.4667120766 97589.1332667277 117291.525632876 122676.719425013 305274.448318672 341564.975044995 6204.72076301662 16787.2057110177 6643.5387754409 26307.4138494843 11455.9472542276 15992.867820511 65407.0719792305 127028.889028912 11132.7698903662 12490.3492282551 14395.0505144138 12737.0153510515 33085.6813750829 33583.3201255815 168049.867966568 145960.911592263 5326.27002331375 7177.71631229744 44661.1786661475 298904.705821021 74809.6905108682 57836.3744949684 126979.655533891 864589.055229977 16155.1266060215 17032.4471298889 93184.3404842513 68105.4877180358 5861.75554134415 36127.4870549473 52466.9872000495 136569.730152961 5874.86826960865 1659.53117462317 104268.634992391 98875.0174367688 8977.28809719795 14203.7786770003 18858.9734143081 59050.0805136226 3960.14835198222 2845.3499525427 38442.0595666169 42384.6791467434 4790.757614872 10081.2350148164 Fructose-1 6-bisphosphate 243646.343051776 231264.852357724 2798.28549606064 13797.0332671705 130316.670260325 106363.842453427 7054.94670239941 15239.1463026625 215210.803118086 341166.726630557 7045.25544686363 14870.8967040919 43390.212990498 68842.018624796 99257.519981787 10652.6409781486 172279.40431469 230241.580165242 2152.7951630887 17415.059107918 100540.931262519 53433.8266640013 9502.38572732244 23894.4583818248 127688.557997274 61688.3958265039 9355.83584559702 35420.8012969746 68000.8301361034 809235.698836332 10818.785377865 9073.16566561248 177160.800038103 1972416.63747038 24242.4348016761 9131.91046094464 277893.902656719 159429.691519516 25646.5232916056 120800.124204963 97050.2207839613 192281.343057682 22085.7229671478 12115.3836247879 206482.225827912 265546.990970375 10233.87640811 13638.5590142899 81486.1724192854 114131.338557672 22727.2905032255 18493.7090405254 69763.2153901565 116601.928481426 11468.6001910616 11650.2035067646 Thiamine pyrophosphate 86532.6530050229 125950.502488017 313259.586656414 365444.068877946 17497.1045026151 120881.170115025 149680.609361434 95580.2767048158 658292.352611301 682261.092556801 3809116.55926774 4048616.57247424 12774.5873877574 16310.6735809441 27462.4195463702 96255.5714214038 77518.675345411 163607.055644139 272117.477502023 300435.2226008 13148.2467199634 7789.20733027976 222360.58058882 205260.38937526 396889.644339324 376313.84494483 494153.041118591 1725544.49749252 52024.7561163578 114895.79848153 174784.236304086 378259.730137327 358877.185448469 390678.257740548 611201.642970994 570276.638691456 105696.520650863 55447.5812541724 254182.17779702 193132.162080755 67437.053882657 72273.0884922275 398146.275752026 229205.064915235 168113.090226565 110705.46302175 207841.941799506 219970.313364369 34632.3324513339 34592.3923267028 208539.16068799 375813.244324031 72824.2165292132 38641.0726120057 322358.887411451 251796.030921112 ATP 258223.495261234 394905.627713757 88310.4131950965 183505.657357493 114192.853010448 698834.975835865 442633.970586902 489386.31282371 703980.372578235 850314.38403906 78903.3490280971 141861.064565073 49758.0913197952 168896.39922921 74770.4526858263 189979.702079177 297735.374187998 609720.179875418 131057.006377717 143146.696218901 59096.7882817855 70014.4632160793 301693.266024728 344965.054771067 947939.693064413 907204.364569489 52439.4772775049 108368.773052429 169126.55552534 772754.527155924 386888.872040511 527963.091691226 353433.801772796 1458000.51566863 266275.010769398 605883.609654011 377247.763643385 320563.097228562 87199.1919097677 520362.826449739 246947.424072064 497486.749735625 77948.2465373262 63430.2584030965 387442.099121484 405036.437109805 307938.497406155 564694.919787784 126859.44798876 280582.852897033 39102.2940160557 69154.6650162303 266530.947410472 198266.683603 66625.9770102654 90329.1179951235 Glutathione disulfide 889758.98059332 1176254.42854198 259753.575143469 236391.354950811 554340.618914389 1997792.24839944 4570075.16502993 1768945.99635228 3398914.32597954 3121728.39111886 93493.1940087165 95425.3775286642 105710.75565957 288578.124093333 255953.845954084 290262.61066779 442471.588048181 1248501.9036463301 119541.14859671 60187.0193207043 182316.316553039 109055.977556866 123343.026237795 326232.448204005 2640004.63462408 864002.456358071 10162.8228548164 15417.7964970002 1103080.69228901 1953925.00719641 139698.529040579 80655.6036654711 1712259.15535717 2930070.74888796 24225.3470336078 214526.194690589 2440492.26020945 1408211.23653902 464640.337257026 1432786.93810121 1413557.32802749 1387236.49183097 107461.837507528 56592.1871800824 1433226.31742761 1180764.14348144 748664.69771131 837980.543300999 256917.114715607 263146.819363667 258781.995976699 315443.734096303 367492.084071782 305959.126182752 625929.669840887 257995.845940204 Lysine 213984.845605015 116517.92277147 2122150.36120335 2200951.29981767 204444.456999994 851395.156566327 1678858.79324 894373.891451382 889121.807328445 743536.218094641 38014188.0721162 68869380.6915873 124725.458082304 130745.711964133 125157.530020331 566700.687613035 243349.097544053 215649.713270488 8356290.74087821 7235824.89718089 19709.390914075 18475.2606490612 909919.682307608 1533492.99049105 275110.114301939 1509575.78078114 4652299.12033325 4159109.96261491 111753.957235948 173401.079472263 1671809.24379402 11844528.1103926 125317.411410705 147132.146839459 11330326.3732974 15061439.3667289 183462.305166954 134103.097898944 6503845.45018 4418562.88657689 335633.169700765 202441.146453809 6249742.45225737 4340253.29204589 231239.589147326 122958.777817654 3451258.2863419 2612108.87389065 218313.527805861 164430.750675227 2140932.18248196 3474755.60985053 464896.344981234 195644.491347394 3312000.406009 2194554.35067838 NADP+ 241586.200417221 245318.143465418 2098338.66106283 2381014.86912995 62223.504333403696 213924.078335177 382192.730220346 208927.726199615 682000.241213214 637811.911825317 1440829.8312179 2244199.24201447 28287.6683986236 49645.1924188224 95767.3451547811 450080.79777611 148564.211544587 431976.584356461 735290.798035841 884276.894982763 76779.8215782842 42180.8858662885 891444.158106018 1148169.6264616 583088.045046186 374978.43227953 990689.247960689 1954779.68257525 141988.183865465 233826.935735256 486043.68597373797 1000433.63180866 539453.582383694 630735.988843634 1540984.87706201 1366517.22465588 247960.300241342 184045.982296854 646599.344707262 547653.636358454 175445.229672857 209784.777342681 1122323.20688259 740523.886964841 233091.836613319 205811.58622418 388482.582101585 410591.804656422 53502.5293013849 55663.9754324412 295482.374549322 464861.132178998 105744.317336046 72699.7699663695 488035.175268215 374105.840019198 Pyridoxamine 5-phosphate 12249.3817403426 5523.97785486645 26567.7075801119 16202.0450249615 2102.56403898556 5393.9647830968 22656.0025012936 13863.5431320736 34020.9760975522 41805.6694297062 166254.246912579 256768.037096179 0 0 10386.9699090089 16531.6371626273 8026.40570517441 4526.48870990991 28439.0115308212 25531.4827542877 1552.67667890455 0 19161.7155734122 32920.5210887827 13422.6497023076 12734.2878284843 10540.1620089542 24091.670563217 2482.52106196382 7382.15526465039 17105.512841693 41584.1097811356 12902.6011741783 9698.24152446869 24136.5129368589 40623.8525008371 6331.15675284655 0 43338.0969440935 57609.9475047372 2547.86829756573 2818.64205722148 24709.3049436928 28010.9978224469 3005.18639617246 4368.08481267634 27583.330948306 37077.3204421262 6219.66630765003 1548.99625861911 25177.1107848145 23759.8268163875 3202.36798155236 2660.85493310897 41311.0640423493 16107.3303089525 Arginine 84977.3350791135 75485.2707783344 309513.927748985 300228.975037817 11403.6385370236 55403.4361796777 108632.916418333 59814.2830155001 276327.263774092 236646.389257569 6266617.9750483 5946219.6512385 19031.2317738499 20672.7530761952 80955.2430546091 348194.804858931 57639.5961073935 135560.237259537 1164083.28369438 984849.496522606 14216.4823130071 13224.0442417708 82872.7016451498 444153.835219218 188586.904294125 80685.7138828141 119112.281273065 424775.795141719 58996.9262301112 90715.7552263333 152863.159900303 1601522.03840443 132783.570156804 203134.445742249 1395538.68037976 3750775.68583901 58119.357797038 54766.8636356816 249478.744849203 91627.6660147561 59228.1513407902 68560.1450628733 722383.753282368 367593.855406756 74686.2815686713 61637.400980629 357307.398637968 229432.133628204 29332.0587550147 23656.1795047406 101331.25122853 224463.558422788 42300.5039329267 23421.3609103462 156524.656084563 137288.594767976 Ornithine 15547.4875280334 18181.9816236874 25426.0585389694 23002.7213984587 3084.61646689753 7452.90163269813 11457.6962728574 6606.0549836135 48908.4514118633 44604.1663199563 447485.603096938 434438.698322409 21774.4859143028 4193.66685039076 16914.0290793344 23140.9316008979 19284.9687057128 41057.9102108341 83074.7710464832 65762.2793739578 5469.04368317767 4806.3771726418 13215.0093854347 31804.1757676687 30025.7966093694 9495.24359206552 23969.5711546123 33612.6515153708 20200.233966845 18584.6160098362 9688.11313368403 112034.338037146 41597.4639999522 41343.1726624277 99086.6055635176 256703.767752026 19398.7915671111 7079.08563987774 23758.1443732994 16903.8682713329 10434.5040099626 6317.40815313639 48069.6474950401 29818.4425417333 12560.5185860773 6083.70732127451 27646.8224960677 19422.8147224765 8263.24428785683 5628.36690993165 7766.88070654893 15493.1961836154 20117.0575063243 5304.71352706135 15898.0665710122 12498.4171667163 NADPH 60869.5694508452 75255.4863218732 54259.89648011 55905.7961124502 10419.9561465757 87884.8872562811 35269.6088826403 59218.542851599 85789.6124983747 164617.974540332 8127.03567758206 24202.6851381088 4280.7808248031 12785.8033237966 29525.2471995999 18826.6038569239 50039.9544414962 65102.8505873643 9970.33682684466 32673.4020280355 11168.7229570398 11030.3064460018 42623.490905483 50649.441135777 119313.488814143 223606.281943602 4618.85187959745 33043.312814675 13678.2387807306 35839.2476462021 46861.6188636526 70200.0323135746 45116.6892659592 135643.42248699 44631.4360126364 72060.9430135711 39166.5695347234 45317.4093602415 19624.6352169246 29812.7048530048 35608.7579951599 71365.0798705345 4938.11224233149 18756.5922572788 26441.0720027011 41059.093027017 18017.2937661568 52293.920173167 3154.19655862425 7615.73878468844 0 9178.93085204033 22047.1973154968 6024.49558639793 4473.86672802134 13259.1776179021 Glucose-6-phosphate 949791.989817964 1120646.17491467 0 4804.57874584464 919221.753770677 3702881.66798003 178975.077681179 501382.739781089 2680179.19018611 4020075.38036114 35221.3299005025 73779.3413518587 191517.860553962 314728.083688705 616705.65069002 93374.2587004637 1474087.12968187 2775053.57781544 14496.7742724022 9674.13881638441 233807.71557039 185739.130168285 8793.90966576803 30231.3299549963 1537164.7391569 2031637.752223 3583.04980842814 6597.98876090328 795928.013183429 2170275.9263221 3255.57531355608 4074.97958297919 791561.484411082 2997456.92812098 3585.98873674992 4044.62836690416 952681.052814289 896279.449169532 4718.67104573469 12673.0707225322 951577.844504696 1669043.32417006 3856.48164105298 4066.98839835228 762933.900755645 964826.111454021 23540.8117697332 33378.3707462262 338521.022209181 443630.487741677 7816.48029133787 5840.17933744141 474141.788916224 492816.141502041 4145.04722832892 4356.87139301275 ADP 1102541.88479198 1507401.53383 1936430.06763659 2591883.11744606 699707.372985651 2620984.31137778 1223534.16956435 1161812.58355514 3112354.82264716 3779981.7521933 3292721.06389183 4140593.13913586 311447.486762955 687780.188660049 557101.256566014 1721885.2366812 1031552.34470897 2811999.83614362 2060010.58087683 2640426.36608975 373414.135766075 232252.779564757 2260733.97330676 2913115.9996718 2536754.01659216 1590926.69367814 1605640.26840494 3254612.46820786 1162813.36909678 2181789.61946311 2527788.18812903 4545787.33198199 2110513.23601934 4389213.30744318 4219584.88287853 4664443.90618386 1712571.72342039 1137894.62089136 1845953.95254892 3046206.06512696 1224918.27711704 1543577.23945438 2638784.00437466 1484054.84975974 2531784.29480552 2120343.21163242 2119968.53350201 2962688.46413507 708606.259540955 643453.003535523 1030561.95986746 1830482.50259158 1041207.69488324 844899.399524889 1779210.7694812 1569167.99709484 L-arginino-succinate 76589.0124827466 135870.994688978 0 0 0 8329.92574924629 0 0 338730.87554482 296877.346128606 14283.6617384581 13812.92658359 8780.20024972044 9773.9491941234 6347.9851446625 0 25886.4677940492 93400.4809043933 0 0 0 0 0 0 76386.6828080808 26397.6770791031 0 0 17349.3848278906 23206.9078995728 0 0 88635.223138804 85110.2419574482 0 3569.94411072944 46046.7992510142 24805.2371691573 0 0 25486.2906711885 42394.3776244323 0 0 75537.2277566332 51748.9610168327 0 0 4107.46503461507 7688.18987424138 0 0 11851.3445178941 15723.4448511097 0 0 Isocitrate 503144975.536103 544968002.145246 527968482.385329 669945452.722132 455699751.985304 1150349705.27043 532748010.67578 690059108.439816 404060549.848339 475592177.014947 8777276.83831431 13289181.4806369 491731250.497158 408039162.918028 794653653.468261 704147791.351296 541215457.703365 729750464.199043 568262361.754492 398956174.646217 377492504.531911 596889082.459585 653560558.07455 710407125.890265 743149020.48003 746804497.00842 552249877.116265 1008368491.72398 716801974.363626 1436558660.72894 396645865.922313 691497266.912509 474889664.690547 859660245.102351 596323813.852456 521203495.998846 709787091.275118 619581182.546986 568124083.110147 642345458.793521 709167643.123483 771402955.846295 612734688.979416 503525774.636771 699537277.385173 578282489.012467 606982639.519387 618255575.046183 596639988.469005 526348596.664149 429094638.412199 648491009.607043 814790826.515153 480177732.526239 644032029.636735 528170235.057795 GMP 265347.042225131 213846.512457263 679564.477837216 969503.515549279 53152.9205591326 200793.115751012 39106.7556894258 82585.2073745363 943627.154709301 671222.690209899 2395533.69636408 2915313.94364975 17962.0260006384 73023.9886484054 109429.044399149 176246.688236704 197084.932643804 361528.381994213 431838.9424468 546312.436569561 73321.1167099025 60106.302165632 133696.581623223 201745.109172916 260460.772321902 128559.287561577 936811.533375921 1539296.43240004 167000.245066694 356815.989101951 103034.918194446 370758.87959257 527747.633190239 811955.096498438 244177.465858763 149829.284161562 325996.844830382 134742.162352938 608267.426697382 156483.302980725 245638.848511036 227458.510795556 950915.799168408 726452.117098104 301945.886512129 287842.471796322 151277.436719212 169289.845746451 47698.7385662194 39420.9423487238 737726.176982112 1019775.04566375 80821.6366443817 71982.839064433 1034547.20662407 734835.241103312 CMP 310990.982609688 311814.826152287 828554.993420099 1131422.82025888 114047.234260663 450715.462345097 120001.020310974 257026.043581249 1759044.55858878 1446325.77616064 3556147.09172055 4447782.44487188 54439.6145818703 98201.5953656055 205212.845424515 278614.1514758 203059.530126999 414777.238707371 456086.177520226 568691.176062803 55684.1301444488 22125.9373527828 255995.024803232 244337.920412269 366757.772799945 287355.031023998 558976.568985196 1129002.32410133 236780.204947761 372870.326153533 220671.525811098 746585.223896634 680804.810862239 1333039.32071005 670605.900422807 488046.424966706 314828.024077054 188491.693303972 497308.812685608 107312.301695941 275746.861819617 315800.698996407 850833.742738492 555002.382058382 384901.174884282 296065.340994346 389515.618926714 340184.394616392 75257.8809218227 30024.5372277594 599864.940773532 867134.830658569 160467.002579947 88332.3956227089 934231.350918492 655965.248996905 Fructose-6-phosphate 289471.673392095 294083.824742562 0 0 563270.35990437 1868239.98143312 215832.233889307 590397.059604341 1269321.28814905 1148796.72515598 39317.6435206222 33448.8659438184 40510.8465877012 78195.7287947786 589633.370560635 67941.1350695832 515691.965671975 927451.110659148 9591.86588979068 7012.57587192791 73600.05991859 57894.8092266305 9185.21035677146 9247.20776086323 836008.007228204 866881.086415565 2174.92046951384 0 232111.363902724 556546.809577856 0 10941.0418637521 417118.474817366 892818.816619942 0 0 342255.659194347 307132.381357076 2798.75588999858 7285.19703735669 419504.827912919 529610.381302567 0 0 286713.900807742 263870.937745274 33825.3453323601 32465.3930257407 113894.192574614 131135.784799402 6501.81636886606 7153.62766003121 198506.313465614 166651.759956248 0 0 Aconitate 6337184.23375906 6632995.55413505 5770002.56713045 7975157.58538259 8788944.65086117 25895480.1390287 60704393.3070613 105760384.140975 12369272.5106092 12381360.0545115 891508.072522952 1597678.76032479 4362120.24437892 4429750.26571335 13346559.3426818 23463475.3168293 5639976.12997388 13936037.3195356 10006714.5026648 8094137.76614958 5584012.29708969 15916248.3598003 33037276.6931427 54470971.2805491 4652704.44257927 7592543.55543825 3315331.92538521 13953296.5394016 9435823.27738596 20278452.1300586 9300169.91514239 27059007.2856401 4290583.82263416 15246117.1907135 5872178.55761906 12389079.9498861 8604865.48272832 7131183.2039649 6426882.64457203 4784852.50014926 11628416.2800852 10957501.7109172 15981545.382249 19577374.0854572 10004017.1261481 10464495.1142445 50152205.7697767 48666853.8548593 1696105.85276662 1707020.81882199 4094754.92143495 8455396.55059918 3030699.81705845 2044697.23090002 5613892.89340851 6052865.77126052 UDP-D-Glucose 3028003.25369223 3458213.03975354 554931.385424993 466911.155001453 1903424.46156038 7857459.4212992 2599801.01980617 3094855.71571999 36128709.8511278 24690269.4608662 359723.335981273 422963.7835979 910365.54872139 1839913.43230096 1317668.21970365 93595.8134438232 5291563.17005518 9739417.53900014 130765.039432691 95429.1940860971 893429.675008224 725091.12828577 89277.6379430805 78505.3512679302 9797266.31991187 7026778.8517719 14362.8203019477 17403.6995140514 2609247.19717995 4711905.1085314 15316.3668063073 20027.2218330178 7954707.31374424 11941368.3647908 9639.87280246354 10511.0806359693 6339189.43731709 3944130.95901618 13312.8163015495 27193.3685509209 3946223.75355292 6191781.64745269 10008.5574315107 6876.71166706681 5935547.10809131 4611770.4846811 170227.090893773 222584.641450927 2086825.00259724 1543389.01799011 63358.7958332683 60437.8766301838 3324636.92918915 2363466.16486041 47616.8202588738 43327.0409701628 Cystathionine 0 7343.79602057373 0 0 0 0 0 0 22442.0163439976 12001.7979145691 0 0 0 0 0 0 0 8799.88244099851 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 UMP 807653.337371217 750898.411967379 4533883.29725813 5572837.74294593 162096.558091697 556314.8559756 406859.940246731 376316.018920241 4676430.14192267 3361318.95102188 10616421.399337 10785399.6970047 69671.9053479707 160871.135484704 296165.018770902 608119.643308487 689826.477494709 1246463.45596227 2421566.60143952 2604755.05819966 202562.634625023 133726.22354433 974169.183652137 947701.263124987 883306.443507257 381415.581210745 3078118.28872825 5927290.86733932 614586.457726779 930678.406459027 1549048.07824162 3025301.15531602 2013602.27541285 2995994.19584094 3235957.81795675 1522745.99994721 911199.609212836 651566.635763851 2332373.79082626 459819.337450453 806445.101185841 804116.413230486 4481338.6692448 3076456.89938523 1082058.06936536 1019314.83525682 289589.499639636 278564.907466231 153718.609735083 93808.1840889351 3271306.15490637 4739313.46036531 265269.028110954 180060.151024783 4797936.91258278 3736179.13264794 NAD+ 1557201.32204681 1548774.11839767 3547907.05733244 3264864.10215872 264362.09890263 1012515.93137033 3464236.15012105 2326783.60101783 6430352.85331169 5408855.94928711 28620754.6821248 41469054.5439091 196640.289606215 315787.857547508 560867.16702508 2709915.81560713 1286626.76175165 2856935.1931216 6823209.58038923 6712742.55111803 395039.469277621 215271.290421863 8078439.26330283 7377569.78165262 4333929.57061622 3036410.92525498 8308917.83188346 13236387.1827798 777297.34135102 1046437.34072029 3787670.76705088 5893570.75187972 3299858.59843338 3540582.91333047 8357929.38800288 6961051.55268281 1613481.93315184 1235862.42397705 5859009.37108895 4034374.51759354 1313341.94239491 1490887.12093341 7036902.70206082 5587127.67770919 1632517.68176201 1443559.05877707 6261756.30047568 6460296.37438658 270584.192533616 227072.711321665 2571871.60306983 3958444.81837724 551788.712205438 343280.506181604 4105089.07409019 3028364.02666214 ADP-D-Glucose 1788.9118488203 1962.5652831626 1050.1586193632 0 52447.1905972619 171126.773741366 0 0 69518.72829443 65026.6656356718 2765.59899252335 4890.73897457684 1265.07737975404 2827.24512113005 0 1642.1388298436 28150.3092046443 95175.7006366013 1842.0367058601 1318.32368763166 0 0 2150.02987932927 0 1672.2299437119 0 1197.82252287555 0 1212.59257191391 0 1586.66063002861 2532.09112029547 0 0 5673.05791792795 5406.01030990133 0 0 0 0 0 2031.92825079151 2088.57027035562 2105.11640464929 14200.1307599808 8673.57493977995 1396.94162921935 0 3162.13929776539 0 0 0 3016.00075914947 0 1170.75286870134 1714.58975033476 Dihydroxyacetone phosphate 48212.5805637632 60368.5378634798 0 0 12813.7401586516 31787.6831194439 1786.0783675006 4535.58261525709 108675.857936492 121737.273360092 0 2241.77579657349 12628.5045309086 18913.9953590716 38478.4051285312 1562.89573830409 41673.6433185168 86779.0938427205 0 0 16419.6161697345 20668.0716964246 0 1548.41430313362 49516.5197000839 26821.0426569898 0 0 34540.5266615033 24110.4634709732 0 0 57774.2070870427 105653.117564167 0 0 55121.2068261572 81129.058119923 0 0 66938.9878363159 115376.264374406 0 0 50821.058306107 48408.3372606286 0 2501.87028099818 14727.6554953778 24995.6047483365 0 0 32577.6113155697 36905.4919920564 0 0 UDP-N-acetyl-glucosamine 1767543.39765325 1559439.27588126 12171.7463197509 31942.5696408854 777480.080195572 3303309.02022067 1791191.51478684 1462360.80228616 27305825.9114958 15097282.3233387 3180551.10176312 3592306.33184109 443162.06667404 714277.419953571 1007348.15823666 462392.577908312 1464654.07611201 3681461.30776472 240403.180355977 227118.63933991 512892.095714267 319321.368655465 650508.553965512 392993.930791687 4210171.6589477 2434449.73832856 116982.63270605 192199.67440415 1748389.3097934 2178597.20657481 235372.180903038 113077.088890873 3335948.30983044 3928722.20586445 99259.23661542 131732.068931488 2494552.46985521 1820312.0703768 208214.695001586 51771.8474014433 2248815.32539837 2521152.33534905 111245.286386223 87185.1775189252 1260248.55361345 974408.549625595 112914.712365892 119251.123464427 564710.408990377 542341.036951316 79931.602640881 112155.206781415 1181283.96717335 670571.869137141 88657.887436259 84643.3520521656 5-Aminoimidazole-4-carboxamide ribonucleotide 70353.1348498801 77261.228629414 4962.6035750804 2538.4152401669 14416.9047083957 60681.6092321892 1737.58777085153 0 392719.905478669 314470.053387169 11429.8064071828 27741.559221596 8448.29665937262 8131.50992110274 37864.2152633122 6110.30629522786 93498.7413266869 212916.687814202 5645.80165790319 8630.23172001199 10806.6293502295 2459.94062434905 0 2508.77963814985 31427.3479753666 6741.56823485191 1892.06499450263 23040.6305380728 16964.9029941808 0 0 0 85347.4279829194 83225.8740190196 10608.3620913552 7836.89850753659 58600.0187087674 36320.5940055022 3042.79260845449 0 45823.0802368476 52343.5084524762 3230.03240336569 2303.41047855484 57408.1621387026 39700.2742294688 3142.64024651223 0 18740.6134454294 8190.6527720166 854.965781355058 2844.16589587367 11120.2325427763 6811.93118662897 3082.92569992321 1924.95615108965 Glycerol-3-phosphate 246000.5688111 287764.332701562 60748.1541380931 67142.6748033486 111099.438251152 622953.64290639 75073.8298505546 118933.696833233 1100681.82657362 755117.202271553 176079.541579488 226013.676474727 149543.664651658 68979.2594232004 180743.586840253 93518.4311390657 341209.12014267 878515.011983859 56447.7775048402 34657.0732855145 86575.6251168929 82538.2134157634 76576.419692421 63277.6636143032 291714.189173305 121991.792338662 67894.3573881934 118159.864122738 212059.765196582 256927.366355071 38074.6991958698 52159.5375530008 366029.058513404 445063.043856331 92376.9099862999 66537.2401715239 341073.757384037 277094.710779526 52675.9465602135 57494.7517301426 274500.195071029 230649.580943652 65212.7234459768 60366.1057758916 275857.004368814 213630.180573773 44396.4371303772 66135.6061651137 100732.202254225 101950.715887724 102312.336288201 72431.5366996913 151631.952461528 155847.987199 64863.4030177414 41717.4735127377 AMP 1227836.54636593 1111922.2190824 9549642.68356533 10093200.8332554 477293.727011137 1411561.78327869 572243.58230822 535113.550866379 6342790.69934636 4101896.06073854 58110658.2294422 61097066.6702448 257286.045345489 455815.976298164 631418.840144894 2348729.94434541 1075179.4992361 2164027.09925742 8088571.32054958 7748238.70040574 342356.825669398 199674.860676445 3173896.22866988 3449920.79298278 2003975.74766033 782606.914334646 10886415.5562094 22182392.7406732 1234273.25930488 1665040.42547181 3026866.9147043 8963038.76679426 2991996.11853955 3691260.55058565 12993985.7967753 8632608.40228872 1853393.44087681 1031688.16942498 6305367.3318685 2540470.89474486 1504123.19573576 1178846.5362652 14805436.6606835 9771528.45668232 2051542.63582408 1684128.11958205 2771413.50187567 2393436.5238625 481355.431741179 322562.750387875 8293344.33279388 13647362.0053525 822934.290743719 573392.135470397 13145400.4404222 8551750.19845883 Deoxyribose phosphate 38988.5984789892 55029.3597487703 1365.13014004965 3105.05547369833 6690.09359642659 46117.4077214937 2207.68388080498 4030.95401139198 151295.865181315 151490.16787893 3611.36461530915 6215.82392447197 49427.7611888057 106282.212275233 114538.924881768 8721.16631956039 69716.8157132579 206610.611351814 1299.07614930325 1190.5688044298 6941.51749066025 9988.92378344528 2062.58648986541 1620.7276899282 69108.3143668765 26489.2199045944 1108.4148676276 2191.21638927959 38648.3674858741 90600.3855924084 868.281813519603 2468.46435154646 369714.370640401 659812.297926065 2190.36605671313 1261.32537704574 46259.7073220119 34858.9573238751 3567.02103545713 2757.27692414768 65289.0786047993 95316.0476359335 2264.19885630351 1728.18473335035 64945.8132302055 54648.6013122618 1561.08407801416 3972.40129316064 13254.3431630731 10159.9753166702 972.189522899519 1618.23480534242 16103.0466903423 16260.6668105394 986.30736733086 1231.12314980457 N-carbomoyl-L-aspartate 8727817.65941796 5326735.7452345 188881.091285076 98190.7257411095 335980.269131297 3037862.80306471 120535.56910996 147185.729074687 19755722.290039 24959099.2653945 175561.718014148 179214.742974264 23775528.0364659 35180447.4519639 1426638.4624549 368739.366349136 2485152.38480252 5736409.99633092 138185.906414345 120780.99293823 2986864.45916688 740349.56610661 935369.419616972 374112.70819308 20115436.3139797 1665220.99577389 271197.772286648 287123.96862607 4248117.18437351 1290020.63254007 80095.8475687933 68317.3387643839 12108973.3121993 3788552.30088732 153461.261929621 149003.018096839 2645644.05405421 1020195.40377186 110116.581328942 51658.6030131998 2167372.95409985 3178179.53380859 143928.611008932 138540.777519098 4862616.00361928 3303546.80744287 169887.689659555 182743.647342486 242929.260415079 133538.619051672 109759.429603436 164871.05706971 539146.804033635 247155.03712143 179229.42663583 103851.540230396 Tartaric acid 80467.6437786868 94410.706790533 93572.6602841983 116177.80739261 61578.8278607157 230980.278306179 96056.8664794888 152312.114721366 167138.633239157 159177.879859495 80461.3495281679 151108.51010804 86315.7095762442 85177.9467181088 147167.711571647 200647.449563036 97582.8492541546 149900.562481007 109459.681185917 90335.6868367651 73180.2048368299 111594.31883596 149724.953028203 174206.60381098 146217.364769665 105148.323671338 111947.207855982 197799.264930519 110376.066798962 332970.737206862 70635.9693716043 160091.052794467 111881.435856098 221438.652921606 173197.938101329 127211.941238361 146095.301105158 119500.858617476 99905.7212073283 184196.827959002 101499.813900621 170977.146649831 112698.099680989 77805.4451032679 127913.063505427 123270.761013196 132459.205370641 140222.05669649 81182.5969826081 94259.0155403754 92836.5107380924 148432.057011165 122246.735843593 98121.4021349547 113641.13099155 96522.4464319191 Malate 62576434.9576032 83061378.5643684 1792193.6841244 2204122.27542327 3215641.57496071 16556975.3099625 2153698.20694592 3740869.30438091 302718114.467623 238595072.019095 4823788.72771193 6364850.58422949 7990033.04356059 9144386.19966639 12456499.6701779 3595453.78512494 43904330.9197965 98536866.1725437 2410921.41421776 1731892.88677594 5135356.86494661 5029127.36790343 3891118.04197856 3833146.70221472 49161493.9503894 10867277.9567069 2324396.31617895 3178614.68607656 20821033.2732498 25152015.0982472 1145872.69295771 2382073.97070437 85080178.487969 112337873.000831 2645481.68157952 2246534.57945468 65021088.7274351 41251770.8748588 2003636.9095898 1340733.29404299 56433539.2526682 56886672.1740805 2343722.98715035 1479152.37464418 109744132.145393 77401127.367295 10801444.9168535 9499299.47413543 8379763.28438178 4700092.08320596 2727364.04172099 2164387.37902194 13215313.2690178 6493418.19320312 2526894.46279763 1491834.98306444 Aminoadipic acid 108431.25048371 87615.186325915 43361.1442095663 32899.0474390518 115266.805530374 415686.001048227 3438413.17502285 967609.812043371 107681.786698067 126248.653761351 91278.6634043068 103613.843481942 39699.7925113457 36696.6968679769 7475.33425724076 30896.0853268473 8767.91984470271 5358.75815690717 44573.9013800686 38102.4320358995 16402.6595175494 11545.1264870768 64836.8997701983 68074.1425273671 96831.8602361114 655921.650282837 40655.8360182617 26897.6991368203 35871.0856426025 107217.423886532 151139.726828877 114974.507327146 4887.00765643067 19537.7061392327 35318.4503890027 43875.9013793807 170753.305125461 67910.5985363292 146336.612543292 55351.1378285019 83141.760843289 113171.48009845 56175.9451539481 43017.1420470246 4755.31829451199 9184.30476400967 183897.931059486 94931.3346075721 143131.711355876 105030.722517144 70566.8922122315 113588.56400807 221908.451140936 128874.882983788 112536.843705896 81262.5755291629 Galacturonic acid 44467.9029547603 41202.8691084721 39498.7872525474 50485.4284816725 24382.3379149052 72873.883623848 38261.2804790919 53469.7243269409 63468.1210055451 68969.8831195195 48831.311302589 79634.2974465683 39554.986083262 40537.2337610125 54650.1458136691 63238.0680467578 37771.1932098465 57959.4798909373 46075.2716507573 44495.5201798214 24706.0934434449 38358.5911803987 52117.5504849935 62985.6283683336 75336.2176484721 52494.2817534803 48488.6906128177 79933.242029174 43374.6134453388 87426.970006198 30581.254612303 68229.0587898689 39956.7250080707 72902.9180323206 55798.8498754316 58725.3938719334 57216.5926405049 42102.4136667081 44665.6097477945 71549.7558785874 49250.0917528119 53056.484989206 45826.3910490165 43676.1047664617 45580.6193430196 32167.3368989344 45302.1676612134 57544.5030168982 35324.5265451201 31564.8630407519 34731.821141528 58736.0165355732 51359.6645427502 44177.3197831091 58029.2578303881 40793.0701667683 NADH 44452.2720480416 88148.9657494873 39135.2578803946 78175.752186117 2528.94821720789 73719.4162655508 58022.6973259454 69269.8040095256 124639.11178381 281828.374231133 153864.539576367 795723.299621907 1301.17863860161 12683.2493273707 12838.9833371283 42417.4274573083 22995.7247783127 111246.700123416 32107.5985557855 156219.867748148 2907.4336387728 5334.18299320389 66065.1384345288 175813.423006952 172128.108452983 171244.334060014 46935.3081934929 273255.268497904 5603.41306083943 74863.2284202809 54292.5202736139 191379.55389028 98600.848725824 170640.820320851 43907.6180220467 254048.717377677 44772.745126738 61072.1529786413 72812.6007964923 89917.5158025785 24661.933246547 72329.6386919604 50261.7846718764 153324.177165018 28219.9940445569 65614.0739627153 66739.6528698781 233389.446398874 1616.37208211511 8242.25249720901 13844.0086336299 85082.2967397843 9160.1204460776 12719.4924512084 31545.0385404864 69318.896914509 Glutathione 2837195.7348692 6337546.47222762 1527236.52048399 894784.238318189 682252.419664746 9389336.645151 43991533.0540377 21176827.3172875 39943533.300274 35974514.7875336 2174425.88577099 5763234.21596362 49186.9576841599 237728.70988161 262859.22381495 1275061.61954543 527507.001484915 3221527.27742885 732851.351387207 1002839.67706952 107818.893853499 26927.1948055746 1088425.42514926 2718233.20125382 12856840.2091161 6273843.68125127 26617.22154469 58145.5514089587 545528.613031285 2183749.2287056 498780.716127054 1211494.92746934 16446389.5413016 15485760.0648665 105872.32447898 745432.782534737 7657858.77936115 5099490.30231708 3983853.52520584 9596483.81121462 1788296.58865712 6031675.60942413 850915.332023686 847599.266685352 3760885.05203633 4441818.61163804 5612884.16441253 8797725.12036764 145877.004850082 177102.57523735001 844932.037681198 1819938.46765774 152997.830923484 188596.540859606 794871.688039984 1043998.32427029 Aspartate 357366.259963145 510231.805797532 77442.3611617913 94210.0691584111 90705.4433969362 442976.499691325 741131.238037934 935898.331073691 10349316.238577 5138328.23425238 725773.08295717 1042189.91251899 223494.424139503 222977.27844717 616406.251427347 447006.029293276 625139.025917554 2675553.15139092 379007.14254745 300826.006814081 157273.141611464 137764.970491957 135273.237549838 245204.182386625 3569908.57609448 2700586.17274593 213420.736788323 129283.29561267 407114.747542566 670544.018348104 136229.654922925 284270.648755164 3176095.5170342 5154947.83765428 181198.875028017 222808.820075576 613182.033076762 740790.417333206 519543.951762974 368569.120739901 705399.065984538 896208.488330389 351047.298896186 221729.88751436 895439.802191121 917288.148395131 299158.87087225 198792.462442101 275448.503585275 205772.852300521 354507.545065965 625840.555342687 526126.812968237 266195.422633931 582560.860710148 407092.373760286 Glutamate 42289179.7426174 55510662.4811753 129980.824316338 160099.983255616 5881958.60926284 41157955.3102078 38240641.759541 25221197.449547 303288852.66415 205473826.395608 645217.214143779 660564.79717592 2950939.53674866 3470371.70866276 16651327.2951762 2455795.92724081 36967745.6268695 96606513.9590835 556287.699747685 417714.058614799 6790791.27477603 4188609.79352126 1390215.56270142 1599147.29226914 99554306.6067318 48006803.1011281 515741.489786744 561910.850541205 23201700.2849726 41910565.9701196 829211.950617201 1055707.14779761 92411108.9947174 160462115.247504 372549.232256077 790582.065162417 48742748.1962653 38896147.6526151 1247863.45517748 902375.943480613 33585664.9002598 43905220.8543588 418722.386236422 332830.185393415 72145460.2739519 65169341.6224015 4902838.15597482 4058127.40795091 18791027.6387731 16783539.1477364 980594.050143637 919277.340115431 37918123.4258368 20500592.2565398 879990.231902157 556476.795210466 Malonic acid 6393010.17628713 5702801.40011272 6910083.42847964 7211520.0187507 3390201.14207893 12013977.4666636 5546933.06049709 6599862.10222102 7083526.84497926 6066504.61437103 7417225.6241003 10502119.4369042 4636093.23563937 3946987.12412314 9725234.33199141 10151439.7099983 5589711.2179516 7780166.02388669 7022207.09469303 6618529.58386534 3115064.28597658 4721640.44076471 7843628.23786323 7935112.78635916 8421599.41803161 9018062.0500416 7877355.93097465 11608360.0366435 6741846.69387185 10976693.1117107 4281704.66193641 8033475.36926333 5179870.03659434 8649590.14535162 8353518.0884467 6710038.63983028 7787250.65227778 6730763.59945448 6230207.07020367 5493394.48624141 7306327.79433102 7110525.32801428 8100490.39999447 5997612.26269086 6947567.90497437 6001569.55062566 7164446.63657013 6318765.82105739 5735529.22341622 4483671.94482342 5545487.03817775 8508028.3843447 8281450.53681231 4886410.63910579 8755793.4393189 5617671.91391531 2-Hydroxyglutarate 10339987.6700923 9966357.41027046 11022718.0772463 9682161.7856816 3616029.16522049 16933289.0138379 8691663.07389396 8830866.94307547 45734378.3831923 140811637.906353 26579765.2037615 42758065.4742315 5732894.35513182 4583573.38370117 14226340.7493869 12765678.8790846 11394274.4527415 20050812.2163559 21995471.8472967 17289383.1121249 7236073.37984118 7353198.76473667 48981367.5145817 48180834.4034265 19706661.3410918 10897207.0005139 9218440.52345056 13273577.7841581 23067538.7212934 19408914.1440367 22869983.2393033 18559694.9725638 11434073.8982734 13016587.309525 10800620.7658205 9299774.5850856 15070458.4179771 10626769.2237971 16263160.0324623 6839163.7006477 13384808.1497018 10965959.2959279 13875950.0133526 9648382.45671521 13906310.1320644 11314367.5059774 12484689.6245397 9890646.47890369 8348043.30606013 6009997.63155754 16730721.0392022 22608756.9365446 13295506.4419552 6978626.19323561 30593549.7685038 17964900.4238581 N-Acetylaspartate 2646889.44556862 1992367.11713643 201130.158686342 195181.191074055 100742.288241647 478081.123333071 787814.0169327 257587.45994152199 10986006.1961519 3201266.52600377 1978310.57971079 3645247.47923702 1092169.94692983 1827148.33472356 6068034.63631586 371776.115324524 890614.743830229 2369880.083227 162951.364713668 130555.579657443 301401.168250084 183070.727661744 186567.799184705 184260.256240409 3993154.05215092 789398.800281788 141928.651269944 177566.414229453 285987.040405225 451506.62664066 132624.439696106 199207.033405944 2023185.97317932 758927.859705045 196130.087712372 166312.356165751 993843.789349928 360203.157741151 242796.744265652 103150.250528591 1845869.05791893 1585653.60639452 221719.276444235 130875.289686538 2338017.22067332 3101130.81787229 189492.076499447 163100.387288952 487883.779532097 191226.234198503 115272.61364096 138973.935892713 704011.794103981 208057.77932541 143613.298266633 97187.9496621493 FAD 17492.6618541551 44431.3117467854 63963.3914877012 90033.6393222321 4043.05196451704 39915.2828717564 39277.7055894768 36152.002318918 175045.500966728 197514.767946487 334701.509829805 546141.499622584 3463.01546261341 4051.12900416785 10410.7222505143 69206.1287536018 11000.9591366813 58651.180399207 78782.2564098934 105284.147760826 3038.29712536526 6823.42247363187 62801.0059306711 101747.706136991 52641.0137807149 73902.1095114751 71269.6658800161 188892.487672862 12166.5386611521 43239.8805298995 52302.0925507273 144230.396105839 49537.4106551677 83433.4719617538 53064.9691460025 102769.692305871 34897.5900186766 21224.2342717583 69093.0094887148 78745.9569023583 21371.6958062135 46193.3936008435 64267.529990936 81356.8593021947 28852.6937313325 26916.2749276923 67339.3992182261 103150.332068124 2895.48197572965 6941.09352522611 42942.861045622 82310.8731079687 7051.44731890453 5165.32634071711 52230.7753206938 70697.8940272497 Glucuronic acid 28919.6699885526 31279.8167313861 11335.5252798537 16640.3953554813 6168.17258182274 38516.1731675368 39740.6465565548 27806.3594391296 58287.7300946606 59379.0387618053 20252.0291429783 30622.7467250186 10280.2288286499 10589.5764084016 22709.8000061512 20110.667852815 22314.519388594 54252.0627433888 15323.3197032662 15374.2529797112 7309.18795196699 12697.7189582955 14923.7911056082 20182.2813448841 61169.6849728859 38966.2991229481 16775.9840438286 24442.9769701867 18665.7046993565 33129.6780406319 12558.9902514188 19267.3991667944 43562.9960661438 44526.1151607398 17642.2590475581 16569.6037814384 31890.4074262869 23530.4014678384 18089.1649676018 18334.8422755441 28141.938982918 32283.2542965799 17180.0412289243 16602.0848723026 42583.3308291248 34702.3216411635 19559.5302527657 24358.3543133547 14992.8245816118 12103.043329018 13712.4812305039 17552.4148770834 25299.20099924 12829.7781689172 21979.8671296043 12133.0868177239 Succinate 28580335.6606079 34650824.8530377 7749098.09267295 7637893.18060949 4836752.5818362 18047816.7196696 6111076.99689754 7607025.85845105 168860992.150194 156429656.287235 8604944.18520941 9832437.57815381 6943010.63894453 5748447.36637617 16310352.5637799 13099239.7740343 23948394.2232144 48516007.7138603 7973183.25799847 7636536.48849903 5469651.61055971 7062824.1903968 9919890.23713536 9117908.36324949 34061471.2774603 16447469.9850339 9150453.87222026 12611051.0926987 16275598.994973 27079201.8935739 4731190.46361571 8380714.55888734 33364534.2887548 51406899.5445807 10129922.8286113 7150125.8595291 32385733.3093805 19448449.2733221 7571596.48089984 6427218.46031712 21003659.9033555 23917788.4885288 9325720.34189246 6314407.22102411 40157491.224812 29030877.0423845 10932328.511212 10000423.1782505 7967905.1263324 5751627.33954213 6101774.43905775 9198119.77738004 12787940.7493305 7416964.6066626 9372423.37907123 5633558.00651271 N-acetyl-glutamate 1145367.60297857 2277963.6293534 67841.023382695 80818.6513652609 76496.7707841283 445219.688584562 202203.330460641 185467.052234535 70164564.5472248 49536201.7344416 412839.180170737 640570.05533668 441431.261379947 1051379.43611656 1094524.35243767 123520.74423962 1750431.93373205 5303677.8382915 105565.144541206 109095.081624684 349352.118775038 253195.733879706 101971.810991745 128622.59304698 1351894.38885456 403064.899719141 82191.3817921769 72149.2027076948 809917.873714173 1785921.81767339 44551.1025008698 102785.248112291 40325039.0679788 23506929.3762275 513940.590764534 306135.383625652 3448611.28164339 1824329.889785 118787.636388285 69193.4728546182 2271817.3529534 2555886.92979903 155449.584237957 94405.2818741512 3366769.12425955 3044300.48469578 179690.954738579 189331.576583599 431984.697251965 339654.895015004 121257.253595129 234505.790140289 615759.893146286 504104.635596248 202798.314537454 152398.278662946 Inositol 16437.6105930551 20035.0042358265 28757.6224573363 65626.3660457264 15507.1568536808 39134.2135482199 20762.3794356417 25503.101274375502 29719.7271613272 12659.5255009672 54140.903395545 52971.7331519926 72357.4071076921 15168.076736548 39128.334394624 24421.2520020796 24762.0609158066 27277.202402582 22532.4627339753 15390.6129948259 15370.8744464622 21316.0383590289 34775.3901887866 33973.6204986193 31666.8105992013 42870.176841928 24633.4765954415 43670.7508898407 24972.7246906066 104222.548294364 15437.6012563789 49088.9825085493 14629.7746188883 137228.623430937 38940.5605998899 35002.6278711183 25534.885145084 23413.5516298634 21407.4358853713 42091.7874722583 33002.9448493788 21663.7903223856 23983.1090029748 28558.6699143587 22875.4819190634 29722.6633449502 188451.63161831 176255.858745716 17614.9727299407 16592.2194207572 47462.3059152835 33245.5004187206 26880.7477932377 41153.6182024236 28616.2888121524 27822.3091282356 Glycerophosphocholine (+HAc) 30534.6850882591 37223.5250828516 59122.0764039064 178450.897403638 30537.0764506655 88044.4036884786 40911.9788986742 75922.6436898285 121395.829248965 26509.1579646639 160102.528795918 135636.874809751 183804.979531794 22530.3726095738 81984.4890087849 55646.8727585067 58830.5224545631 40697.5016266092 31817.497132596 26778.7634000307 29439.9301824955 42894.3239131998 72130.5393224226 75166.3747037056 59475.3178188526 110099.70078927 49342.9927615842 89855.6333310938 37719.1340581175 207401.399825367 23743.6456716396 121262.854728872 24672.3461643204 327599.608718475 92536.6796042292 94044.3495328383 40431.5027137616 45464.9385828313 39613.8111663984 94697.4846544797 61824.12381556 44536.8494174013 43557.9963817295 57396.4790882777 48902.8179583906 60872.4815200202 30367.5947907342 89865.9976212482 28101.5508604305 20884.3754962033 144515.519516747 69280.5353882204 48871.8912679972 128116.438246949 55286.5404867619 69844.4508745936 Acetyllysine 42497.011011623 81782.6294047947 84846.8055309116 84627.2346775938 807.506224733892 9466.39117009742 106169.049415251 23068.6227146397 968932.41261967 858120.486808816 344539.062540372 244752.244139962 1248.25902589909 4426.59911301019 7912.87855748286 11719.3012165786 51754.3110512606 228686.888119911 50359.8812450427 42841.0348729092 6053.07265271169 4232.67470238692 65707.641526893 69525.3375359239 392040.609914793 117445.41283463 28816.2302213823 123183.066371151 42167.678569318 59459.3613017143 35101.2151618863 67393.6815028803 140319.3897354 228326.780906143 52314.3641026224 44866.2473144521 75597.4509895567 18977.720242756 35077.4578102238 9235.87960976106 74344.8933546459 83241.4948876675 73078.3208040558 44778.9041925988 141434.398284954 99912.6308751292 36374.5501117621 28586.464120678 4089.992652964 6528.18998654509 19461.0316804022 39405.0249878712 16405.0767395912 5098.59451018906 31309.0139330906 20984.6770200964 N-acetyl-L-ornithine 86543.2910289696 73282.1873273218 21652.8658261459 18420.172678892 4349.93184648777 22334.77676037 23523.2735015804 18026.7478965299 267146.174351905 397032.162034047 331434.071571802 432025.869712539 166120.131241681 235302.149998436 74746.0350126261 6597.18280832849 62279.1023547532 282145.795526218 56510.8900678074 52769.233069133 7995.06569213219 2181.82568821509 14978.1088594899 18703.1291852973 125272.492913495 27028.9273439272 53352.9783256931 33351.2680318023 16630.0294939726 5438.77168137775 24249.2974500327 93606.0031581088 181576.490614836 104404.64895672 207139.404247707 95981.8606040867 49095.507452627 12346.5107100236 81309.9131456005 31419.1756690533 19896.7202971958 29074.3734547877 59035.3170499093 22505.2629448408 21305.7271889381 13564.9025123925 31949.7548306175 16102.511551576 20866.8584021632 18770.0767564445 19277.8634643206 33612.8565743226 45988.8256791352 28822.7802890512 42871.2294459293 19273.0037176161 Fumarate 4745530.46758888 5809232.93818972 97051.0298890203 121454.584125129 355379.294542666 1049970.43809872 103306.436291137 291467.737346173 23551214.1077338 19814974.5031163 191332.581384841 313201.599786801 650274.474899928 787236.564072362 1264741.49366795 235491.49683868 3385197.41595593 7375320.39144027 214058.306529938 186695.709666743 567342.158394129 673661.824517474 381390.992762386 353851.083741975 2518142.35313066 744206.389624798 113588.000505997 257334.310279156 1906573.65722358 3929887.86643232 74359.7708692116 187361.855736169 6373399.41111842 12887992.3879639 156452.016610232 174284.592128442 5087979.360543 3484522.4008437 158102.496895781 273139.866203763 4560213.25060533 4946291.24959113 148096.251427395 112996.312029898 8386578.93177164 6130778.864905 956407.672645477 1058467.61466963 607903.164218986 409056.853183928 139794.505248674 152526.813264721 956511.862166512 522192.746826589 146965.875387529 103101.057743718 a-ketoglutarate 979518.868404602 1584153.08847794 78983.599750028 91319.6515418581 145982.319062529 384431.210206327 105681.645594829 119694.627010152 4954803.29112005 3463416.45695979 115390.211645383 144101.517608918 85184.4003255045 102115.375267417 207618.086034488 129025.094678271 523556.191592786 851020.597002864 27670.603938026 23106.4364188458 134078.451099456 143936.346349638 59156.8469427454 82154.5303744936 598180.198199145 203685.413976661 19136.3992848627 40851.9588710938 433361.799236798 856995.03175746 21767.4017574904 31810.3446215195 1330052.17565502 3189248.44822918 30976.0593352457 16916.080206172 1540663.99841864 849597.772629114 27062.5874270577 40279.3014414392 985414.572012429 899660.245669623 31801.8928367622 20835.0004484854 4438640.63838221 3352403.51989848 137147.696826843 151371.423611242 188920.476049864 163114.428997112 41458.6847988259 32409.3607836332 293190.070167919 159088.462768394 29584.6438870345 21535.6443033815 Asparagine 147700.514200329 189205.33620889 340720.307619641 303429.638548487 60819.0199482571 176131.011336408 4550871.90573051 1087420.86951686 1431498.10994125 990350.944096646 1509240.60211382 2771933.63956112 43266.0782861262 35737.7441423727 103451.183276319 348905.911684551 129236.979466819 303967.132113613 744448.252888564 613906.709572739 25680.7618110481 19170.740120163 871867.708068123 829859.725959574 367473.147179119 187387.592637521 224489.721530449 218465.746259731 152511.455103915 197331.617127765 526134.853322115 1167818.41585706 397319.081875129 459385.49424943 1044225.35803887 1448331.66308822 207814.385339578 119330.598759922 775523.174537364 465467.161389545 131093.905305963 132661.55507905 394640.410001714 272505.832817387 361514.355715194 240685.108031253 765508.031483568 679033.417828493 76590.4193029519 53843.7422577083 313377.226842519 458311.43519704 125628.727807213 66009.3202060333 481436.288234401 288530.944352178 Serine 269621.904970671 268424.329791232 66789.7945447475 85709.2998653255 49649.5001161288 210110.904841946 117227.153519777 83644.372551894 3144584.13657944 2364871.88653662 165950.907599569 105004.845609448 198662.329382957 55050.1109731598 307811.206534404 78868.9522800168 293571.479476286 520169.446860226 92328.8667450503 83042.9705266011 50495.0177612959 45481.4438034914 108799.958601479 84377.6683611824 347600.208027917 154864.302374598 214915.22267066 123099.911041919 297376.767070813 316244.219019885 62047.6029641821 118879.480344906 475574.286945597 427700.512243064 85651.6570401706 68956.6905180518 432899.63281991 157088.94028987 90527.4101821407 77705.1641985443 392556.327774702 304061.88031881 106308.7498633 56535.9366082453 528681.792669733 352506.422847156 97750.6173376233 78842.0427678196 111440.428851618 65982.5247406505 111732.069490864 122917.561172729 178049.57702543 81495.9346508619 147722.829534556 85471.5025622222 S-adenosyl-L-homocysteine 6063.52611496838 7223.13042219642 7519.77147754824 2768.71177816307 2763.77674449791 2715.9512948794 11398.3762707753 1939.03731544082 54796.3276911984 46128.3088469158 170400.632592781 302510.416053621 1645.4531517611 1204.10364313576 869.643969448188 14210.6524851004 4445.66322626956 11182.0484934122 25978.6948890337 25247.042955879 1289.23310636262 1856.63871416671 14331.2594779508 22398.5836841557 11807.0351478272 4255.51913898538 6185.73065844063 6180.22339189519 4194.06893952174 6195.54566647316 9660.04644567308 22253.4652594648 13972.6422515543 8802.66117505188 6221.1029775517 22121.0548323584 6930.68769843472 5341.06632027883 18896.557005478 40036.6577451604 6582.86364513412 8095.4467114349 12236.6979646025 12104.2680122148 8615.78796357232 6542.16488171339 20071.7577764026 21717.9372051497 2977.81183806951 1381.89985345199 5076.85080331919 11209.08352832 3138.79485104725 1674.66170946536 6262.72684929618 7500.27923081532 Glutamine 4754822.43208216 6416930.52797607 18325.1228534682 22365.0209584264 697701.24839671 3760354.95536234 2525139.56146696 1519872.4925765 15418008.2876378 17432522.5631855 61634.4912746475 93710.7535034731 295634.3727416 165091.277728373 605231.107414922 43088.3456926658 1236545.41267672 3768761.24893143 9899.2340379275 16232.838659486 470766.228326446 293403.515881598 61848.3024791127 85942.9022384028 6188708.26969101 4726713.1017041 42374.4732510782 66940.0845554283 514370.422565765 415463.432274226 35849.0349109586 213025.484640658 2817041.01773437 3006400.58642939 25163.2486095516 93632.2375772398 4069458.0945998 3076630.32803864 35334.41378561 27691.2599799101 705644.75387196 762554.074385097 18790.5638819448 17279.4551230189 3773817.83426592 3609042.73098138 55787.220544675 85963.0927247819 1005865.37680647 777368.564923953 52093.2349845594 59269.8201704057 1610864.28457201 904718.562068002 117435.304280335 46735.8254492849 Histidine 12123.5346935515 6813.99524908756 146666.699555686 135414.7617702 8314.51776505359 28641.913566611 24797.1145460211 16051.261663916 14283.3276524769 19355.2186082104 1403568.35635206 1093672.04044977 20631.1348827599 14957.7110791329 35862.5205039757 82862.2227353705 13305.6617447087 16485.4922933861 246205.362150329 180687.12936091 7136.53155127273 10587.1624828267 301111.773136025 400994.312150926 23075.1717673004 16512.137098045 94627.3287698119 77527.3771432528 22149.5516890316 43928.9802352351 430218.130700584 815852.294761812 16401.9260743791 25947.144336904 176584.417517542 239794.055840401 18636.870081822 10969.9181407132 301349.239626244 190819.897214476 16133.6026967508 11385.8351745889 83925.3808287874 76224.2900456467 16831.1718590684 8681.82687579745 191407.667101541 127667.110558512 12265.8750325655 14810.8129244886 62203.3477078001 99745.2426832226 23827.2764311033 8292.67732447331 98717.4755604015 63928.6174227883 Methionine sulfoxide 13066.9876479642 7344.5052585543 12067.015259785 13406.5730646337 3827.66906554573 8408.8966784739 2716.89154877347 4030.43883235067 27446.6979981113 12917.5408809563 64525.6564354622 96594.9810175512 4867.98622388353 3326.11281418954 5629.0831595392 8727.15607109541 8976.55428396077 14508.7806857907 13372.6994044593 21495.7476062222 4130.17154760337 3583.34052079392 14201.4695267647 11866.3065541767 7324.03959162519 9314.55674234986 13381.4068187628 22487.6171741884 8179.77770361517 16580.1407985893 5540.1415255582 14176.1249832521 10998.2985534996 11806.306837925 17554.5904865908 19478.4096449976 7562.85157976036 6068.60754500854 7201.86580363436 6216.4771157639 8454.14037221547 8986.54265760126 9563.39837625117 8711.74846873002 10036.9933160296 8267.87975811962 7356.76096127266 6312.69377912466 3835.04388220878 6736.42871358181 5960.23560265582 9428.36525955215 6434.39363599624 4053.17832313575 10840.0540528609 6983.62546504509 Acetyl-arginine 0 7482.32230712029 780.976533474816 1128.65704945123 0 1891.42642763541 873.257792129586 0 1171.28437034422 11197.3031379955 0 0 0 751.816495111891 1306.4453159644 1161.64844889427 0 4654.06826138924 4724.15720517855 2536.26853846186 0 0 0 1284.57340731578 1470.60339024062 0 687.727935566282 1354.08280001281 5547.37944770322 5399.21802810518 1115.50539919433 6384.07072575542 9920.49474142989 9848.38991407068 5667.97010086372 8768.90871491658 5605.78852252131 8005.64596347377 0 0 0 1340.42931528371 1242.66546037778 0 7789.74204334676 9369.29816600197 1148.44430156309 0 0 1123.05533035567 0 912.186961673816 2356.0021786136 0 0 721.820843970847 Glycine 92970.3036687321 89246.7537032428 42617.6607056663 41690.0189848608 21900.4745832117 62390.7484688928 26507.3226147434 32984.2093254565 870193.429256174 675594.666470958 242428.511107763 254369.120596141 49375.4838044126 21001.3964946572 83234.2369754884 34129.1307918793 121313.885073392 264720.668056084 45699.9695453168 48255.9840445452 24994.9008181937 21186.9151817967 45501.0226592401 116226.060201498 56041.84032467 38317.5261860123 50562.0631172656 45408.3603752031 71607.8010077444 104822.435745238 27528.7765940141 55291.6967168768 142037.49498142 181503.135534006 49586.250241539 41342.3591398182 122516.92322522 64738.0176283785 91895.668334622 166298.64836693901 120109.743130135 96560.9627409052 70040.5444908629 41339.7413482995 124484.479740744 87166.1703804722 32282.4199220581 36478.0480759477 34185.286149983804 24522.7376765476 108381.969669061 147101.331757353 49871.3380649946 33935.3110599804 147011.571150569 92119.7465807249 Threonine 332368.192675292 366385.931673172 50502.3767204374 52434.6957905367 68683.9134240919 273391.23364364 205385.169317231 174561.270040516 5698897.76573665 4154600.94882555 609174.0044742 953411.379051519 97407.2413447195 61551.3215096436 283359.989527933 186313.456642834 350047.346851884 1156806.97307208 88845.366745076 85876.3697459089 44403.0076109738 30509.5068616746 109907.289166871 102010.04836563 916581.674545917 327399.922579463 92283.7816875513 94407.8644537086 125367.020394934 167135.665308768 66409.1141199767 134089.225364935 1250412.89855069 1126072.70167878 80263.7702551833 130669.817695955 304305.569677995 282357.641212555 79027.605734475 60030.1464291895 178705.166155222 165512.082464349 60300.5647680911 40454.0758545431 434403.27841212 344079.635807206 220018.514980201 181630.409569799 100876.98046416 68062.6703836118 49530.3864008682 59306.4744464208 180044.663782345 77030.6657676402 62880.5760950722 38550.0804055116 4-Guanidinobutanoic acid 0 0 9052.56329927299 11208.5155473268 0 0 0 0 2460.12490325205 0 128328.907598805 114574.253807643 1582.11338473701 0 0 0 1522.70829677947 0 11224.7426724362 10093.8875946838 0 0 2366.38727908952 6010.09743764589 0 0 11113.9909321832 17832.1357168481 0 0 9114.93278356476 18400.2027164333 0 0 12146.666621253 38566.9650164654 0 0 6964.7288201984 0 0 0 7162.65243979778 6009.7515299914 0 0 2376.90581429057 2327.8691423227 0 0 6417.88498339861 6101.54697694804 0 0 4542.23225302305 6179.08812589263 Alanine 872126.556846452 981190.310905171 461901.449789943 539485.643374882 150765.601862594 558487.135218854 489230.87970957 423939.351958678 7130554.19271623 4916099.48165148 7840818.23609318 8442360.21724785 382864.230093581 191130.383306294 1278287.79112985 505301.57238268 676911.755751767 1296541.40100568 1226606.26509584 1169752.30393134 133070.849145165 188716.897115122 996042.859313711 904467.949566279 1158951.72534705 712445.906741895 1000706.38709769 1036945.23394241 488217.921664332 533664.703575594 269570.768168578 597565.020820563 1550530.15607271 1422469.57699963 914639.194572927 1000792.26690114 894931.405932445 643200.74302642 1668474.34961314 776770.770310647 627537.677650791 759709.50205323 1046113.1345927 845135.116955319 1029594.10810107 893236.755608128 631728.193414253 688138.560710913 442409.386151072 277047.288365934 1040014.8799753 1437852.39998555 638245.663262463 420939.446603404 1306816.7799956 887127.310780773 Threonic acid 198121.074871583 173743.801195311 203344.361334082 265748.83800412 171325.642577731 219918.386366726 137149.085683321 205811.69796691 392278.50835723 423291.602379233 416168.01893791 564313.97553262 248536.511497547 188653.097790479 211562.504987277 206088.610325107 134761.463655062 198894.540031096 186705.531291719 192302.912757423 174518.299719781 235737.670020179 180917.05741154 205530.559174917 175277.408837142 256410.151994714 237476.297986439 251170.901984177 179801.385742341 370062.074513739 194517.996867657 224182.129364399 118547.103183653 256846.162609686 231370.305312692 200377.90427293 230801.926450237 218832.725069251 180879.118470029 217665.055266519 148840.564483864 253266.667442921 150723.406256087 184982.239176692 169885.51507894 199359.852558871 135529.27048292 182735.152748543 186761.531016977 199717.106437197 226856.780710121 174749.724228566 193932.078856893 347074.37665499 212393.086180383 216539.26377312 Uric acid 7241.40384525721 0 0 0 6370.79620416852 440343.556694243 0 0 0 0 0 0 0 0 0 0 0 0 9300.75078121945 10676.0710349269 0 0 0 0 0 0 0 0 0 227521.448235453 0 0 0 0 0 12010.8990916641 0 35675.1576793185 0 0 0 10651.5057613831 0 0 0 0 0 0 0 32237.837653374 0 0 21109.1528080256 0 0 46701.471704903 Glucose 1015721.33735203 1596470.47638197 23581.6650583813 56415.3523732351 1425434.11835639 6165904.94340189 33170.605820646 22198.9468284159 434287.522378668 1320503.49149202 74692.4037927691 62078.4215603708 2081803.33556408 1612157.48813131 366948.415831163 53034.9557191974 1279479.1004067 2093865.89354922 34939.7162551826 13588.3350236663 1053315.31336796 3265613.02377423 29888.2993345094 292805.064937408 1328440.80855041 4130399.09276024 27546.8944018056 63530.968357575 1582785.27367906 8512814.51686805 15518.1701048793 45391.8222613805 629791.296145491 2696744.78356383 42975.8583129175 58006.3139968749 1780806.87445198 2522659.33082558 9258.51686037623 67909.268695961 1713669.66530636 3219459.37110481 15751.0377873155 12667.3213450337 1285647.92363263 1653447.30144083 15901.6856518441 32755.9399933112 1871848.51879619 2558804.7310344498 49520.63219247 64955.577925916 2613000.12431302 2238384.21835017 32606.1561222909 34336.7183603702 Thiamine 17793460.1344775 20872110.904899 20656621.4580392 31137567.7213866 15844623.9465951 42147350.1603729 19977867.9764288 25655652.228247 21930489.813535 26561905.620167 15567138.7816195 21643536.8703353 15689006.6116866 13397046.2125365 30503535.3992689 31700916.3491885 19360166.4162728 30014333.17243 23786108.7414488 19741341.0249365 12727409.4084249 18770225.4534608 24533859.1663066 29514882.9459278 28470671.9342589 28772979.2319071 24066164.0407729 41938579.225758 25558549.7769114 44486943.7007683 14193748.4376818 26194238.0144683 18250117.9420362 30587003.5484005 23864385.6695789 21922519.8910312 25834201.0217744 24330616.3621094 22507187.3949515 15118981.5614056 27553354.3421713 27487091.4171675 24246677.3897798 22467539.0344436 24943267.3176411 22363396.7599574 23739546.6931504 22951006.0909387 19766673.9189529 18216986.9151813 18239227.8218806 28272721.8716579 28299034.7610311 15445077.2599296 24332355.8269212 21095864.0803673 Proline 171477.910947696 188003.463256864 1379660.01130476 1925694.50285233 31661.8557593467 156428.127857292 66639.9549715281 67451.200527889 1023342.60571842 659272.504189352 20565543.577574 42982422.9018475 55897.7377636051 37686.7919025956 183865.300974663 261646.936058164 122539.141837278 252291.429889459 1305142.5026191 1262133.83008302 27279.7782989367 22451.2825521687 727394.97196442 965821.119669937 230755.085131099 120364.811090799 121317.227248446 147173.237863046 107744.341256891 205028.180629013 1863269.35594402 4959647.10030509 345409.891494171 549991.065585686 2054131.76836452 4434400.23774787 145527.440384003 92888.637875682 949817.797321201 566755.533419676 94141.7442562394 105292.031701742 252099.732957013 172328.906018268 114326.537445476 88559.4072529734 336153.537360075 314667.494489908 60001.6961593714 50347.9137444938 68963.0969819832 101783.951455954 92310.4507187867 60732.2825689073 121551.204671856 106945.951744244 Sorbitol 873639.563390985 1120871.70394325 659531.489553293 1139016.93603356 638791.13365904 5581320.55382077 456844.189086231 1887720.11647746 4459539.11964705 3016375.05029795 519297.571456053 1039413.87225435 2056587.04377708 820665.622414242 1452495.18157784 1462488.25609624 1016346.27149898 1784428.01933181 809573.279481226 1148193.77530669 931609.457288756 944652.235360487 512088.17382355 755320.775278194 886052.84475024 2224009.75689875 1207958.64621126 2039589.80731136 978472.415485835 10092019.3572741 977505.476544393 3206125.42702171 1130863.6002088 4671541.1995734 863804.351456433 1240545.67672092 823299.481901097 1749801.511992 1056041.35696582 3000062.3678514 750883.175350533 1895629.82190556 1191341.54921289 1278300.00935986 1280852.23838425 1216845.48866046 708676.615250983 2064484.29721531 1212477.31761757 973701.818481089 1040773.65946998 1037919.36532161 1023832.25222605 1906958.06269092 1533259.63466888 1032261.82407718 Pipecolic acid 4519.66930098987 6170.4396249128 32453.2552795389 35317.094849937 5200.06246786079 12259.1735888624 9787.02681459653 11197.5023261632 21655.7826041471 19592.5821761717 693562.678358668 1348679.7025207 5269.86861640487 5278.39984714906 10455.7541173926 13324.6427125435 2728.82232885822 6784.85943842945 51967.3392278644 48121.1671600959 2631.45470409694 5187.4855016963 19936.9326795316 18277.8958506949 7567.01317319016 15546.8594682327 60180.0563549465 102085.878133204 4434.01216732879 18146.4077256237 37534.3101263466 88786.653949745 3141.33483166715 16305.4485377895 207990.76225809 206109.996342748 6203.3841206433 4192.1770017438 33116.9108815924 30004.5165343347 6750.70031378141 3940.42889316729 25100.8162497837 25580.0796428807 7526.20928769046 7846.25083818551 115663.160681512 98718.872300053 5270.73098230868 8663.92164494423 13164.498088125 23639.3619204951 3201.07806155036 6188.90413682229 20153.8717792112 15436.2154307817 Pyridoxamine 14477.6595081227 11786.7914021267 4929.8159693635 10469.2853864475 5960.77299398182 16551.8249734568 4282.07905277499 6141.29909096686 17437.373751576 23182.5760757328 4840.99765024935 5532.22763527072 5601.41898118246 3993.64914326785 50060.7654047761 22893.7882866426 27272.791747217 25480.4031907562 5163.46630186431 5722.88005243366 5815.126860863 4962.15001743757 4579.47548375921 8361.16122339807 7928.99578517755 10463.5597034827 7364.302773069 9972.86627509816 15681.4339819478 37233.1530330633 4377.35007658416 5553.95232701041 11503.0355115181 34576.1576001287 6489.23701789282 9988.45951282012 11691.5233669383 10919.6940572285 6489.56517555984 10031.501412022 15430.6827874657 7267.67351869687 7034.09389060333 3951.51860793219 8704.32693658402 8763.44602477053 3644.60195659941 7076.35777458086 12591.297113029501 6702.63512306646 3917.47086566268 6621.56407369501 13845.4559694423 7428.94868484665 9950.4925934829 4995.52318954871 Valine 2960395.11726965 3796355.43708713 240623.506398152 248017.647282666 844959.214698129 3373612.7284708 639177.703896974 562903.810960467 4005634.20024263 3001116.78260266 1970193.17085156 2317538.9189245 189032.22827201 159799.33004145 3755830.96111073 1687883.77347948 454334.442588068 556202.424081457 465906.037437256 422670.081304394 119906.399402002 132445.445946094 523825.602790101 471028.905419438 476768.840391326 454581.270156136 289550.887944555 365251.613562669 457259.716949374 715993.82211603 527744.324405516 1054415.11408314 1203366.91817272 2064345.97756583 961535.347690052 1770479.59042345 2446703.23684708 632262.491159617 552560.821219106 475058.545204546 381537.15635152097 322192.368263176 290712.443908638 201001.345236075 734818.157069571 320702.051104831 661589.743984126 622845.395281833 863438.645216599 604077.147504057 175578.281987956 270388.771641195 1604148.83519574 731461.592126103 268487.728115207 189821.514014524 Tyrosine 128269.418023546 127403.687863987 909049.467622829 885811.125314666 43596.0120488654 151150.587325856 206029.599516434 200433.604426961 1088181.71399549 844550.870694796 4968296.5670641 6811405.52349378 78009.3453732704 38897.7974611975 151150.520163227 372159.866813954 95077.7652238067 214370.029279416 2150538.43535971 2067209.20695366 29804.8038428986 32881.3272748307 1002981.04582038 974492.903925026 229564.133829067 140156.360823726 719742.848806007 466771.566474693 89463.8428523042 132592.333925918 1629060.96958817 1953230.98252757 282757.39470295 332572.525641662 549302.06462652 815402.34537434 105757.439434183 53221.244820436 1871155.60856324 1176080.56008835 77537.563614407 65087.9453378078 710905.333638536 578883.953828101 78645.4747662017 42559.8251193728 1213042.37984909 977129.626600092 50725.8759654771 38591.6036508261 430294.52053472 584997.931116443 74425.3113791762 46520.9588765146 642459.100077658 413942.345459864 Glycerate 166142.204265243 166258.745727192 176833.101150702 259880.846712369 137928.989649003 315010.380257168 162712.082532781 219628.284675947 216133.489114084 204045.546370321 200137.732667805 303562.851498234 155107.465109612 133816.227452361 226563.827421458 223429.93197051 164589.39097025 216904.575647566 183927.675574519 194201.650068359 109706.399517231 170410.609824731 221068.64312624 231743.067537459 207627.115064852 267354.465740679 195754.689366129 343424.41562737 183583.055223754 525460.005550553 163293.686083689 234437.38908519901 154223.975919956 440416.691207143 234285.056925245 197664.115114272 205201.914381701 203833.552476979 204849.536172584 261820.353830202 188177.30100796 241591.05926648 223015.030823061 213669.262231912 190256.651093786 186873.983202474 190121.846312443 205613.058611307 164745.351683252 154303.797067938 149321.99420836 235354.151299429 214216.532323152 163368.578473211 222555.04447247 186508.147663825 Acetyl glycine 40210.0921074594 34201.2025703307 31286.2570940791 26801.0245616037 16021.2172425065 57362.3270361164 36126.8642944201 24171.2024591248 269213.826903153 139255.159685668 191731.377455563 166228.803716826 26909.2216665357 13019.0604982711 65372.4428968714 42144.662540439 49107.2492198383 57409.661854937 40999.6382057907 41618.9633269735 14298.5860042049 18128.5098218698 58594.5588225814 48042.4071523373 60978.4095264015 51565.8085888205 62100.8274556073 45009.1613665144 35693.0148390897 15483.6095932664 33397.4628774074 60791.4535999882 69772.8476767182 20760.4156550096 69251.7375147222 36086.742688917 63751.9037388867 34111.3028662249 54743.1696389269 10563.3981474244 54298.3213618561 35422.0772486721 48572.503531902 26903.7406225553 64427.4556403785 37018.2950003147 57983.6368566144 35240.7467587268 27151.3904127993 16198.4648784539 37469.0704520534 44413.852397626 41314.8372569264 17181.307992924 59999.8214913486 21325.1773354592 Homocysteine 717.010578987151 853.299783062984 0 0 0 3539.0765410191502 0 0 30812.4779995783 30057.9276023847 1107.73009949009 3450.0291919245 0 0 0 0 1007.51581009379 1449.29661589403 0 0 0 0 0 729.085409545738 2874.05851805883 1247.84499619347 0 0 0 0 0 1163.19673149868 5963.47416391817 3906.00472062413 0 0 3846.98444468977 753.983421609216 0 0 0 982.182428003475 0 0 2232.80557347424 1711.18146666875 0 0 0 0 0 0 0 0 0 0 Methionine 154532.843317441 149323.639070322 162816.68716213 197868.43002038 12443.5546349619 26813.9545728947 7788.10711933171 12351.6643721601 898959.43590708 517371.434699399 827453.885971029 1742401.97171585 15665.1847581166 6963.15642783472 25132.4168622207 99065.5246208395 111030.686933308 224439.639961228 224707.642195238 200508.552444002 16645.4452822193 8992.52232398583 220878.903027064 188022.70870938 163649.929998961 89693.3954059447 190200.987818059 287570.14008113 67588.6807895506 106742.780047261 78354.9605884543 296085.671613011 300934.446143486 411010.428496546 412373.177762611 473724.139485922 76528.6905659898 43313.2624696959 165859.228221424 96570.9755012255 116300.252341231 109446.88737784 162912.163873798 102515.864965916 131525.458667049 100101.785253344 56742.7492017195 46116.7364039146 16211.4019228898 27617.6743903882 89269.9578763374 132856.985882923 22894.3811164856 10945.4703642441 131015.538822508 90637.2055124351 Pantothenate 30881.7875031792 42793.8888314961 334407.017433007 315568.123416499 7968.32599095229 38350.7621772272 154065.75309047 405083.970772882 146604.712199345 180232.366949777 5868829.88420144 12284203.8512224 9907.44740640265 12871.5603618985 18601.5098569268 68391.4124391133 41144.3300189176 123308.315696205 149112.335960163 191934.756301195 10019.5224899327 14045.7988340294 445774.089220676 191223.78632965 44191.8413861975 58376.5879516549 135495.533166157 152215.674326467 14614.6823209363 31633.9147787739 239684.971578608 180989.551050484 40671.3423680875 58439.5269951071 97826.6208431832 174526.596278065 113622.860259348 87279.0411235636 156155.370850906 93245.3333098682 33544.7702911757 79726.6891894463 51569.9615827843 66727.1663853648 25296.0140789824 24628.2181181469 202511.722175833 194715.407751565 11410.8876755748 16550.0831697547 19988.7305886374 31989.7722847096 32691.3340188355 24425.164946724 57136.080004221 28966.9244006478 Isoleucine 406839.260005046 446747.196269441 365892.777422837 381516.777438316 225942.400942741 737557.673863649 299271.102599085 409974.018034358 2738442.14540252 2057075.67519341 4390070.23113324 7057843.63919174 192586.255513933 145495.853596967 638916.851124067 284749.870172761 236089.506085732 405060.812175303 358042.757396971 327302.822177892 87986.2846002121 102388.94952757 540624.538453894 528600.571651938 373933.653802008 289411.50050441 322119.610049432 433251.613189981 234983.179289721 389723.185060744 502454.904387026 882600.947616129 923185.051100831 1443462.10692585 523594.743914096 905682.602902477 575031.620210372 318999.725133058 536181.342443916 426372.479422977 228000.073206623 226195.086538312 388066.563595824 287904.366812339 753083.958993387 626280.183930763 420973.125020793 395046.963197189 229926.955329535 205371.53755258 240977.816394465 377830.073788748 444146.167471326 237097.087813738 373087.974519302 277871.518521863 D-Xylose 34235.4827897271 29807.1619079244 259586.99252516 364421.644452643 17889.0666763147 52149.1690754758 36750.9651856553 34693.0582054996 69260.9992495405 62965.1791849121 957352.910311001 1182617.87893114 19181.9226188194 12619.8915156387 68808.5262570878 51884.141673815 28074.8203904398 43047.2984595963 172155.125396096 215506.240178713 15703.7439959262 19940.1673329394 59033.2074152259 64490.5705415201 51215.9667411874 48357.3433571235 118100.365834119 203284.860082297 46092.265243786 26572.2597536344 27233.8155643636 82353.635110338 31402.8791322281 37135.3459532244 81051.7332541386 54417.2202184341 44838.4476920002 26387.0168954297 54587.6085349655 19036.829522893 39534.7962562184 29220.7005265272 140054.778132065 115695.417180059 50956.1323440344 23840.6933540235 49785.7340870376 44157.8724224664 26969.0198598483 16591.2995076236 184240.802395049 210264.834766623 33012.8492011228 19505.8000896512 234408.598811891 130492.818714906 Xanthine 31248.0073012793 14319.1169625101 1438849.62646164 1396409.89390912 40419.810966574 148175.598463531 1309630.55341766 389318.891066417 22588.9859607597 22255.9163957289 14487192.5306977 16977494.1337223 36441.1662082296 12813.0959196197 21771.5714278278 163421.96956588 8793.07516225662 13688.6874862299 1078905.91620712 1074179.27121103 10218.9745879072 27621.4536812156 570165.466003955 743250.714678446 15445.0187548186 31975.4611678727 1075041.27505053 1178738.94681931 23175.1211886261 19901.7815350927 1428752.02654866 3160685.16519851 31097.515183062 95596.2258795842 1787996.36851158 1607791.39396181 55419.0617636321 48395.3239852462 1224040.32646859 312038.609786718 38066.6321879095 16003.9809188562 1274310.39507136 963337.580330526 85721.4203849843 16272.9378546686 1264383.67811937 839765.268106621 16741.3700919815 23155.4718435191 855981.785727572 1320196.80724227 37740.5738029273 27004.3932097837 1313807.16302337 1060518.99569395 Lactate 19037930.3416764 5439656.37837154 19873582.3214748 7742388.38005916 16288094.6890787 16093668.425511 17410165.9911641 7522504.29698524 26481856.6239315 8997799.62219901 30295115.2130714 12584460.598308 13674927.2548406 3533166.58599139 26194028.9855777 9513151.30676209 14066108.2898507 8708935.35927901 17658136.9837791 7747447.03107275 14614580.9633067 6370758.43095205 28420576.5471862 8041176.91273215 25602881.4802461 10989288.9851471 35876420.5241362 14549990.5681075 20212127.2025715 8756099.74159557 11589173.8336406 9049182.24572281 21592891.5997294 7571077.87815166 26305889.2144086 9721504.36724564 25137926.5225383 6425129.88458172 16984198.431964 3667918.94021151 26624967.9559749 9295371.1061118 22993082.6662944 5700464.17359873 26330930.2965621 5481211.46747418 21299601.8093755 8119861.83285477 20480065.0950433 4584256.51569181 16540080.8735214 9438464.74813171 25840027.7510382 3720400.01836897 14856397.4859458 5607533.73777031 N-Acetyl-L-alanine 84901.7895791301 67127.0741621842 75029.7612160116 85208.5532684711 31049.9713286455 102173.484530499 48408.9490558716 50627.4600902106 283577.299382524 135992.931735327 91901.4287431462 157418.794821621 44223.0546622531 26131.8039147442 611920.252474969 104630.664431227 70330.2594902261 81637.2250932759 50924.0866027927 53595.2195842255 25634.2210343345 45037.4748081993 107568.366873098 75763.0490944316 95166.8244074218 65308.2897440689 54276.8696465859 86355.3920714014 103118.157168999 110065.979832872 33604.9236499029 70809.3236380746 67229.7719701836 122640.165224958 96925.6008734082 44690.5235862809 163654.738440409 111592.979056582 60800.6921475586 35840.2813719953 155616.493958594 74603.6202568712 69328.7590538065 40275.1788608321 206297.055927717 106940.499709659 67136.7280740045 50311.419984073 45247.5730891536 40678.9817142857 53705.0821443657 77876.1690366629 104679.199977646 33708.0541520385 74313.1097743651 40476.7964820307 Leucine 436683.358744603 338604.189102127 265163.485862849 317038.303978924 412284.12596238 1872740.81299907 53060.6460297975 60551.5149565191 1899878.30615343 1685404.67904356 6306046.17729944 8960998.21833059 290042.169736659 190869.548007397 484568.591591434 276648.477978485 161051.506263512 337426.042286873 333542.850594199 302194.299772153 119866.26447167 147824.315852412 556077.708674627 606882.373529411 316034.478571436 313044.239283208 311371.431848933 363383.564636182 587012.521103964 867253.170684223 521327.194173946 921648.123476586 563729.245800236 758798.442865098 590432.241286185 973023.116997931 680359.551455086 460287.548734707 553756.557602117 530277.852489559 360747.470890803 269638.835811295 341736.40955517 247238.777278963 279277.918074747 120236.589154815 394169.494093647 392655.703147569 406801.724800232 363419.085010081 220509.864183501 303668.290522824 875719.872707867 471424.706344789 295181.22169339 212831.251744134 Pterin 114153.668749077 128684.329478075 287888.436522163 846854.77816647 2682.99720333437 55802.8530522997 37913.6678453203 42950.0688243884 495191.018689002 619522.175047731 4116748.55093331 7276644.3450408 1538.8111409692 6488.7752736684 33249.8849158632 103846.634582783 43800.2773699606 160113.827862883 153380.913992361 189941.433066461 3220.33202010761 2694.7583270496 170629.621435207 446413.426398206 157041.111720233 124089.132823517 214587.809967992 302944.570547073 9399.42514632259 44641.8121325343 88030.545025453 191785.066184841 57490.1508575527 184204.394315939 670526.025748936 871411.818365954 74047.8530103901 28893.5333455132 35978.2376196251 5806.07817317189 35034.580373732 62832.5352875425 51053.4920631245 53640.9968455607 27912.5757272277 56187.3923337649 61608.8298765772 55304.0644827316 2149.44005726918 4573.93498459621 15786.5874818945 39915.2916353523 6611.67898261268 8572.1890654549 24566.1955010688 21860.6170480987 Phenylalanine 289763.535732302 280280.14215781 550102.576862505 521811.086207267 207617.503316087 772578.481733883 224511.043490324 269819.506180027 1629101.07408316 1191900.00207806 3911559.45651513 5650409.20981398 170651.164355133 109506.036929969 443619.055837419 765587.755806274 293923.356721985 531039.364339515 671852.995391668 597983.804708829 54122.2843128812 66439.9494087575 711838.252344316 755740.930395235 528939.711102018 367734.703556604 331630.97013567 364611.675200871 269221.398700547 418804.705480967 872285.680038392 1734809.42778717 693915.566678693 772854.151085247 535162.656141653 592659.877374726 245689.571946558 178199.424843288 858738.275832266 643958.455557367 160379.404692915 126004.845727516 572200.74549417 421695.223072447 197856.616138943 115308.352922924 700893.367997552 558803.855179009 285219.108738339 252161.02639592 466810.570931343 674685.209572684 606481.058111406 308299.754355627 677333.560196465 455460.877002063 Guanine 7029.16362004949 2069.38344243145 78468.9484379564 93539.8193284883 27796.4083685725 55620.5927771583 15292.9978907708 41202.2702622425 18307.8733268445 11828.9117375334 572366.494753469 518350.569235571 3278.13398801709 4682.44258431655 12136.1712901583 76781.0504154397 4193.8738147886 9319.00966154241 133386.182797224 127107.535965264 2578.24849768483 4442.07463479467 51869.6592132034 81990.5395271482 7262.18168240402 12238.7868696422 237042.756069717 387890.28462601 11700.9085642442 8478.68646997328 111298.922763583 372538.591396156 14289.6216462342 95307.3964153122 131898.55605145 87049.4631685263 100511.188846584 193764.449721724 74940.1989227946 69714.6209701196 12994.0218617775 9092.67094377845 328413.619504684 235361.490651927 18010.993965462 14317.399058415 26695.0106248734 17058.1108971694 7228.6408474931 5112.35908429343 153203.318011395 243234.274946996 16407.5097594324 5482.23494363184 217620.128761771 138940.521116308 Tryptophan 83010.2868015627 96820.3687772524 72466.7557576298 70336.3833161789 17761.386277665 89879.7779824683 151881.80687961 75780.9801863635 525253.482902788 414128.352819573 201774.228763638 262950.548537476 37326.5582114092 14541.0559312113 87019.2757207805 41086.2492209423 49126.4452952452 138857.43579696 62263.1457275193 74527.7164748201 18758.2022762136 13391.5709687829 139476.444618507 102120.130321672 137642.697161234 85259.291224068 139770.983784119 108179.740493366 64074.6824205429 78761.8905540876 86571.7593556687 184323.142971082 154826.877402424 174714.315626566 111026.050057888 102189.613222774 87301.0826842322 38966.1223944749 152553.548271322 99741.0506134788 50286.1837206562 50238.9903996456 151095.669966378 108061.950381817 71261.7648758449 52349.6619495199 358710.659653656 252629.468077944 19616.5018820234 14421.1292621442 104441.103767657 141729.3181307 31044.9870972576 16430.2615179588 148587.065631285 100277.523895246 Acetylcholine 1240.85949104176 1175.00840120104 7469.82499535688 13065.0230564298 838.344064325399 1689.1946359682 25920.1980192913 40179.3393441241 12346.8344980887 12038.4544400173 143063.722064894 117576.647232088 991.046587945728 916.310506084197 2083.23115853775 2448.90551086101 1200.84063621468 1628.36459724397 5549.08414677758 4004.80220128133 1445.14219625672 1237.4012521334 3023.96458184786 3286.36148631226 1812.80218591663 1527.52237819109 3865.90528343936 5187.07894757093 1219.36283300548 5480.57729447168 4842.13563376335 6169.94728927148 3620.66937074128 6384.0745306542 6701.12128790233 7514.79357290717 1720.00780477868 1236.45428937779 3937.57182525962 3489.84655431036 1923.82089041456 2053.85486109819 5935.10289235172 2076.53477335719 1408.57380355817 2029.9662579581 4731.62148147997 5858.42413154948 1249.99473906091 1361.45029023024 4920.24868223387 8196.01967071826 1148.75241544029 1903.41793293667 6490.4608008888 4717.02253288435 2-Hydroxybutyric acid 1444402.93754854 1316852.00136457 1575548.82312113 2074840.94740524 982526.73824668606 2675436.81268029 1314317.65545667 1493644.91004238 1789903.0414963 1805905.18045832 1854356.23386964 2314780.72421859 1040362.99477352 929153.690810756 2697926.12140169 2574949.86734709 1241247.26997171 1964583.31455814 1696891.54263919 2030681.48033039 879906.012195709 1156777.46358543 1792921.02292641 1726381.44025704 2064255.87839738 2043273.65179708 1600421.30955792 2876447.17187928 2254252.65349832 2221997.38044995 1015885.96019964 2160514.69740395 1324444.88301439 2235637.610376 2303859.08994154 2168789.88429489 1884685.52819028 1690401.5034725 1473960.0296917 1283061.6059537 1797761.96399881 1590765.74943937 1781235.92885161 1295164.85309463 2192954.17581514 1522632.23042891 1572790.35445896 1546631.02124204 1377388.03614306 974218.344418722 1402242.40269322 2061107.52125877 2097530.92404164 1098065.20489299 1919708.49759069 1353769.9594806 Nicotinate 53901.6792957324 70164.7058359931 67767.4259542703 130509.077227186 33579.4190505015 119769.144231917 42807.4149228251 98800.0491169667 70504.860243923 101051.106311053 199402.580920982 309547.739040733 50549.4129313414 52240.7458498705 106908.013896553 144294.832127802 61799.3071567794 96823.5805893256 101818.78484788 112007.10388233 16799.4870469592 64252.5293246798 52287.106268829 117270.372462052 83654.030477336 135460.12477769 70535.6215171821 203093.378722713 52605.8170087429 162064.944701783 47373.6804396293 138033.379989609 47502.7972551306 174436.614541809 92934.5327095206 132405.173481774 58094.7143726353 84093.7164712345 74386.4407656654 86268.3273562227 43203.0989481943 91171.9058154972 77964.819074595 97873.7853241534 53556.6788421056 74036.2099114553 62090.4981060268 95209.9360524106 33877.509119413 54295.84255485 52196.2755798385 124626.721234107 63242.4705241077 64364.6079387405 108308.436524296 85740.0269558811 5-Methylcytosine 3074.37339062828 3865.32969562198 3829.62241999207 9696.68448355195 2903.14730456137 6352.93402371908 1987.4537399588 2672.21222150946 2728.69356771659 3924.84072199196 24909.3688422035 37988.9246052571 1770.80808992096 3250.69388056603 2879.32270912269 4660.85248719075 3956.860580447 2257.11974419387 3190.87714087727 4155.90140156508 2857.64388376392 2287.30547929678 5483.51241298251 5414.77076920252 2774.11580577403 3358.68730532272 18266.0169521486 9015.93439606502 3327.03566844336 22589.1779978064 2672.99593317725 3228.76089561159 4806.13893791089 8749.67427157308 14184.9555961957 62112.2965376907 2893.12611504937 2075.22437392235 2615.45387610099 9761.31437724674 2328.51740388809 2975.96985153798 2831.97086833767 6848.27414484005 1714.97113396902 1928.90254702379 2774.63592118688 2668.3537040343 1960.29433138622 2424.14028633931 2868.64866612798 3074.49065836189 6141.9068973312 4688.7897918118 2653.48484249496 5472.64400181634 Creatinine 31529.2549124828 10949.2505410223 32551.8569057952 28488.6382279252 12107.1776890341 41494.4861299847 45117.4624692714 13514.2195433717 78883.4369660505 18399.0009120164 53773.7923194189 26206.7367426573 66902.103094774 17806.2920787436 92444.6232265018 23163.3821585815 65277.6070625619 20918.980743552 172695.717847307 12979.4920970516 36899.0400607455 18037.2251039262 56421.0574948954 17847.142245623 34593.8013491996 18799.839597726 214134.632818108 37275.3298763384 27769.0926329808 75909.0616583434 68971.9397763761 45249.9709747581 38663.6278945035 39712.9497972946 148029.267216619 21985.1172706858 89322.9749191589 19117.0325392567 30819.4410898058 23805.4099560895 74140.2991400134 17851.5161054988 38154.6987897938 17512.4602671289 114731.835500433 28317.8437549845 65275.5029070469 20560.4744527486 24735.0134753879 14566.5707006732 63833.279697231 18594.2920805231 38866.4642215841 30312.5591884864 96095.5016870333 9891.65584756188 Hypoxanthine 5886.51560848043 923.791118936761 173845.024329183 162624.356023954 4194.14773895204 9419.89414206719 4097.21368904625 12333.3540504 8646.03212836541 4039.33394460913 11278436.1116415 16117509.9285544 3924.17552810128 1075.21209482437 2952.70879506223 26143.911149893 906.604960336492 1927.80854533126 168576.986365947 125631.966200957 0 4170.39042845022 122402.633052289 191834.455468558 1550.66661979088 5357.03725789616 199281.023312087 259188.260051124 2396.79316992535 6358.3219417657 237970.556360121 425911.105970029 4326.07206537508 95652.3761802856 35408.9669113147 50532.3276672293 6237.26758858969 3682.6846759876 135117.520360314 100411.239860287 6333.67050550476 1841.89762813366 194033.181025159 181672.591953048 17133.5696208899 2226.46235864146 442245.132459431 337854.720372856 3371.067870826 2889.76436391568 56935.2842910486 71755.2138264878 2482.3828773462 2903.8546541092 93727.3751720127 47557.1072218084 Acetyl-Methionine 0 2954.82381495541 0 4348.33088755033 0 0 0 0 1487.89891616887 8758.7227121895 5048.24997193871 13981.5543502193 1140.82225757419 1476.80314764884 1617.97579320606 1928.47978282071 0 8253.85905745275 2420.26329166304 2470.6644461892 0 1177.2869256828 7233.0206751682 2149.59547717255 5763.21319769375 2153.36962873295 3489.35410412752 2792.35981432747 4526.85530191573 0 0 9372.11323576563 7127.23482003699 6978.51076232527 7869.65705729945 9225.32107112345 6782.58895540715 2107.13737015624 3301.99170757153 0 2622.73356075669 3405.4844585522 1606.22606928406 0 4249.54162613359 8081.38600412414 0 0 1168.06776928618 1801.6340114925 0 0 3480.98021483002 0 0 2111.47807645541 Uridine 8080.61192997348 7742.43101187269 10417.684594541 22764.9532056403 5550.14512027372 12935.9307664473 3743.94462475828 10588.5285006384 26547.9177577171 25216.8941947855 29530.9900517472 49001.978168913 12195.7951795314 1597.52267051539 13670.0158905533 6219.33298585231 8097.08597488434 9216.05365153997 5727.75684325985 9125.65096400027 4046.83692906177 4666.30254169071 16386.6406475944 11151.6902910568 7035.48095942012 17341.7111133283 10745.145413669 31413.1982516091 8295.29474445654 22964.0426942232 2055.56892086488 20440.593564954 15243.5974221107 28708.2252198858 15313.812473548 28773.2176768812 9829.81835305866 9468.78443315895 7901.43646792036 4765.12551965688 14136.2580594221 8780.89649677278 14368.087493772 10614.1130257193 13593.2004455084 12653.8487666739 3051.60876148965 7769.92013352424 4083.60392800264 7163.67020868925 13309.3800947181 11836.6129706147 8172.45072357008 11449.8794346296 17470.4844411763 13749.060403712 Hydroxyphenyllactic acid 13262.7428185451 10962.3800929065 92850.0062411733 90899.0265201188 6062.87349670437 12435.1221111394 8044.40304791487 10816.4308290403 21100.0030826333 19539.6034884418 302710.58408497 453774.77892168 6293.41998466499 6334.01877253338 16949.8128356546 23119.0976352841 9519.81312464556 14688.1509883526 28994.0085364903 33299.9862903023 5167.65070436256 10362.1547510529 42866.4750245468 36171.5291241781 11325.7469395056 15828.2274339803 23088.8351991856 31018.0063710468 10095.6839717014 32946.5763843876 27347.7574904238 42779.7613657945 10424.855980542001 43584.3266161783 17750.1572556573 22263.9607950972 12694.0135047033 8273.58640714772 20291.0985107034 17791.7810510183 13962.3283103949 11488.8079246981 15034.2870018901 17122.4434926972 9386.68371438928 9324.43764110684 16808.428305143 13520.8876516975 7653.35538951877 4146.89439005817 14566.6485978897 15193.3106658581 17998.0020962082 11056.2353713434 23943.0253349906 15263.2600162974 2-Hydroxy-3-methylbutyric acid 1586694.36599613 1815400.56450514 1814035.09416179 2907442.12650349 898496.254331662 3203063.85020864 1299956.01060593 2272337.49434573 2210932.7911848 2504820.76016432 2540349.36544371 3186204.41986477 1504993.80654727 1307799.37982026 3802419.42693337 3752847.16886598 1615476.05551733 2527798.61082112 2003169.87677029 2783222.53495579 760805.886951214 1583316.87557885 1640797.7625796 3092855.79052262 2317811.84052727 2885044.56631068 1862524.2947288 4652585.56520819 2684826.81282361 3192758.24654165 1210357.7443326 3196607.41720067 1246264.31227584 3122648.7121414 2605526.60823 3107977.41042082 1708976.70136608 2311056.85709131 1980308.54583038 2210185.76690744 1585476.63748753 2013806.5185243 1948024.57317732 2338284.87236671 2464385.65753989 2095269.19892474 1867510.3198722 2077249.54826283 1319928.56740277 1393636.02062015 1389722.36779023 3055793.63134707 2028844.781366 1728538.28574997 3219801.13472008 2080768.26270352 Pyruvate 1112132.41280406 1180414.82718525 382823.405461052 404812.006174497 822248.62244483 1846284.7711499 1327683.09169869 1039482.3864328 3581069.73849949 2843165.25178422 677354.795248983 1360556.90812093 836746.773102431 561707.06362063 1693087.72738425 861281.677915544 1026516.12973056 1457827.41160658 546652.202794658 506173.256034533 607750.22899221 738510.41129224 623221.582442922 723416.016301131 1752206.70994889 1004338.96715694 378439.112019757 611735.83785498 1617228.22233548 2204703.83032846 297338.713469613 611164.945022263 1095110.76220411 2271831.11129542 644740.127654642 277671.776128275 2196558.83247857 1764058.05038956 424371.477173302 528955.772241727 2187732.62733671 1600908.06642614 415006.326845925 326742.653397225 2146517.62348028 1531443.7977436 898585.184396424 803672.269355857 914020.474756596 588747.577588244 447302.342440267 699402.649942256 1423222.09684942 546824.485500632 528321.32857715 360306.67705269 Adenine 75904.9021281844 43381.0946331901 1756912.06224628 2058974.62343791 60660.4403673398 210407.018910759 72075.6477186939 94668.2166095471 299543.521918446 149085.492755108 11551259.5133959 10261044.2713016 167871.271089623 162666.411325171 139017.320687972 526992.257414309 53273.9940038811 112837.87921158 1609767.63514974 1483335.70376656 35820.0778151343 52963.2645101947 1141426.44208065 1392482.70565676 152762.58401027 168961.760425899 1407259.3597315 3478554.16282943 103052.429576924 173381.851199942 1375462.43396175 3745451.86663964 132867.25995118 268656.9885865 2817953.61251001 2745086.28104208 196754.886905942 156320.872241688 1956850.980037 1598521.21994346 137361.599175479 68925.8006000524 2377298.86520646 1398960.25284441 314445.618405976 186791.703898619 1022637.69208711 1185785.85225492 201854.684069604 175126.644121335 1146841.07223537 1977640.27781554 426737.260304162 230733.218470428 1653834.29076618 1216094.14089129 Acetyl leucine 39400.7403746227 53192.4679760673 32017.5701783766 39871.3864068514 14797.3870384281 63624.4068091171 23423.8911454705 54309.1119786941 90442.0162817193 82043.5647500816 506881.772448508 462425.465731728 17189.7223749072 22372.0420780333 137335.473052063 92853.1172851996 16307.6185454745 32840.25672474 25204.07740848 26412.8861226895 25207.4409395585 33848.9543264798 169783.933471702 190809.981680004 140298.473601548 125106.487286548 124005.13765463 271287.798270235 112472.829595826 152361.654029467 107235.763109401 219587.421369007 43128.7350596063 78521.5634135741 51701.9510625705 34216.9630429416 287367.309405377 185623.83592006 230203.885499764 173268.840463326 81985.6680807462 86761.4018279907 85795.5673824968 64726.9421657398 54637.0686357222 39668.2967271077 30227.6497235043 27962.1327023683 15027.4322307268 26538.9546435841 62248.5936767943 105508.623075496 38849.3596726145 23066.0968667173 109660.547488691 71009.6522461713 Phenylethanolamine 1200896.53498404 1179485.68218448 1294635.79714275 1663942.9869305 667838.319192971 2337302.13478101 1038476.82561697 1220940.51929285 1963082.44824334 1286192.56040734 1542259.32858093 1967744.8037018 918127.48795855 699486.792334437 2002362.86324679 1504016.01827086 1085591.40786194 1776861.0027935 1277812.18178984 1112023.5689715 533904.846091364 1033954.83059536 1609120.25508129 1441302.05853234 1689046.07277686 1871249.46744519 1401313.3566701 2124690.81986702 1249537.39509203 2308278.50710499 774704.53661333 1582713.98867822 1048579.96249613 1349158.91966101 1829705.70496869 1750317.69528108 1588211.01947628 1588247.19799851 1109130.15186837 884418.070660171 1446923.10542756 1332335.45257654 1797750.18282458 1197813.65527774 1315139.67923368 1145007.63451345 1452680.33592766 1561348.43616003 1226708.05857879 958137.438094508 944683.408437522 1504803.20606409 1654714.09778603 1029422.36153858 1633718.39623581 1209854.0788918 1-Methyladenosine 93918.6796210881 42708.9446094573 100793.531209387 35010.0946214784 14855.382157046 136128.305977218 40701.667655215 105526.913585769 61717.6298638126 74462.9741241341 21404.1749559276 44471.7357250872 22770.6944122861 29506.6535071892 52040.859061754 24885.2045028716 38174.8213678472 54431.0160511756 41590.4549344018 62908.7992073376 23643.7277828367 22202.9139794899 108571.969083452 108701.726697805 68051.5065234117 133898.722187319 43434.2719044462 86431.0674281307 28977.7179181405 95867.3154166486 32033.580329593 37648.4040516397 135213.605417441 67239.6461545337 37112.7673871125 119530.300139669 28704.7957223739 109549.313685995 51433.0761848848 84910.5783250876 43739.2727117411 48444.9621289391 128360.778086349 140868.609680593 89277.7962726314 59213.6623382625 71917.4927789228 69032.6874292999 84809.9127471544 24572.2438063326 27257.0093035859 61855.6043088076 68379.8967902874 89532.4625197742 45601.5539863498 63344.1311026108 3 4-Dimethoxyphenylacetic acid 336302.032986021 418441.543061847 417769.995853618 617936.164342325 184395.821412133 747369.744530702 363100.536787366 566552.716781137 501863.156092734 507074.786888858 539079.328159346 719023.076581692 255494.702005372 326318.910438748 587063.737577732 643433.853047913 295945.246805002 531125.327812427 413845.652113388 488010.185955858 175235.026006441 371932.208829937 433348.001177861 604502.91053972 442735.625148613 657567.616329298 370247.151642035 860872.766125804 331332.024066157 762177.533815481 331792.508982607 694790.375795829 342845.890154984 658633.537035988 460700.091929816 514968.528997383 455809.095066383 483055.792763078 417125.184269279 494547.74447155 395641.789246585 514775.819600066 422463.199079489 503380.891225388 363726.353406514 427848.53914218 429911.850401642 536025.962541679 262393.674464914 318201.621974841 364985.176777908 702710.090880068 429052.331118809 383904.386712773 589995.333579622 449352.829523217 Hydroxy-methoxycinnamic acid 242537.60471216 265149.406117461 287567.485929055 356296.630509519 154562.932593197 404864.790107122 248406.56168848 326873.459892159 322795.296906399 324883.09029547 277454.114083666 348516.4753246 175179.411803293 191470.78262642 318341.156224632 340392.228596472 224109.082251927 318915.164670754 275537.473094261 269514.733601219 123747.956168931 216483.285205513 287307.613443141 333723.563048877 372683.771983303 403557.47642501 252331.217729671 513026.172945346 227527.448667837 348269.917065015 224356.076075615 387655.005597356 204031.547573193 278929.895109998 294708.600755842 271621.672387693 308966.968186172 295821.010247246 279582.686256837 179435.445262346 285365.637383829 316137.143998127 287923.127398246 291571.221979873 251143.931630677 262464.887866666 283399.5797941 287495.751899188 204196.164101387 212455.17531865 241017.194774006 394252.77504984 311212.633179938 239854.32907223 379585.765209891 279038.127833784 4-Hydroxy-3-methylbenzoic acid 397668.747579321 365999.232638131 500818.56881957 479226.800223965 239630.782503481 806300.104772004 382499.692295777 495708.053373897 576184.070229106 486752.716047603 474143.649617035 636639.658048805 300298.33105941 260898.430255384 658085.057252063 608705.681039096 399938.54123462 534689.820000768 464565.885734082 477411.192606918 234758.1254583 324456.413759581 555786.670249979 496284.304543999 713328.734480912 600013.588754936 427841.212055783 804259.733448208 419035.314424952 595100.534947187 301689.060142293 577390.353630792 382023.501513474 508979.597717744 552658.432679192 451454.840429854 572137.094690232 470986.447766228 458335.985956097 299951.466808555 493490.662272335 503796.961270931 532537.222081328 444129.728466206 470733.984098269 390769.58991155 476581.19988958 463652.457497107 427357.05680428 293933.097534579 391951.141593074 608856.158190099 616091.549406963 320416.26388513 520061.104230658 392637.191047433 Phenylacetylglycine 28754.4777831207 22372.8083061729 25513.6837911511 28758.2139441978 11013.5341700854 55811.9505894773 17064.5484175006 23692.6440613296 84470.30384558 47564.1565003336 126546.709370934 100160.762676268 16586.1321260807 12519.0900740672 44473.9418967201 45712.3743619172 24876.2543219094 38528.4511789424 25630.8559909094 56172.5996751814 10714.988065531 14280.6391403496 43060.773783837 47856.6047675704 44211.146870393 31983.5485550012 50855.6387149085 42853.3412756853 22957.2740231332 34150.0468099453 29506.4850315548 65175.8291816308 48603.1187291175 46835.2821547767 48838.8174825038 33505.478545909 31748.1246505167 28506.2114782806 61759.7079920461 38032.6799324132 30372.2747052295 27812.9198485267 37691.5380564065 36913.4986573297 29601.4906000073 26217.6810279708 50402.7460538659 21659.7492366417 26464.1954757396 15239.0377750147 23845.6048469155 46820.2365064529 32505.3443339942 22930.4456797249 48960.5434113431 21433.2769836911 Leucic acid 902902.965792711 499827.950614325 1307505.94511414 1122621.76727811 592914.479782517 1168771.85200022 853325.522073802 728627.313341979 1287842.13558699 872143.07599374 2146267.44210251 2556997.92435847 709311.914339439 389918.102141614 1729403.19461721 1253251.87719147 772314.497805954 704552.745936358 1246902.44417575 948993.868673305 537194.327757766 492498.785844869 1359171.93500825 1004751.49021547 1297626.65364763 938258.845970945 1075115.49128414 1508496.36927543 1119710.95464547 901927.519934628 764215.389370353 1217485.65647047 747838.311096578 868703.222785696 1602757.25997987 1116294.75061324 1187462.58959737 746081.871012281 1070157.30620955 477662.334395702 1091816.71913578 785601.024720668 1225352.47240433 708663.534254516 1224453.05602024 674635.398728133 1163357.69640893 694528.948169887 906930.280950158 449547.242132121 967803.89522399 1024569.5794087 1328324.4860928 474873.365562275 1445326.99609828 643981.665330229 Phenylpropanolamine 29705.905373003 32023.7727760299 29796.716254808 48173.6004473205 19251.1983252448 48974.7745794822 24302.4347188233 37633.9577628484 20088.9986006556 36121.5712088939 34127.4334286879 39377.2116087427 21007.9382597954 22474.8520656178 46799.7973466385 43223.5995674013 22763.4819858944 36965.3566888901 33372.7460590774 32855.8313047579 19268.166263734 32942.8656293191 43802.1871065886 43787.9174506611 14693.3294014094 53231.5933028921 36189.6313549413 50429.024775803 35859.5546374058 84213.3078560007 27874.1533398701 37769.6011991605 27998.018880466 52731.8545777314 57350.076649865 35422.5680818991 37988.9751131335 36271.2173595646 22089.9607022349 23168.8101464722 26803.9193033494 35335.7801970726 38199.5060201872 30832.6917508555 42238.7519631304 30294.0373971485 41033.8686263938 41414.7344370083 32502.2559040827 27194.292300956 22646.695885573 27219.5786264161 37853.111457736 34732.8977637135 44538.1802234738 34636.428632638 Acetyl-Phenylalanine 13435.2806959868 27440.2444833999 12321.4619393814 26171.3256809909 8896.62470813555 32107.6445786099 10472.4459910593 20177.4808663646 87908.4553972014 47098.3091145016 44201.1031601487 57650.3675663285 18927.1185370266 18353.0301184451 53330.6489076245 44435.2910691018 17827.1186057529 34790.0408947255 32680.5352372015 23548.1136606763 5230.36100965377 16931.4786344255 45576.1746200902 35447.5866228627 32834.0940281418 28756.1784847481 23057.3986686306 94821.1032520553 26466.9601239298 43962.3554346388 36515.8043243881 72053.4263425511 18860.7133835336 44125.7759443706 22779.494828929 26310.514876949 19766.7557071558 20926.8266009736 50539.8681011569 12807.1725517742 17816.9892505822 17122.5872737849 41661.5722676345 17655.0898127298 14576.6302335139 19065.2329654433 20762.1018430034 13760.1803630657 17624.8970427185 17645.964054671 29236.4959674109 25986.3887536964 28373.2481584795 22970.8411727167 23882.3567339311 69733.0023396874 Uracil 41072.3544207141 22278.0817895484 1201217.21295556 1609926.34045035 35457.6441598075 73641.1182310849 446841.138194505 90130.7342715752 137844.727349518 60856.2253113745 16922550.6886933 19772588.999504 115818.610409951 69137.0385891686 266129.051873491 766249.083832832 43305.5459640481 38542.5247526061 1415327.97401996 1295642.40440772 39538.751189067 50350.4330025548 1146374.56623563 1079203.44272806 57909.0767053698 50118.1434470918 1771961.59666102 2846203.00131432 70794.3692305311 134165.356732417 1454758.23045749 3095033.43552582 181173.866413842 576090.222456984 1934531.84453006 1828654.54330885 130429.31840709 207527.886737474 1312993.18683228 658225.872908619 108530.908426147 38957.7119794371 2085136.43880129 1455931.37000816 165165.821633762 61892.6308610635 1472274.58453246 1226710.02389173 34579.9893070559 25926.1444646392 955700.105158452 1555076.193002 52140.2024769689 33848.0189435457 1298203.47950412 1036147.23658945 2-hydroxy pyridine 34496.440505622 49027.9695912996 50075.7575205051 71355.058666456 25156.3247487788 88205.3331996756 37167.2526873631 83977.0386849267 43168.0525512884 80218.0838915989 71244.7817465003 86912.2918116082 40186.5694585286 54264.9467067446 93807.6550031113 139059.073598976 43389.8059901595 76801.5243326691 45063.758452007 122707.253060874 18063.0967677975 63351.5490455592 37644.4545139431 81802.6778227336 35532.3272270581 69580.3263432066 55301.8691326417 235288.085688707 31075.6622764939 83064.9238322271 22944.005868863 88466.6014786407 24355.5832856204 58281.4701124486 61738.5418398252 111000.896623351 40542.3435368504 61497.2340884766 66029.1769475451 51741.7768576724 32299.5662280763 65535.6947026539 37886.5791390225 106674.775733412 32596.121172751 68016.3275643962 45830.1808931752 31983.8663498517 37263.2126793397 65953.9757123678 29864.2979100948 154580.91477415 45338.4752807282 78518.0727990658 91258.9187676244 76810.5273689284 Phenyllactic acid 106791.201085315 124824.033642266 345280.960090916 365276.115615825 69689.8982589161 181748.229143526 93395.4675759666 152742.536077488 182828.621253527 171953.626915768 533941.002049114 903281.510517027 76407.258688108 100804.98606443 163773.980386677 188714.455151987 102584.3299286 168843.248611739 214404.450273516 216441.273316979 65319.5279402136 106698.804289241 289800.541215277 235903.820458937 166111.034834768 154929.435540426 237115.698716103 306618.186883704 97980.6588147696 188140.560700969 135568.031403331 287277.773516801 102582.367449658 145377.421697921 146452.500005927 139967.276944696 124708.461071631 126967.330486932 208421.138102073 82901.2901822702 132285.284274058 154146.452698575 255181.858442632 214684.183950006 120395.309001969 127028.542640365 117877.965302394 111198.174078971 82950.0455543499 107904.414835508 126275.616809096 222359.6441641 132219.684172557 117709.89807868 218398.68395341001 168125.344398548 Hydroxyoctanoic acid 599094.248933114 472554.835466274 741120.346283826 812922.41676264 339154.997989363 1119694.52825906 493020.365851819 766762.765702858 610063.984790836 697682.220335924 705174.291405654 1010186.83851304 399883.256211678 362413.457027019 886320.164624344 960190.268844051 425547.378453351 664895.104180721 597240.904348301 772630.583391547 266200.464603927 448511.656034417 585025.558311314 716886.636077114 712008.356074974 769363.886448899 601719.392979897 1195095.82121336 397431.601021556 697061.307185074 487889.918328449 883858.815894008 409149.807954219 499092.851612349 1063872.29809049 918051.631233511 538072.438521565 586926.663441549 595805.899513301 457919.039033835 545396.636020357 712295.464782942 643154.327770746 830930.171097667 596635.483988896 521414.671041504 580877.970158667 632447.408200452 362533.345090291 545970.030820898 540303.68046977 950739.84681735 636749.670674777 539324.221012369 846381.770037665 624877.805531453 Cresol 32640.7265254052 29251.638285777 43134.4789892514 54914.0001728723 24785.3154805817 62378.0173000023 32804.7024500195 46016.5862046446 43056.1115069732 33884.1739988928 50837.132170093 83458.9325316756 21316.8982437865 20060.1760796869 56302.1755007888 44118.4508298159 33634.5418365945 54082.4605434364 48962.4179851616 48937.7088960139 19533.1840834911 25264.95852218 52887.8698571058 43353.3578778631 43373.3768694162 58634.9845395559 29407.6419782269 83437.6833527916 29476.9578334864 75189.8780794968 32557.8295488625 56538.9663122956 28005.3613194339 54376.199751894 38499.6637514276 29488.1774176332 34766.8300039743 45885.4928743774 31636.21260286 23787.7515091092 43056.8650190759 47417.4672007968 39741.4024284976 36272.991505527 35260.9307813204 35772.8327977803 44304.5976484307 44122.0146177854 29236.515660998 20847.4943811477 35699.6645808401 69834.3032481071 48192.2921957236 45751.07264166 63395.8705795869 35912.7868943364 Hydroxyphenyl pyruvate 82316.1984464373 79789.2468664519 131683.957788589 121468.20267328 51373.054049308 164477.8198541 88339.2068986255 123249.984903237 196165.562228287 152502.635749729 349858.305085437 755161.203249341 49795.8784279552 68081.6362716877 121623.698345283 144676.502618996 76150.3205648552 107898.315477334 150192.77976487 122806.880804633 43560.7769771783 78526.7490370497 158535.665689103 148910.622073045 125651.915514426 132983.442429628 111553.009705569 212348.390255775 60021.4004135801 293142.864519118 75754.3181294097 138407.188700759 78151.2901363147 141558.297422447 126585.891932301 90903.9831644414 122945.92524689 86343.6202504249 84810.5680055296 83515.1771343585 87933.6916039084 254319.681054048 84855.6965610397 80566.0560025151 91773.4848828139 140569.66957468 127724.326385773 119929.894611667 85342.9149439305 66794.4908261525 83449.7911998373 159242.000184429 92457.6693934866 170334.250948957 136408.027485717 80216.0936986938 3-Phenylbutyric acid 135949.248225064 133417.489686118 188197.478108421 209959.051255639 118840.358178621 275958.85201726 138270.622098673 216670.802793205 147311.650704106 196235.131586866 296768.954341231 329339.067037217 122429.323290923 120563.200881023 255637.491822055 234213.653816351 107306.092006822 193490.287744213 224818.78129755 230667.502164812 62860.1602282438 124728.638009543 201172.286289213 212299.014550086 539855.489151675 206078.994995119 169090.940656717 392634.041631855 105707.907092302 259689.654917484 168912.520664088 247364.75349153 131857.805139494 204386.92508546 483025.869016684 265976.246447331 146212.543462173 148210.004570632 154159.028589153 155682.050948993 167939.428794094 173943.799562859 169926.634561068 187360.864980083 161961.10401727 142590.87377694 227638.461802684 181090.280813947 92597.1189135663 122062.427794028 138238.991466945 286798.180579159 207240.393260624 113282.923188815 314798.046811728 191442.375164847 Pyridoxic acid 31691.0227613011 24766.6681247154 62177.0639988939 74939.4923341217 18531.9028687201 54631.2221512046 21482.4140330423 34435.7262743626 40685.2523357359 33775.4742179931 36560.4581467534 117308.789804672 12113.9351536322 22436.8078411372 37700.0779341982 38066.0601468568 23095.3325201325 35238.8732210363 37315.00258201 41490.1724533686 16132.0815906066 21764.9123397845 31961.9151446098 39336.9729672964 34000.430359493 43097.7545449805 35402.8384912605 79350.4868698621 30053.2752308392 59241.3831395188 25545.5812092461 108003.798949324 17123.5101544573 114878.826628507 29562.5178094529 29723.5803955524 31405.8460450488 32731.7818102013 28571.613424466 36588.0782136845 28820.5211904584 38727.070979556 44606.8483548446 33732.5216144906 24967.40817362 26813.2107474204 31206.6613227283 31752.6965939412 26708.8005965574 26878.984144145 26934.6233007686 49266.1166273006 36090.4410185792 32097.3714314735 36009.2328367374 37106.8711563897 2 3-dihydroxybenzoic acid 446388.179511767 298125.235740726 231537.474444972 248685.327075292 22120.0287841568 79393.3187273905 33094.7677522411 53060.586304963 43225.1802760763 50819.7709327318 44865.0936548115 79950.4585547437 19449.2180412318 32964.5131556889 56415.5812881722 55524.7655075448 1257027.73944364 1669070.18856922 1277700.69343458 804014.021969234 312597.633127464 178524.834601912 2943846.83674422 686910.866612231 5902036.17935083 2388211.83869654 6356807.78127106 17189693.6420315 324760.446420151 978218.779594447 354140.53407896 361072.19237587 141575.144210539 422836.563056348 97451.5210233682 57166.3887912447 327880.334909329 170953.694364253 474669.977589303 96683.7400403662 420695.471210798 612050.943762786 420407.462404253 756124.356189416 33639.7385614896 39510.4797010664 44107.7951134463 50232.8343718598 88342.1787555189 84973.0211428657 118899.04755041 103803.766802706 143577.975122207 89302.2807176029 237445.634436529 107311.945836542 5- Methylthioadenosine 98150.9902708409 159708.552409902 309906.087679461 291320.285185712 32239.6248989055 84573.1280236436 140636.47653651 79998.2036198811 664809.737356107 594853.753122937 10016397.2524171 14963578.7388751 23607.9835150845 29541.3895382366 10973.5485088925 945798.074036691 108179.425801924 301151.343619315 1613430.73634793 1747946.85305909 12897.3468832108 5023.79008821433 824075.355903451 1143724.69821051 227743.745295793 115814.170858802 502181.395932456 533879.148985807 86142.283764489 122549.170548256 675277.251112397 1271506.27411988 226363.298680955 262870.174749323 286213.436117361 1246238.4125513 105822.0204904 77898.2400164921 1017188.7029874 1129002.8525293 78678.4496408311 87781.6253034546 586841.597346505 758769.295545552 120839.514252634 124494.858203205 738147.239898583 683862.53077551 30030.6497960595 55669.6217958127 272068.598676672 561471.373759999 74488.2028446396 51770.9350972828 379277.499627711 491364.733531935 Methylphenyllactate 189179.18678094 198069.989287873 235665.944348633 295513.155312023 132031.881589557 429328.269445982 173694.010149981 636958.039795102 236145.799847601 231134.127868946 392781.845944827 883510.12823931 146394.297439695 187308.179318534 371917.88914845 426555.81740032 165282.728218661 302733.870065892 287318.447935226 443478.898207372 89236.1447788836 367859.680772747 241185.43566846 368948.581423104 338971.641956673 732858.277665567 211951.640187878 477138.348285838 175863.310292909 461315.586196901 168354.627530741 422435.512508858 162930.077106538 694380.885968554 469455.353479291 320575.415379464 247329.198319908 402664.745476061 242973.676565327 172216.787300568 223704.044756415 686463.410874287 236330.327045196 326453.954902997 230277.95447676 443789.709159559 282497.812700807 1014402.11033805 183048.119577951 176647.175941384 179968.760404959 413356.499790103 238373.891941759 246306.510558114 357015.188854313 231241.771320745 Phenyl-pyruvate 261101.298158278 247689.177929928 282117.499503847 210219.340393843 123577.21333613 216140.418727425 283628.76774957 257284.223411224 1673408.86868837 1243233.8990776 742102.286036218 1574818.05424159 85259.4928705924 114939.872639405 356977.721785885 271083.327157524 252257.402502351 506929.602125176 326183.724718819 230352.604248554 110726.352613238 341657.451860104 360281.052788172 285788.887424921 290999.714058509 686102.49968574 168175.973608853 359379.03372238 190275.04864729 316697.382627013 116504.079640776 342226.740974147 353027.433118973 235553.731328915 269162.438169192 87706.7678994288 235403.487984703 145092.15311034 147357.13919422 109487.489668541 187782.462475385 644957.859205649 171100.792871807 166963.773552077 210622.597794956 162511.29738185 220614.221343929 152078.800303585 93044.7818872099 115446.729748939 188282.147941265 483793.549659615 209537.751271342 102532.1426329 349338.235892847 137858.921230984 Undecanoic acid 213670.775419197 151363.995651012 349686.103610556 230655.906046465 215894.672154645 236701.983211886 267569.154314369 293941.272916979 188931.776283794 261805.3931253 798840.547562876 541054.703166914 311310.06596043 158861.595044561 698481.635834507 323427.006092489 214744.255146189 291950.906422107 500944.950047649 621504.455990572 123794.907254759 174674.059355267 310384.210251717 235143.985417792 252101.746397937 286989.853511129 181274.68071507 488524.439603853 205455.017583495 200512.481504154 230846.302073996 271664.654431497 213799.417653093 157900.238006769 1174347.99228738 499391.57305214 208486.546401871 230644.288145934 292050.535831856 139244.436055809 321327.006441146 322974.043189877 303653.012068617 276319.611980669 324739.132575768 184172.099303411 443872.608368902 147558.933049054 155068.250494488 228298.204794984 216743.662636185 440822.073911619 321696.442265467 211418.998952803 648310.057688732 200238.784162471 6-Phosphogluconate 120710.317746351 143262.629676265 3406.03698017868 2180.71638935956 55659.8642821051 71737.8219398539 3704.5107630101 11324.8481454384 213056.980473928 1026584.98038265 1511.00870674266 4576.45756764643 21907.459285784 36142.0132565477 21966.1587708419 1676.3266579984 259623.513508921 324744.876726797 1505.06724090441 3125.27224885832 44889.2825273673 20097.1155659568 1627.50759181459 12161.6194607375 317267.379600029 88322.9031278321 2903.98959594698 10040.5718992203 195112.740866405 658628.090537465 9194.36813108396 3581.1873139031 50270.0179458733 487189.665734482 2655.50604943371 2096.70947812512 163242.886574746 74684.7782921894 3968.21838492298 84609.6169678574 57554.8391414506 116333.239931289 4475.18969908736 2781.32417557186 50431.0159895659 75735.9286888198 1617.235611614 8116.42523869279 57960.0750859095 48942.667130135 5551.10870106419 5462.81532894988 42429.9259064608 52428.8642462975 6112.08088349816 3009.51271113413 CDP 111986.881865702 142348.508411746 44071.141369996 83515.0046706596 82457.5700678284 184242.730772346 78483.2151427329 118378.548484629 207419.802134893 200103.519319703 35193.7808139529 67305.8359135009 37266.2369174398 70752.805552635 46675.846051892 102346.411024143 56167.6937791484 140133.11663819 37433.6208083993 43616.3873570529 35819.8517264385 29897.7172923149 66347.8978049612 67463.4733884587 158393.174845525 84517.3648379331 13436.8674190104 35609.0917952731 80639.3120548246 267886.326726752 97138.5965552738 121131.324732803 156054.083608791 778756.993813411 65161.588674301 70961.691180603 135133.23501037 103813.78127815 38475.2791708501 50921.1069322491 82087.917585872 147924.907985039 34419.5841878435 8721.76885240655 159478.156648796 178626.358196397 93594.9105478498 151046.473538203 48568.8960616319 58475.0713628668 25197.8620158082 28587.1023022731 66287.7094699692 82509.5088171237 34149.4379507718 38444.2234051127 Carbamoyl phosphate 1708166.72344619 1831926.24191461 1956465.04599639 3253431.74166187 1626893.98250446 2991204.95318645 1823915.81857063 2258207.09920316 2340276.55176522 1849056.83305964 1986445.31999422 3149360.24492083 1870417.70072387 1613501.32356374 2700390.89810949 2729496.74278742 1655729.13591213 2561573.88450547 2118678.90009804 2292435.89471977 1411191.72960372 2212655.89523231 2013178.9497937 2450767.20204027 2090873.14731573 2478254.4196069 2058798.17704273 3130362.92694767 1942221.02239138 9050264.93813102 2150602.19482791 2901055.87526326 1509927.51931956 7487935.66469133 2404561.12809842 1853562.99439493 2303518.53953332 2266166.8029771 2321309.6066859 4923262.60657519 2166336.09184202 2850588.11816787 2369860.23284116 2234534.75168526 1751386.0921707 2259261.05366568 2086683.31285025 2074161.1050336 1828693.79169235 2098322.91500606 1693804.730362 2429457.76965551 2298083.72180832 1843575.11316082 2574526.3314604 2212363.79035219 Citrulline 284413.758904308 351483.397277693 10427.8826278271 8165.20720683141 14917.2418642573 165431.486684 26714.845930911 15937.6324866159 1360510.06633069 1699746.75405324 34521.2191422338 14148.7201269913 49006.5718077301 31313.1634211892 231289.933493638 29279.4139516002 126545.749134778 318790.973201823 8884.07497914887 12978.3525076082 39550.9181103633 18461.7097790829 14460.1075572125 13433.7075688274 196297.828467689 67331.5529612289 32600.0303604604 23936.8618465974 259144.818077021 372878.583339544 6757.75229189458 12363.0568028069 996759.091530651 764265.584115083 20150.6339409731 17278.0429618098 329573.208150146 283984.099133554 9731.71185633969 10104.5664353972 63484.8603816722 111662.522706679 9833.81747801999 5532.77934553459 598434.81733121 394985.048916116 7304.99812675454 7359.46135420896 49784.3078184695 42186.9519618912 9014.86953037963 9539.95487849928 98536.9050555986 59278.9419526243 12860.286082767 6375.10359186039 Cytosine 62060.3370495658 52544.3282527499 82111.4595013417 84478.1327715223 37305.7412519166 105219.060053322 62403.4254938374 71544.2872782429 65920.531224595 69965.5967448649 63716.1528788439 89463.2784629882 43340.6650764203 42233.9530054517 96085.4956823863 78332.230904418 67720.0657067667 82629.2869381384 68014.8391751708 59684.9611048832 37967.878556978 51648.3441444826 83249.3279715706 70972.5971954155 64582.9290185683 95640.3892782842 68601.7663694118 106591.329745246 57480.4308682818 128747.949798062 49042.4045344963 86697.2225236036 56001.7244894649 87834.6613261894 79853.8057128565 69616.1269706172 88334.6475549029 69981.5535413436 68780.3066830576 54409.4819493111 72179.4091256397 72036.1613651595 83986.3849889161 64180.2308009303 72012.8231039752 58448.8529034673 65014.3327855306 84506.4716102008 50757.1042504233 40036.5757093544 60060.1786480679 76492.9437397601 71347.9607662731 54206.696069443 68908.0339957046 64193.3403775197 Mannose-6-phosphate 149036.642243051 145786.011918698 15149.0678867373 18461.4257517936 353475.971515602 1358171.20411533 68379.3557008785 151763.105589671 768182.599495439 980669.635631505 87224.3154644988 88407.698579872 44451.2865477404 65931.1431613424 135147.973328084 16116.5495833654 245384.178737244 602470.663158958 0 0 38139.0109523895 41630.905894853 0 0 489594.081980869 687054.092725468 0 0 107412.701957842 401294.793988954 0 0 193935.910508316 643979.777273057 0 0 181584.422633229 152145.826350864 0 0 271639.814065567 394557.653287478 0 0 157764.670586708 212562.790149323 0 6606.20323633268 94413.4572647421 89544.481878344 0 0 170790.672816447 137259.387239699 0 0 N-acetyl-glutamine 1544.77308173451 218301.936801963 0 1148.67419561507 898.056777873716 97460.5027040901 121587.512091735 92588.1168328561 1599.22473883253 392262.219535315 5965.15321312405 2837.49025102281 711.468549114143 37796.0607440256 33185.979806575 10514.0288787474 1173.79543112567 315233.455251098 1676.17562966433 2809.69230558486 0 38881.2207720617 9457.98588480492 3441.58674793171 236318.116338311 89283.4631151528 1822.86980978932 1885.57640173642 98823.0345362163 155951.56669751 4409.42915744871 2901.06858905902 216741.233009215 374673.388428143 1564.4023963129 4119.27445236108 140090.60273285 192344.51983988 4955.82695848484 2911.53241570421 97518.4186195195 150308.572491382 2054.17011698676 3495.56713247272 189968.639965814 264135.999932503 12465.2151976261 1587.42724305759 819.458810583967 128865.830413218 1136.56488187432 4246.58320695971 136155.649584841 66460.5404435412 2196.95901708483 4968.15886330079 Orotate 550203.793294518 837612.381700324 1489261.89254624 1536374.76098992 14418.7537519176 68084.541699887 50389.8277996746 52228.7224137923 458464.551668878 313268.156726454 28938.9643570932 27764.3244922302 12923.7770240535 23413.4731857478 88478.7140599706 55278.9434620104 120500.158940789 243962.188601515 87884.2055991938 69734.2234129559 32171.232353583 29543.5976851187 88695.1372514183 67436.9717774939 144587.916850395 101950.664468205 79102.3463871105 79186.7585828573 95153.3460357118 183821.070793366 64681.0066108764 99321.0161613258 202470.040693747 223717.202749667 62259.1207953771 63971.0503459894 136206.588639974 91865.9309351971 69130.2150557428 100774.32568135 98684.3607080173 78106.5646317695 69772.956187334 39528.8284041739 1502482.9821265 935820.306293844 738667.598422844 769658.853384711 34910.8381037034 26784.3599759592 88566.2086878787 120965.123798517 50536.6955814737 40616.4822692947 119535.24751134901 86603.1848969076 Phosphoenolpyruvate 2957803.94311563 4059150.59692203 1059018.43717993 1165432.09731501 280484.811984337 760632.917477637 13172438.3493455 7487737.22472414 31900892.9899994 23233440.2013259 19112930.7412797 27775560.9285615 500132.686967929 901200.076587384 1102297.71093875 8509631.19733489 3318366.64902163 4993930.99179539 11062718.2676347 8034913.64810899 555020.74315568 489034.679417712 1397800.6833581 1977703.20362879 7691418.26821143 5666746.48946941 747513.922045787 1220635.13359773 1253696.7847706 4529837.04410257 6073036.94987818 6032564.90185644 4146703.85944869 17968750.0873625 516276.446092078 784327.128049107 2385137.10461164 2149619.86492633 2694129.0747933 3803450.33590036 2810284.6765864 3976022.52930377 784829.421835179 540043.73618174 4990883.18082721 4495557.21945333 9343167.81587483 9240321.60312908 366781.263406489 329760.806315074 1814280.50238977 2853194.07057138 684541.605260774 288320.428637601 3554636.75743215 2070493.43589147 Thymine 25208.3507378526 22275.3745762811 250212.43494854 332177.837295795 28184.33068889 64383.1629423571 140526.377581274 201450.084874167 135190.778329755 122443.923343216 5165065.34659564 7252267.40463542 20517.155413532 18621.4270023324 59636.1748012954 97204.7488493953 22657.8997608991 45451.3880123174 132437.637349243 106249.682183208 17616.2617683384 30130.9188362107 277788.613095072 201092.779242808 33711.450795026 27793.391039108 194493.718907204 422623.462736481 43632.7889431428 67511.1570291414 123038.502146439 211842.685547706 36963.8055125577 78011.0701867746 133598.63694784 135199.98597725 42610.6245618128 28485.2400807555 139199.712145936 69092.5445933447 54794.3534964226 40556.9077247735 203184.134846199 180102.946406112 52709.2934514953 29114.9107578481 162973.617455074 145717.209518077 25749.2585077667 19257.3346532307 182273.826727478 285462.101329974 39105.9279071588 15645.6524961847 274713.729950125 218546.644774606 UDP 296518.028680041 350386.266666456 477670.17423695 430110.565736083 148114.152321246 860269.790625132 285996.846083166 357101.515011062 4015812.70067793 2858124.36801792 3278316.6809059302 4038646.32378709 82505.0960689697 185510.31402904 138165.829184931 43735.007636421 608974.962619604 887675.282159344 268756.343808841 263075.621583642 79748.7345950044 78270.9777789366 484903.216449094 311415.729592342 969987.512679942 654602.458083247 148804.996050814 142741.131536934 290120.590972671 320129.831335239 122530.412839388 196213.304361833 959355.166343862 1393174.71106266 276281.226670674 426716.568804257 612887.016648904 351453.300705503 192858.55388048 27830.1922901196 425731.514659082 617140.224761732 128935.38432326 96609.7278539027 628081.408551703 506668.461378233 50501.4067308969 54429.8539653525 210253.711374207 157504.703545278 126524.910272689 191983.030685274 354856.898166006 209793.568866375 155496.636355222 125527.395278559 IMP 0 2270858.70814438 0 0 27848.0326121171 0 0 0 3099355.09149542 1890900.45526431 7139.29417896055 8130.91460651672 0 0 0 0 0 0 0 0 196927.976785342 139445.470500026 0 0 0 0 0 0 0 227988.065858951 0 0 0 1427467.179719 0 0 1490964.39458537 0 0 0 1474348.45834506 0 0 0 2815708.09994053 1110883.24846391 0 0 0 0 0 0 0 0 0 0 Xylose-5-phosphate 96948.4664909121 132320.142843789 1410.13238927749 6053.53738650292 31022.5686789147 90837.0111546055 40059.525812518 88359.580926223 167087.345237347 199000.243438544 108115.133635777 71001.0384838659 13807.6035957287 45115.1039570764 66777.8895690262 34600.2731966279 137868.857891052 320330.267715079 6566.15983758045 7558.27518347719 32759.4397771617 45487.5354789863 3624.11595337385 12241.3938380885 197892.874741188 89313.4024395367 12745.3370467842 61160.3365167362 111467.018909175 230600.685707083 2113.73858625998 18079.0984676804 200219.592702263 408601.896936177 10620.210015953 5573.49376945963 145713.749833414 172380.747012314 12559.6851427808 24726.8481930854 122000.372311378 209988.390490153 54369.7309759977 26250.0042585545 94758.3443576116 110093.919545253 22215.8499085925 20315.4797451963 31026.7728853046 37530.2036478468 11741.4457032215 18977.9058489981 51876.0415425755 41119.2445504923 13010.0684385855 16128.5198111224 Ribulose-5-phosphate 342536.675986911 370297.258046607 1090.07511912052 0 95017.4304166461 269029.785498614 24490.6439837833 79927.9246123283 743337.410195363 719397.926950078 42166.567273922 31426.7367186542 50959.5880969091 85432.4806961812 192678.694892234 36927.7320908874 352961.263851469 766363.224700822 7734.72612357953 6889.81100916738 125481.66290393 84922.544932394 11232.4254968302 9606.5644302927 456161.690142227 199780.039862605 4080.81167346197 28737.2529299634 317018.527806163 525126.773239551 2113.73858625998 0 498913.633374865 945869.891870977 21602.9117950916 5657.12353906741 452738.720898007 396044.574085555 5254.72082944503 9839.24187152955 326817.140166722 366033.490576188 23246.7166918975 15622.2969443383 289944.016528567 281787.991332069 6968.84589069477 11996.4478227257 103177.93279281 82035.051216009 4098.4020161889 5191.25450594467 174601.211861057 123883.18229716 14004.1914762308 9281.404219098 3-Phosphoserine 43603.0549028383 48351.8582139679 0 0 7647.58266418652 44404.7021425534 0 0 1204079.59054171 548610.051614963 2181.97903860388 2225.1369596268 6525.28848795485 31288.40119951 14577.206745313 10447.7232101006 44832.5674718956 76592.2972042012 0 5791.27268554118 23631.4603776756 10218.2035993324 0 2028.40828952217 47277.1122333291 12490.6267340802 3332.30888882214 5645.77638833021 11985.768377739 39092.3479645528 0 0 36562.2320508791 180074.522752579 5454.54529660369 3395.26832976222 100378.384310969 55958.9400879436 0 15103.0585686801 46646.9356747533 71211.2443690996 4915.99720365442 0 20136.2921478048 44071.0396710575 0 0 7172.18655459133 26078.2367693867 0 4223.04621960843 8945.24913777685 10257.2230889103 3368.41356889451 0 IDP 5754.19256754951 4645.0763105536 0 0 0 0 18703.5918219484 11451.721717259 266190.110139954 151773.96716087 59739.1976259858 60260.2863326682 0 0 0 5315.48608556244 5008.52965013102 18258.845973975 0 0 0 0 0 0 39180.049675928 11410.4579464451 0 0 0 0 0 0 7117.71448503525 34988.020620666 0 0 0 0 0 0 4837.5682788629 0 0 0 5200.77235562263 7052.78468012955 0 0 0 0 0 0 0 0 0 0 Malonyl-CoA 3260.66304939089 0 0 0 0 11445.5361588619 0 3561.93715875781 20477.3206478679 22057.5020394359 1460.29853513271 0 0 4335.89947638621 0 0 7065.93132957328 22040.8009375945 0 0 0 0 0 0 13087.0901563995 12997.1850244766 0 0 3928.200355229 0 0 0 11662.4740582998 0 0 3664.85050879777 3355.61461031421 0 0 0 12402.6122474001 20222.0470961115 0 0 18798.3520755991 24001.8011521252 0 0 3677.356665595 0 0 0 3522.32057782097 0 0 0 Succinyl-CoA 121263.223217244 211711.100688689 13073.993654948 4261.85045726736 3258.54924331475 54433.3103439072 24031.5384311295 32942.9091389777 1042388.96963187 1326638.73745278 31361.1096675164 36203.0923915431 4258.88083944927 12942.784978848 6319.28717089225 22035.78941097 57352.9809457697 181869.060353536 7340.47065701034 23886.6753243905 1987.19403127014 2529.46935838254 28658.4406504689 19142.227886743 613330.353904472 804017.574962709 0 14182.6066726215 15149.6623152166 14316.9789206838 19565.7115198794 20890.8006305873 454289.409705353 132474.432829999 0 4872.35439226172 28273.8980526725 22055.6885030486 15726.8528100791 8498.25556904966 28033.6569820184 189580.366325621 22196.7012515447 14849.7570668725 109502.13799476 63215.0711237079 48702.941661854 80450.9613335524 25250.2966215955 18447.1872465674 2915.33328670837 5922.4352394315 84051.2607404479 91579.2740067811 0 9006.25244910785 Coenzyme A 263806.00409925 663336.66066883 2161614.45037733 2255678.5218676 36011.6999734401 384141.784711445 2228923.49537826 1377512.68170554 2704028.06220047 2950622.13221197 4039698.55350732 10110914.1572947 22992.7528781484 66359.5148276729 75976.9430035043 1015061.73303252 151929.049613635 1195658.50137799 1340282.35784943 2641033.06796954 33717.1598662351 25567.8018182076 1872517.67738786 2580253.39396238 1624435.36222901 801706.295673433 300603.975752693 1358491.47205999 82652.1236141527 405724.052502209 827171.779253911 3991567.83643825 1252962.93460917 1688624.0924261 1394274.71256758 2885938.89423791 443446.32372416003 281194.667267447 2158923.0652627 1909474.92289885 291044.197889166 551346.836261839 2007294.75486956 1780900.90546547 547415.164412618 566562.113251378 2579917.16774326 3335305.68562767 57023.6047631955 158369.622791387 448106.26245304 1647144.95948859 142071.988276294 104835.373943842 546716.361476999 914107.279371633 Acetyl CoA 1551897.06353734 1202238.48636185 288372.361062651 386962.209556548 157851.408299201 981160.717714201 509837.368887091 153327.478947315 4159415.44371118 4311516.36183303 1481389.7912248 2159693.32749241 146326.855439344 324321.293279104 306348.064515446 40281.5855593058 1392425.40935174 1506346.71357917 50740.0047448198 48964.5928469729 188426.991581248 110727.334400788 596063.468418312 266722.574038912 849039.687392304 153037.135449578 35653.1487734617 122645.354300224 653217.265656497 1070230.56656925 414335.705541473 509070.749499164 1147951.72910488 1399620.30237144 512477.691332162 767968.349748768 2268727.69137105 1313764.32192017 310159.538720722 655780.977750346 1204044.82911099 1278133.04651309 47606.9814642578 75238.4015005831 553023.994019251 499310.805171057 270336.872134282 627120.628849054 543341.373783819 396457.71233307 135208.302426092 109005.193899859 1199003.83944539 546510.194555158 185120.984711064 63747.0333453416 Propionyl CoA 2540.18928888533 4869.62797459716 36776.8852911431 29535.7164646187 1857.09693901464 14334.1118758958 130431.33314652 73363.4488705077 196755.579322981 93002.0405281446 360570.212390791 1019741.04665796 2450.9037861162 5613.46273620147 2024.837213455 160722.617568961 12644.8564716491 93338.8282268766 72242.7931268195 75570.9242776705 1127.22799533726 1192.27312550861 93419.5008933122 136870.383871967 186070.18856653 475455.684472408 79947.0370755003 91998.6306119182 36842.6741687294 59725.1503031941 166772.711555262 197384.94998851 25363.2104477108 11510.303240666 117161.53176341 167126.190173045 15205.7769203267 6987.86274240783 105382.653255975 54699.4067771786 29976.1465860402 73748.8691016228 31551.1793887608 38223.5173121523 77834.1192445288 93790.264483906 147085.463625399 213894.820502854 1308.88283194796 1637.52996743797 20095.7783181773 26568.6769350893 2168.91134255105 1491.58545175331 28085.6328651274 19449.9214784957 Butyryl CoA 11195.2545119795 9655.91183723361 118918.655859329 143625.977943694 15197.7531587512 163927.997544353 93328.3397659494 137502.649204954 5934.80890246858 6431.88428553668 1438804.32342809 1842562.50233024 5358.59245736181 10496.8879173923 0 153102.497506294 28552.3675367085 63980.8740202812 157234.809519794 133688.345570217 14543.5321719681 7698.97368064983 145824.27522166 163152.510176739 23754.2694388088 35702.0217817738 63694.0667411269 125115.466807106 28417.3041659506 29838.2366627585 125489.843467402 282962.919281938 3110.53224945751 0 78880.2691472757 75595.910766764 49326.9055355709 6652.47056081163 124592.528269822 98390.2433993631 31057.2615711237 52023.4896997751 190653.730112753 105782.894335304 26481.9621068862 38356.88905286 205405.473854073 310012.064134293 7188.3269240883 9520.67798370754 93423.1265714937 101006.108593563 25131.2177586542 14595.3328099821 143495.72856305 63489.0886176926 Itaconic acid 380730.287947882 346257.844277017 385487.091069387 298214.410234947 84165.0171669158 255342.54081499 140307.77507428 142774.411937354 3683955.30602909 13694818.8266913 1504000.50903189 2831816.62808277 102566.839360384 116050.539509683 335927.946536053 254761.617573512 531175.989518886 993942.553848003 1469380.30222907 1107701.65874111 438856.999276676 366208.407244882 4205887.63616657 4118253.57747398 318192.799177913 230598.707676659 318504.03337319 258136.789630737 1672988.10993471 1270229.02380854 1906985.6199258 1031453.13210232 233657.995875267 610288.241110538 249328.231990295 244704.431906861 694565.438550653 295962.028145899 1015427.92657601 353188.933319426 261149.866486125 304102.553058406 303318.400723264 311018.797990907 539680.867865475 421310.435213222 426394.860927643 383675.324613683 276100.860648897 232668.416028498 1147303.45937448 1412174.06159256 414398.242128275 279663.515955266 2211674.39137918 1358188.25729945 NegIS_Alanine-2H4-15N 79480432.0504426 81737594.5228772 79137212.3804701 81856058.8430532 72131086.1384221 79852243.7211541 77203211.6509148 80194941.9094421 79298774.0795626 77506275.2309318 69066122.4634217 68323301.9531008 81540183.3565082 81073037.9098628 81662528.3483407 82096811.7653191 75826579.7818867 78461711.8861842 78155245.1503001 82786151.9589882 66780424.3317401 85581137.5565943 79278173.6564099 80414987.4881324 76632715.8018587 83532949.3431559 81568280.6198332 78736428.6192747 81757017.4770195 51727153.3184737 78830094.106803 73931915.0927462 77444536.1272412 48607727.9696843 77739582.5884943 76980016.1461428 78855940.931645 84230503.6183861 80453954.1663232 51295910.6684009 68812057.8677364 80921913.9557026 72071001.8629815 79081790.2731564 76459945.106002 80404007.8842976 70467612.8922917 81201921.6637672 80673865.3628473 82328655.7670966 78044537.6665438 76965528.5559603 78595459.1460345 76103014.6706823 78313811.0716964 83433619.5388658 NegIS_Glucose-2H7-13C6 10950635.8690689 10999979.2200448 11342463.1266097 12976013.6564561 11726436.8434382 11905563.3542451 10558846.7585582 12350880.8707014 11983572.4794834 11186907.5695926 8811190.49650347 10661035.4137675 10591809.1041437 12745953.3770672 13319679.9422108 12445721.5466745 10370708.315525 10829734.8202614 11113503.9052585 12151214.3165178 12471012.2669022 12544849.5484434 11830711.0200739 11586741.5129434 10980244.7822376 12187723.2443871 10993127.5051345 13576455.821537 10798149.8759434 26341763.0045344 12810002.5390456 11940325.4055969 10791985.5706773 28707527.5778198 11082663.1953195 11001291.5287099 11481103.458042 12342686.5140043 11369577.3913419 22928554.499228 9247471.55460416 12592847.676568 11837918.1946813 12761621.5137556 11159721.1589156 12625135.030037 10777313.8760887 13263733.9947404 11878622.0990294 12518064.782649 10965094.322231 12131305.1128602 11886450.267542 15177874.6536546 12279031.2270435 13183459.5918994 NegIS_Glutamine-2H5-15N2 16751652.824942 17398169.864233 16585814.2241135 16374392.5209561 17146299.7592723 16038447.9897907 16719401.4072875 15779023.8858503 18660959.7746415 18773714.0206034 16867838.5336784 15815171.5863863 17538924.3847713 16297042.0517533 16632556.0702928 15518996.9958537 17045232.5058074 16973855.724388 17556356.1567636 16493645.7901506 16854570.626912 17581426.5042919 17346760.3986858 17575303.4266914 17606209.3539902 16680373.026899 16438659.3508508 16062271.8183106 17899970.0583735 14513316.6151345 16375028.6359447 16218753.4598254 17795001.3521337 13409738.2705982 16526546.3732946 15847054.0367488 16920596.0089242 17056206.0219882 15727514.3896098 12755361.6446558 16604821.1076678 15961852.6414769 15678278.0275056 15885000.0846332 17892991.5038424 16711020.6349042 16177443.9451917 15701908.6248828 16876000.3426537 17310653.602748 16886761.2576261 16670301.9251884 16685179.1975216 16043746.5771199 16809131.9188796 16529139.1791534 NegIS_Glycine-13C2_15N1 2280142.40525971 2131803.52034768 2323926.58696808 2087760.02148795 2374428.64512344 2107210.31980232 2030836.62819713 1979972.99128208 2565943.75972749 2381865.32088937 2134864.94056635 2160778.07755411 2415709.47405944 1931249.85677756 2136584.24021235 2123506.33503333 2342805.94135098 2188377.37363324 2149282.40250648 2206940.57087736 2336280.21112332 2048276.72225603 2181500.41047218 2199213.35010968 2143931.18060168 2107559.24117815 2135337.3329461 2169632.98798775 2141344.96615154 1896620.2517607 2009061.65647609 2042164.56172425 2241204.03276302 1874738.67026137 2159656.97601754 2070116.92214127 2116303.9429995 2101355.89376087 2116157.48542609 2018882.91756604 2064923.51977411 2083032.49417 2160346.80873799 2174268.82092432 2270905.47229384 2063510.6279279 2062403.43054678 2199311.55409941 2313814.67379184 1982021.1735812 2274760.29831465 2194233.07178652 2125668.60973601 2041516.71566232 2110607.73474768 2042849.41223759 NegIS_Inosine-15N4 1203431.02477689 1254716.80358695 1160817.78811808 1247669.39602061 1296374.9291396 1205550.09949315 1168026.81114766 1202724.2391736 1234042.72087232 1223436.44775162 1190305.37070522 1129550.40864969 1216286.99002314 1405515.0252005 1227677.38412312 1256461.17285124 1125065.29067423 1230661.04281017 1189592.48892112 1273106.69510191 1331915.82183454 1427841.13275972 1179095.44177694 1187376.34476573 1184596.29634118 1319595.71223155 1266868.4688218301 1222686.18954988 1231384.57432464 1148389.33608913 1344631.58845198 1275667.15273017 1247383.19044294 1222064.01327577 1187857.43374981 1211317.69474156 1182210.35431992 1304909.41480986 1252204.53372854 1198573.39080884 1124879.14075841 1294893.94449661 1120376.46052017 1245236.2306667 1221042.03154297 1305232.72551989 1125110.94938251 1268763.29695542 1167175.33758753 1342821.92239122 1159279.29230313 1183137.99549448 1196176.77526149 1423523.4334034 1206173.16271256 1298314.58851973 NegIS_Lysine-2H8 152072.94393192 162366.698517887 166516.795443867 180861.433416856 152623.15449006 189698.225052448 172866.753158163 175044.304056233 158154.444041739 195308.260274288 240810.220885254 256110.837846067 145002.508414477 151863.633664983 170254.588315842 191099.895721952 141441.636932561 168980.617115566 213350.370807099 206035.44901194 140529.716187408 156757.458467586 178420.051333971 171998.085915613 170752.367887957 190401.138131985 206854.276851494 185385.671754799 165758.5791825 156539.732408801 176083.81022544 214189.582895855 173788.404447103 129078.412933049 218044.359722663 243138.63756138 171087.058277219 152165.671407345 216044.654379149 164687.347069923 167051.82969567901 164566.706308823 216175.17183305 171047.96857283 170304.153467104 162865.410461641 202583.259671911 152575.829613419 150927.271376291 162290.123387164 175510.883797418 196150.261503119 172947.188342394 145709.13630008 180990.133071773 181170.917352905 NegIS_Malate-2H3 15887068.7823734 14039846.7233411 13925957.5217715 9974868.50000813 11274395.6527816 13791515.1100997 16218510.7871523 13672310.8185167 9466058.1381059 8983111.43975035 14663396.3937341 13511296.0301624 12754173.3581547 11401156.0086312 12272381.3213819 11743732.5762864 16043948.7522709 13765206.0274832 11756638.7252762 10097077.5817998 12494072.4765085 10017604.3862341 11819026.1569795 11952000.1277928 16908862.3555981 11300861.2857044 11689298.6825855 10225549.0962069 13845945.4788248 10196447.4690803 10129679.9765176 10416941.0613989 13397225.5623088 12115284.6004894 10471724.8114087 10440043.2507561 14396955.5147738 13883125.2331554 11580056.221613 12920045.8567116 18923944.4356406 13703293.2913808 13716720.8187617 11452486.7278671 12271396.1855671 13335352.6568444 17258880.6365893 12956161.7372601 14083882.5100826 11109391.227525 12193494.8878685 10711263.8904666 14574784.0795816 11001353.0492859 11834603.4979336 9961239.2763535 NegIS_Serine-13C3-15N1 571618.34515367 550093.843205249 618805.250032449 618339.925150255 576396.711103587 587205.691498817 574841.148957396 556044.781601775 662529.38412561 650656.801007171 670101.940851946 657189.526719315 659301.748408166 490627.150596484 577127.041982059 573891.868796016 650745.096889611 607922.609223258 612879.880568414 583064.999010056 561496.300217947 539414.293693231 620702.903892371 644003.432301453 622889.524673736 586397.958495256 582125.161996179 628268.669697426 592790.529280138 497207.033116911 559569.751824846 646374.796816366 584595.852375875 440358.902718594 639531.257030621 624344.946231827 621862.929925306 547750.612530672 576921.779067241 471109.515048867 623348.304072063 543443.914667977 602110.27261043 578310.217209905 604259.083615527 546295.168347813 585816.532410219 577319.479123124 630901.135177854 516285.089571418 612767.80011037 623240.263936054 580246.392444699 490695.212212103 645905.033437337 552089.864291119 NegIS_Thymine-2H4 2226213.05933674 2407837.21253699 2201184.23469249 2451618.6952964 2774257.57886888 2139379.39967267 2365482.98278498 2551492.62433082 2136443.36490844 2198932.32829686 1807672.66416495 1760207.49977482 2277148.71628556 3014485.17726298 2220588.886935 2330818.49524691 2289746.58675159 2321152.41939011 2083561.09039517 2182910.55764745 2794818.65005235 2573998.48908669 2334822.56075416 2251346.76285993 1741084.53159125 2117717.86754915 2245677.63106958 2286585.11853438 2236457.2162712 2121943.26752748 2738040.58295245 2286307.00368201 2252845.109948 2017101.60036308 2304967.10906614 2228378.44630403 2161027.09360681 2225996.92236469 2272158.93255871 2322596.62526956 2327741.27180986 2353321.47019111 2149247.14806643 2570355.46918803 2387328.99030102 2338160.31451566 2027951.2922322 2333722.4484614 2135667.09270722 2763664.62770534 2542697.85792108 2378240.62622586 2191049.2013171 2721318.21143507 2240555.79765991 2551611.5416451 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name GTP CTP UTP Fructose-1 6-bisphosphate Thiamine pyrophosphate ATP Glutathione disulfide Lysine NADP+ Pyridoxamine 5-phosphate Arginine Ornithine NADPH Glucose-6-phosphate ADP L-arginino-succinate Isocitrate GMP CMP Fructose-6-phosphate Aconitate UDP-D-Glucose Cystathionine UMP NAD+ ADP-D-Glucose Dihydroxyacetone phosphate UDP-N-acetyl-glucosamine 5-Aminoimidazole-4-carboxamide ribonucleotide Glycerol-3-phosphate AMP Deoxyribose phosphate N-carbomoyl-L-aspartate Tartaric acid Malate Aminoadipic acid Galacturonic acid NADH Glutathione Aspartate Glutamate Malonic acid 2-Hydroxyglutarate N-Acetylaspartate FAD Glucuronic acid Succinate N-acetyl-glutamate Inositol Glycerophosphocholine (+HAc) Acetyllysine N-acetyl-L-ornithine Fumarate a-ketoglutarate Asparagine Serine S-adenosyl-L-homocysteine Glutamine Histidine Methionine sulfoxide Acetyl-arginine Glycine Threonine 4-Guanidinobutanoic acid Alanine Threonic acid Uric acid Glucose Thiamine Proline Sorbitol Pipecolic acid Pyridoxamine Valine Tyrosine Glycerate Acetyl glycine Homocysteine Methionine Pantothenate Isoleucine D-Xylose Xanthine Lactate N-Acetyl-L-alanine Leucine Pterin Phenylalanine Guanine Tryptophan Acetylcholine 2-Hydroxybutyric acid Nicotinate 5-Methylcytosine Creatinine Hypoxanthine Acetyl-Methionine Uridine Hydroxyphenyllactic acid 2-Hydroxy-3-methylbutyric acid Pyruvate Adenine Acetyl leucine Phenylethanolamine 1-Methyladenosine 3 4-Dimethoxyphenylacetic acid Hydroxy-methoxycinnamic acid 4-Hydroxy-3-methylbenzoic acid Phenylacetylglycine Leucic acid Phenylpropanolamine Acetyl-Phenylalanine Uracil 2-hydroxy pyridine Phenyllactic acid Hydroxyoctanoic acid Cresol Hydroxyphenyl pyruvate 3-Phenylbutyric acid Pyridoxic acid 2 3-dihydroxybenzoic acid 5- Methylthioadenosine Methylphenyllactate Phenyl-pyruvate Undecanoic acid 6-Phosphogluconate CDP Carbamoyl phosphate Citrulline Cytosine Mannose-6-phosphate N-acetyl-glutamine Orotate Phosphoenolpyruvate Thymine UDP IMP Xylose-5-phosphate Ribulose-5-phosphate 3-Phosphoserine IDP Malonyl-CoA Succinyl-CoA Coenzyme A Acetyl CoA Propionyl CoA Butyryl CoA Itaconic acid NegIS_Alanine-2H4-15N NegIS_Glucose-2H7-13C6 NegIS_Glutamine-2H5-15N2 NegIS_Glycine-13C2_15N1 NegIS_Inosine-15N4 NegIS_Lysine-2H8 NegIS_Malate-2H3 NegIS_Serine-13C3-15N1 NegIS_Thymine-2H4 METABOLITES_END #END