#METABOLOMICS WORKBENCH renpingl_20240322_235012 DATATRACK_ID:4735 STUDY_ID:ST003252 ANALYSIS_ID:AN005329 PROJECT_ID:PR002019 VERSION 1 CREATED_ON June 11, 2024, 12:37 pm #PROJECT PR:PROJECT_TITLE 4-diet multi-organ and multi-omic crosstalk PR:PROJECT_TYPE Targeted MS quantitative analysis PR:PROJECT_SUMMARY Presently, dietary patterns have undergone significant shifts, and understanding PR:PROJECT_SUMMARY the intricate interplay between diet, particularly high fat and high sucrose PR:PROJECT_SUMMARY diets, the gut microbiome, and cardiometabolic health has become paramount. PR:PROJECT_SUMMARY These dietary patterns have been consistently associated with heightened PR:PROJECT_SUMMARY cardiometabolic risk factors including obesity, insulin resistance, PR:PROJECT_SUMMARY dyslipidemia, and hypertension. High-fat diets, in particular, contribute to PR:PROJECT_SUMMARY increased adiposity and ectopic fat deposition, exacerbating systemic PR:PROJECT_SUMMARY inflammation and oxidative stress, thereby promoting the development of PR:PROJECT_SUMMARY metabolic dysfunction. Similarly, high sucrose diets have been implicated in the PR:PROJECT_SUMMARY dysregulation of glucose homeostasis, leading to insulin resistance and PR:PROJECT_SUMMARY hyperglycemia, key hallmarks of cardiometabolic diseases such as type 2 diabetes PR:PROJECT_SUMMARY mellitus. Amidst this, the exploration of multi-omic profiles alongside the gut PR:PROJECT_SUMMARY microbial landscape has emerged as a pivotal avenue for unraveling the PR:PROJECT_SUMMARY complexities of cardiometabolic health dynamics affected by the effects of PR:PROJECT_SUMMARY high-fat and high-sucrose diets. The approach of using a multi-omic comparison PR:PROJECT_SUMMARY between organs offers a comprehensive lens through which the intricate molecular PR:PROJECT_SUMMARY signatures underlying the impact of dietary compositions, particularly high fat PR:PROJECT_SUMMARY and high sucrose, on metabolic health, can be examined. PR:INSTITUTE University of Sydney PR:DEPARTMENT School of Medical Sciences PR:LABORATORY Cardiometabolic Disease PR:LAST_NAME Liu PR:FIRST_NAME Renping PR:ADDRESS The Hub, Charles Perkins Centre, D17, The University of Sydney, NSW, 2006 PR:EMAIL renping.liu@sydney.edu.au PR:PHONE +61432953638 #STUDY ST:STUDY_TITLE Metabolomics studies on mouse cardiac samples on a Western diet ST:STUDY_SUMMARY Targeted metabolomics was performed using liquid chromatography-tandem mass ST:STUDY_SUMMARY spectrometry (LC-MS/MS) to measure polar metabolites in both positive and ST:STUDY_SUMMARY negative ionization mode on cardiac mice tissue acquired after a 30 week dietary ST:STUDY_SUMMARY intervention. ST:INSTITUTE University of Sydney ST:DEPARTMENT School of Medical Sciences ST:LABORATORY Cardiometabolic Disease ST:LAST_NAME Liu ST:FIRST_NAME Renping ST:ADDRESS Charles Perkins Centre ST:EMAIL renping.liu@sydney.edu.au ST:NUM_GROUPS 4 ST:TOTAL_SUBJECTS 35 ST:NUM_MALES 35 ST:PHONE +61432953638 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 SU:GENOTYPE_STRAIN C57BL/6J SU:AGE_OR_AGE_RANGE 6 weeks old SU:GENDER Male SU:ANIMAL_ANIMAL_SUPPLIER Australian Resource Centre SU:ANIMAL_HOUSING 3 per cage SU:ANIMAL_LIGHT_CYCLE 12-hour light-dark cycle #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 - C59.1 Sample source:heart tissue | Diet:chow RAW_FILE_NAME(Raw file name)=C59.1_heart.mzML SUBJECT_SAMPLE_FACTORS - C59.2 Sample source:heart tissue | Diet:chow RAW_FILE_NAME(Raw file name)=C59.2_heart.mzML SUBJECT_SAMPLE_FACTORS - C59.3 Sample source:heart tissue | Diet:chow RAW_FILE_NAME(Raw file name)=C59.3_heart.mzML SUBJECT_SAMPLE_FACTORS - C61.1 Sample source:heart tissue | Diet:chow RAW_FILE_NAME(Raw file name)=C61.1_heart.mzML SUBJECT_SAMPLE_FACTORS - C61.2 Sample source:heart tissue | Diet:chow RAW_FILE_NAME(Raw file name)=C61.2_heart.mzML SUBJECT_SAMPLE_FACTORS - C61.3 Sample source:heart tissue | Diet:chow RAW_FILE_NAME(Raw file name)=C61.3_heart.mzML SUBJECT_SAMPLE_FACTORS - C62.1 Sample source:heart tissue | Diet:chow RAW_FILE_NAME(Raw file name)=C62.1_heart.mzML SUBJECT_SAMPLE_FACTORS - C62.2 Sample source:heart tissue | Diet:chow RAW_FILE_NAME(Raw file name)=C62.2_heart.mzML SUBJECT_SAMPLE_FACTORS - C62.3 Sample source:heart tissue | Diet:chow RAW_FILE_NAME(Raw file name)=C62.3_heart.mzML SUBJECT_SAMPLE_FACTORS - HF58.1 Sample source:heart tissue | Diet:hfd RAW_FILE_NAME(Raw file name)=HF58.1_heart.mzML SUBJECT_SAMPLE_FACTORS - HF58.2 Sample source:heart tissue | Diet:hfd RAW_FILE_NAME(Raw file name)=HF58.2_heart.mzML SUBJECT_SAMPLE_FACTORS - HF58.3 Sample source:heart tissue | Diet:hfd RAW_FILE_NAME(Raw file name)=HF58.3_heart.mzML SUBJECT_SAMPLE_FACTORS - HF65.1 Sample source:heart tissue | Diet:hfd RAW_FILE_NAME(Raw file name)=HF65.1_heart.mzML SUBJECT_SAMPLE_FACTORS - HF65.2 Sample source:heart tissue | Diet:hfd RAW_FILE_NAME(Raw file name)=HF65.2_heart.mzML SUBJECT_SAMPLE_FACTORS - HF65.3 Sample source:heart tissue | Diet:hfd RAW_FILE_NAME(Raw file name)=HF65.3_heart.mzML SUBJECT_SAMPLE_FACTORS - HF67.1 Sample source:heart tissue | Diet:hfd RAW_FILE_NAME(Raw file name)=HF67.1_heart.mzML SUBJECT_SAMPLE_FACTORS - HF67.2 Sample source:heart tissue | Diet:hfd RAW_FILE_NAME(Raw file name)=HF67.2_heart.mzML SUBJECT_SAMPLE_FACTORS - HF67.3 Sample source:heart tissue | Diet:hfd RAW_FILE_NAME(Raw file name)=HF67.3_heart.mzML SUBJECT_SAMPLE_FACTORS - HFHS56.1 Sample source:heart tissue | Diet:hfhsd RAW_FILE_NAME(Raw file name)=HFHS56.1_heart.mzML SUBJECT_SAMPLE_FACTORS - HFHS56.2 Sample source:heart tissue | Diet:hfhsd RAW_FILE_NAME(Raw file name)=HFHS56.2_heart.mzML SUBJECT_SAMPLE_FACTORS - HFHS56.3 Sample source:heart tissue | Diet:hfhsd RAW_FILE_NAME(Raw file name)=HFHS56.3_heart.mzML SUBJECT_SAMPLE_FACTORS - HFHS57.1 Sample source:heart tissue | Diet:hfhsd RAW_FILE_NAME(Raw file name)=HFHS57.1_heart.mzML SUBJECT_SAMPLE_FACTORS - HFHS57.3 Sample source:heart tissue | Diet:hfhsd RAW_FILE_NAME(Raw file name)=HFHS57.3_heart.mzML SUBJECT_SAMPLE_FACTORS - HFHS66.1 Sample source:heart tissue | Diet:hfhsd RAW_FILE_NAME(Raw file name)=HFHS66.1_heart.mzML SUBJECT_SAMPLE_FACTORS - HFHS66.2 Sample source:heart tissue | Diet:hfhsd RAW_FILE_NAME(Raw file name)=HFHS66.2_heart.mzML SUBJECT_SAMPLE_FACTORS - HFHS66.3 Sample source:heart tissue | Diet:hfhsd RAW_FILE_NAME(Raw file name)=HFHS66.3_heart.mzML SUBJECT_SAMPLE_FACTORS - HS60.1 Sample source:heart tissue | Diet:hsd RAW_FILE_NAME(Raw file name)=HS60.1_heart.mzML SUBJECT_SAMPLE_FACTORS - HS60.2 Sample source:heart tissue | Diet:hsd RAW_FILE_NAME(Raw file name)=HS60.2_heart.mzML SUBJECT_SAMPLE_FACTORS - HS60.3 Sample source:heart tissue | Diet:hsd RAW_FILE_NAME(Raw file name)=HS60.3_heart.mzML SUBJECT_SAMPLE_FACTORS - HS63.1 Sample source:heart tissue | Diet:hsd RAW_FILE_NAME(Raw file name)=HS63.1_heart.mzML SUBJECT_SAMPLE_FACTORS - HS63.2 Sample source:heart tissue | Diet:hsd RAW_FILE_NAME(Raw file name)=HS63.2_heart.mzML SUBJECT_SAMPLE_FACTORS - HS63.3 Sample source:heart tissue | Diet:hsd RAW_FILE_NAME(Raw file name)=HS63.3_heart.mzML SUBJECT_SAMPLE_FACTORS - HS64.1 Sample source:heart tissue | Diet:hsd RAW_FILE_NAME(Raw file name)=HS64.1_heart.mzML SUBJECT_SAMPLE_FACTORS - HS64.2 Sample source:heart tissue | Diet:hsd RAW_FILE_NAME(Raw file name)=HS64.2_heart.mzML SUBJECT_SAMPLE_FACTORS - HS64.3 Sample source:heart tissue | Diet:hsd RAW_FILE_NAME(Raw file name)=HS64.3_heart.mzML #COLLECTION CO:COLLECTION_SUMMARY Mouse cardiac samples were collected at the end of the experimental design CO:COLLECTION_SUMMARY (after 30-weeks on the diet) during the cull. These hearts were immediately CO:COLLECTION_SUMMARY clamped with metal clamps and snap-frozen in liquid nitrogen and stored in CO:COLLECTION_SUMMARY -80C until further analysis. This process was approved by the University of CO:COLLECTION_SUMMARY Sydney’s Ethics Committee (USYD # 2017/1294). CO:SAMPLE_TYPE Heart CO:STORAGE_CONDITIONS -80℃ #TREATMENT TR:TREATMENT_SUMMARY 36 male C57BL/6J mice were allocated to four different diets (n = 9) consisting TR:TREATMENT_SUMMARY of a control diet (Chow), a high-sucrose diet (HSD), a high-fat diet (HFD), and TR:TREATMENT_SUMMARY a high-fat high-sucrose (western) diet (HFHSD) at 8 weeks of age. Mice had ad TR:TREATMENT_SUMMARY libitum access to their food and autoclaved water. One mouse was euthanised TR:TREATMENT_SUMMARY prior to the expected experimental endpoint due to the loss of body condition TR:TREATMENT_SUMMARY and was excluded from this study. TR:TREATMENT Chow, HFD, HSD, HFHSD #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Approximately 50 mg of ground heart tissue was weighed into 2 mL Eppendorf tube SP:SAMPLEPREP_SUMMARY and subjected to a two-phase extraction protocol involving tissue, ice-cold SP:SAMPLEPREP_SUMMARY extraction medium (methanol:water, and chloroform). Samples were then SP:SAMPLEPREP_SUMMARY centrifuged at 14 000 x g at 4 °C for 25 min. The aqueous layer was transferred SP:SAMPLEPREP_SUMMARY into a new microfuge tube and reconstituted in the acetonitrile/methanol/formic SP:SAMPLEPREP_SUMMARY acid (75:25:0.2; v/v/v, HPLC grade; Thermo Fisher Scientific) for the HILIC SP:SAMPLEPREP_SUMMARY analysis, and acetonitrile/methanol (25:25; v/v/v, HPLC grade) for the AMIDE SP:SAMPLEPREP_SUMMARY analysis. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY Chromatographic method to detect analytes such as amino acids, endocannabinoids, CH:CHROMATOGRAPHY_SUMMARY fatty acid β-oxidation intermediates, gut-derived metabolites, nucleotides, CH:CHROMATOGRAPHY_SUMMARY neurotransmitters, cofactors and vitamins. CH:CHROMATOGRAPHY_TYPE HILIC CH:INSTRUMENT_NAME Agilent 1260 CH:COLUMN_NAME Waters XBridge BEH Amide (100 x 2.1mm,2.5um) CH:SOLVENT_A 95% acetonitrile/5% water; 20mM ammonium acetate; 20mM ammonium hydroxide (pH CH:SOLVENT_A 9.0) CH:SOLVENT_B 100% acetonitrile CH:FLOW_GRADIENT The LC gradient program is initialized with an initial mobile phase composition CH:FLOW_GRADIENT of 15% solvent A and 85% solvent B at a flow rate of 0.25 mL/min. Over the CH:FLOW_GRADIENT course of 8 minutes, the mobile phase composition undergoes a transition to 65% CH:FLOW_GRADIENT solvent A and 35% solvent B. Subsequently, at 8 minutes, the composition shifts CH:FLOW_GRADIENT to 98% solvent A and 2% solvent B, maintained for 1 minute. The mobile phase CH:FLOW_GRADIENT reverts back to the initial composition of 15% solvent A and 85% solvent B at 10 CH:FLOW_GRADIENT minutes. At 12.5 minutes, the flow rate is increased to 0.4 mL/min, while CH:FLOW_GRADIENT maintaining a constant mobile phase composition of 15% solvent A and 85% solvent CH:FLOW_GRADIENT B for a period of 2.5 minutes. Finally, at 15 minutes, the flow rate is reduced CH:FLOW_GRADIENT back to 0.25 mL/min. To ensure system stability, the final condition is CH:FLOW_GRADIENT maintained for 1 minute prior to subsequent analyses. CH:FLOW_RATE 0.250 – 0.400 mL/min CH:COLUMN_TEMPERATURE 40 #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME ABI Sciex 6500 QTrap MS:INSTRUMENT_TYPE QTRAP MS:MS_TYPE API MS:ION_MODE NEGATIVE MS:MS_COMMENTS Targeted metabolite profiling was performed using MS multiple MS:MS_COMMENTS reaction-monitoring transitions. Multiple Reaction Monitoring (MRM) Q1/Q3 peak MS:MS_COMMENTS integration of the raw data files (Analyst software, v.1.6.2; ABSciex) was MS:MS_COMMENTS performed using software MultiQuant 3.0 (ABSciex). #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS abundance MS_METABOLITE_DATA_START Samples C59.1 C59.2 C59.3 C61.1 C61.2 C61.3 C62.1 C62.2 C62.3 HF58.1 HF58.2 HF58.3 HF65.1 HF65.2 HF65.3 HF67.1 HF67.2 HF67.3 HFHS56.1 HFHS56.2 HFHS56.3 HFHS57.1 HFHS57.3 HFHS66.1 HFHS66.2 HFHS66.3 HS60.1 HS60.2 HS60.3 HS63.1 HS63.2 HS63.3 HS64.1 HS64.2 HS64.3 Factors Sample source:heart tissue | Diet:chow Sample source:heart tissue | Diet:chow Sample source:heart tissue | Diet:chow Sample source:heart tissue | Diet:chow Sample source:heart tissue | Diet:chow Sample source:heart tissue | Diet:chow Sample source:heart tissue | Diet:chow Sample source:heart tissue | Diet:chow Sample source:heart tissue | Diet:chow Sample source:heart tissue | Diet:hfd Sample source:heart tissue | Diet:hfd Sample source:heart tissue | Diet:hfd Sample source:heart tissue | Diet:hfd Sample source:heart tissue | Diet:hfd Sample source:heart tissue | Diet:hfd Sample source:heart tissue | Diet:hfd Sample source:heart tissue | Diet:hfd Sample source:heart tissue | Diet:hfd Sample source:heart tissue | Diet:hfhsd Sample source:heart tissue | Diet:hfhsd Sample source:heart tissue | Diet:hfhsd Sample source:heart tissue | Diet:hfhsd Sample source:heart tissue | Diet:hfhsd Sample source:heart tissue | Diet:hfhsd Sample source:heart tissue | Diet:hfhsd Sample source:heart tissue | Diet:hfhsd Sample source:heart tissue | Diet:hsd Sample source:heart tissue | Diet:hsd Sample source:heart tissue | Diet:hsd Sample source:heart tissue | Diet:hsd Sample source:heart tissue | Diet:hsd Sample source:heart tissue | Diet:hsd Sample source:heart tissue | Diet:hsd Sample source:heart tissue | Diet:hsd Sample source:heart tissue | Diet:hsd NMN_0_0 7866872.527 4771212.722 3505276.941 3760456.327 3034065.168 3926880.826 3649748.953 4940066.898 4933469.46 4996042.534 5131080.038 5538904.385 4062157.224 4664870.857 1981025.217 4179032.387 3516467.281 3391507.562 5639918.432 4030345.912 282614.4011 4233353.007 6148459.108 6710764.476 6912944.082 4520788.144 3197841.833 4039739.146 6279829.596 5503418.876 6439306.932 NR_0_0 202002.51 830956.7755 269802.328 192180.0835 294642.0005 334074.02 441753.529 1347376.605 196709.074 869039.772 646100.612 307508.3745 307244.9815 316173.3225 615995.9105 359755.187 842494.2335 283172.555 348002.604 225580.652 13654.3685 295317.023 315865.819 264845.7815 285337.647 429310.8045 289969.974 1032157.046 1084954.015 972091.67 275635.637 NaR_0_0 123874.2963 124873.0294 91789.8954 110963.9385 119595.1865 133140.9025 125278.1821 126595.3069 100773.3551 113365.8267 104442.8957 118544.7018 125122.5978 121307.8685 141679.0627 126428.1025 130960.7422 107756.3826 127588.8559 115431.7022 141618.3217 99910.53677 111874.4096 127996.9288 107154.3462 123582.1749 126749.3127 124399.118 118555.6221 105539.7429 123743.7088 NaMN_0_0 623510.2419 416476.4611 358891.4601 388986.3767 263777.6526 372935.3644 348568.5062 381135.0343 442455.8382 419072.029 466244.783 487770.281 326582.9286 390392.3676 238290.6276 419235.5525 292789.018 336614.7543 497999.951 340141.2828 48410.50668 354488.3581 526097.4459 512924.0276 513249.4233 370173.2863 287083.4143 359046.0188 475666.7995 411921.3429 443258.31 NR_B 106714.1786 202792.4735 106656.7186 117168.1202 138684.9623 147397.5089 143380.7483 333768.2912 123929.0482 209926.3448 155875.7769 161875.9233 131938.1726 161185.7665 216865.6193 176756.3469 177748.3644 149297.5234 162216.9792 122721.2678 63115.8518 150404.8237 193371.144 144564.8556 119162.2985 146393.7824 117126.6178 226393.9832 239084.1042 210114.5918 118822.7589 NR_C 70781.7985 127209.9485 97372.5955 35112.0435 26891.246 96662.298 155332.8525 58055.9775 22168.306 14899.166 56091.6465 27810.72 37294.8305 27526.586 203266.6795 68442.167 65437.7345 98345.0995 174868.6855 14530.6215 16499.145 69154.166 46171.956 76785.651 52405.455 N/A 24723.984 126073.2645 130789.5825 118678.6285 37403.581 NaR_B 921525.549 1035858.234 909486.8301 947599.638 995719.4213 1023573.056 993196.1757 1010144.677 867037.1495 926939.5088 938914.832 1015589.667 1047457.215 976689.9375 1010136.244 988967.4382 1079948.055 896774.1953 1035672.018 976268.0955 1227234.84 897565.6822 987159.4668 946527.5485 935534.1421 1000208.578 975727.5651 972888.528 1013436.352 923292.2711 948198.8317 NaAD_B 69470444 76890328.58 63795247.38 56951200.77 54126642.4 67617392.9 64324509.46 68103880.66 50462517.85 59758483.97 70781927.13 79133065 42670724.26 71765499.74 43438325.39 68680563.34 66906667.21 57702896.25 61602982.79 48830315.63 914223.8815 58322237.41 103829269.6 56162665.46 63386142.67 43433309.05 48872042 64436762.11 60884986.41 63325828.49 49711310.19 NaAD_0_0 50412282.97 56730909.22 46049092.52 43889226.79 39443319.84 49263725.92 48377671.56 50495907.12 37491844.3 44597627.16 51617882 55903392.99 30710761.6 53026457.65 31492062.84 50534218.18 50290531.03 42946176 45352291.81 36509141.39 721696.8365 42622126.93 75556121.76 41099370.83 46120477.87 31949200.11 36079426.15 44923495.32 44363142.9 45583640.52 37061636.22 NAM_0_0 235116785.9 34415772.99 138923917.4 194445709.5 134346052.4 56245072.71 51397476.78 118664533.1 123490017 169319752.1 197345294.2 150022023.6 385736759.1 264311804.4 85787343.64 339288943.2 152209733.8 210339014 193863093.7 412387296.9 23138.5185 311641338.3 300467350.1 178327088.6 120805143.1 64779109.66 56454324.91 219885368.6 357504389.7 257836059.4 227317324.1 NAM_B_0_0 86103551.72 11715657.93 44350160.05 72052288.5 47602113.17 18896543.43 18157948.2 42450964.52 39641865.76 56277849.02 68337709.12 50676879.21 132424116.5 91820598.59 29979629.96 113553880.7 51983820.96 75644705.81 68942943.1 142574700.3 6780.7 111083146.9 98450805.64 60478053.31 36817503.23 21969457.46 20890630.9 78645863.79 133973006.2 88573737.6 78274890.29 NAM_C_0_0 24947559.35 3204640.222 13337373.62 20002341.56 13155591.33 5302433.312 5031359.098 11788095.11 10816398.05 14446376.65 19732544.51 14988257.83 39318345.31 26127603.85 7800216.035 36243421.52 14962786.88 19701387.09 20489680.14 39630689.11 5104.8875 30158082.21 30772498.63 15857980.88 11574368.56 6135127.569 5801140.247 21432284.25 36306796.95 25048450.16 23122190.38 MeNAM_0_0 18071035.45 17585936.14 13157200.97 9385828.577 13486123.61 16994254.63 14345535.67 17702314.92 29044557.47 15647914.58 15963634.88 22009530.87 13687829.3 19230130.5 20219488.49 27775290.74 30194419.75 24548087.79 23991429.21 21263340.82 3307690.73 17853426.55 41730731.34 23949961.37 13181502.69 12258980.16 10415559.91 9928225.241 15399334.14 16362869.45 14339060.04 MeNAM_A 4669965.159 4583897.546 3537544.394 2260857.303 3370645.962 4253513.056 3854127.85 4241824.877 8602173.866 3961211.465 4100825.567 6209760.46 3453062.31 5483641.712 5161632.483 8037369.78 8470562.823 6750175.758 6794507.062 5443124.711 4950.0055 4873315.254 11816946.42 6168873.012 3541896.2 3142464.99 2549722.7 2370862.564 3774084.327 4273603.351 3796021.788 MeNAM_B 6410208.782 6272381.835 4631332.718 3391977.871 4766572.469 5726637.489 5585538.695 6112320.175 12521679.18 5341920.785 5691348.562 8812942.778 5077974.243 7881756.629 7165553.629 11104778.24 11754350.69 8840649.97 9804680.564 8323451.085 8952.064 7189064.973 16395553.48 9381371.84 5529585.343 4462967.608 3632219.793 3569816.499 5861380.239 5907967.506 5197683.448 MeNAM_C 23281012.2 16135783.38 17660486.32 23811660.64 18905961.09 15844870.25 16135042.76 20595734.26 16936183.69 19695033.1 20964722.98 20215893.34 17436211.27 18429637.83 13564563.23 18177757.68 14691025.66 18728517.68 14854060.41 19230389.72 1630551.776 21430539.94 24441540.87 16489143.58 23660766.05 18548063.13 12809832.02 16822756.74 19644811.68 20979884.62 15820085.75 NA_0_0 1135774.814 208364.5566 661573.918 965036.768 664662.7945 279981.683 260810.4045 605589.4565 589210.63 830336.4765 847670.527 693845.072 1883366.272 1155314.295 404971.7525 1719734.356 770583.8245 962955.3605 973417.4255 2046010.866 6646.518 1542175.401 1396504.697 768040.314 539983.87 319875.2345 304968.3715 1063141.603 1789562.219 1358091.542 1113901.553 NA_B_0_0 4428103.567 707584.193 2855231.957 3804821.455 2493076.518 1066682.892 973166.7995 2216702.163 2114371.791 3137287.45 3544656.988 2728943.306 7300738.039 4348004.426 1599402.075 6175262.639 2712744.048 3284054.54 3572880.85 8063636.245 16547.0375 6124503.24 5376569.903 3087056.894 2045172.432 1192026.292 1167658.316 3775442.654 6967082.098 5109900.629 3941106.159 NA_C_0_0 1056315.763 238177.6177 730180.7769 840032.007 496789.4551 477119.9863 285531.7619 534421.3448 612418.6154 758630.7154 815770.2581 544011.6679 1395073.576 982934.7285 314921.2116 1256515.644 635840.4545 832056.8781 868264.0831 1328519.801 3098.883 1123021.461 928783.5097 772841.8482 640697.1708 288615.544 334663.9987 843022.0788 1207713.259 1052826.527 956538.0472 NAD_0_0 639430859 719865815.2 588197973.3 574067225 517990257.3 658608522.4 620163607.4 596865955.7 501278997.5 578394284.3 667421783.1 688325328.1 421558663 679054939.2 414238767.5 668494860.1 633742002 559920877.9 583845310.4 484022883.6 10596349 550419505.2 889959648.2 527998708.7 608452554.4 442412405.1 496408708.3 607960831.4 575489963.8 592956291.7 495217476.9 NADH_A 13669747.48 13062319.73 12536051.52 10055044.19 7903099.561 13932564.1 10476637.11 9903283.577 11414909.17 9544051.814 11234463.76 8815309.138 5725369.809 7608000.101 4580884.769 9798783.916 7417117.702 11580683.07 13016473.74 7946985.088 4124.205 8572750.676 11977105.26 7239632.764 9780514.126 4171286.796 6736959.716 12129083.43 10046998.99 9690614.567 4831776.453 NADH_B 395096288.7 375743444.2 379436357.5 297987773.7 237451509.9 390058048.6 301312515.6 284727327.7 325962577.6 272571023.1 315784434.3 263222879.7 170026208.7 227412132.3 134484646.1 281571575.5 214308943.6 337357479.7 358323164.8 239928052.1 260874.7405 249108292.5 335304268.2 222794644.9 299479049.8 125232351.8 203458826.3 336579442.6 292406008.1 284323555.6 139535949.2 NADP+_A 2666760.855 2592591.306 2158594.511 2495149.5 2053949.93 1916277.871 1980799.555 2464150.772 2068675.163 2394693.036 3058133.719 2856475.028 1635472.09 2381032.133 1124014.487 2686390.122 2338794.619 2357754.838 2346303.238 2461808.999 74453.5 2448722.768 3745657.64 1840951.935 2721898.853 1776966.612 1525740.192 2353406.553 2381450.399 2773829.733 2139244.446 NADP+_B 8693562.156 8681390.378 7998287.75 7441205.583 7091577.359 6786104.833 7495862.896 8806887.077 6937459.627 7349119.487 9789291.246 9868635.678 5503192.354 8134173.335 3992232.126 9800683.964 8168829.75 8194304.891 8812915.905 8104773.885 234219.8645 9004238.917 13385556.55 7537120.407 8120338.358 6239834.178 5349010.009 8151628.325 9276392.576 8951049.339 7498500.503 NADPH 67685340.24 65499053.22 45800320.25 41262525.88 30374341.03 54945013.35 45667568.26 40968069.8 39288905.24 41103966.93 60816171.88 61899168.95 37375223.94 55971227.54 16570550.23 56660247.42 46460247.3 39513752.26 51815162.53 33292863.42 476668.0325 39574588.79 72532869.01 36995714.44 48165731.21 16586875.45 26110294.32 45670611.41 40574541.32 42206776.71 30133550.92 Me2Py 8166565.666 2313693.943 4057662.552 2394454.441 1655764.995 2863268.741 1835503.64 2136288.976 9500090.582 3740170.257 5115050.122 4653755.262 4431195.43 5528262.729 2266708.827 8377857.676 6408460.185 7130411.67 7428973.05 6245179.063 7441.8675 6899521.607 9534617.586 8266572.933 6002902.782 1417677.312 1553973.207 2989848.516 4655488.621 2863489.288 3241796.499 Me4Py 40189133.05 8636570.156 17539384.06 10455509.64 6703022.13 13431047.85 7534092.893 9454835.499 47855523.85 16334272.5 21084179.85 18120050.8 21615297.25 24642532.53 8768903.161 43186688.94 28512211.46 35073745.16 40216377.67 32866827.55 11062.623 30581005.27 49110789.94 41440107.49 30024433.17 5227266.859 5894329.881 12092426.61 25283802.22 12893172.25 15867282.97 ADPr_A 138749712.2 47934000.22 56042765.08 106565041.7 148057952.8 36781590.98 75689950.13 100265764.5 69527693.47 83164773.22 73408259.96 135643874 172500159.8 121064143.6 107539667.5 155920578.1 87820502.92 69307406.66 82921328.14 171484459 4635134.909 112115814 163281023.1 87754636.99 51485483.09 103307339.2 61313180.39 96377279.91 155258415.3 91605446.36 102789317.7 ADPr_B 149952144.1 52162584.73 60118298.12 115118371.9 166922637.4 40604098.44 80791447.97 98753458.15 76638010.23 91287738.65 81653651.45 150924518 194111680.8 134247677.8 119007467.5 158771074.4 97901110.53 75814558.12 93578366.06 190687083.7 5210011.316 128563842.4 175231881.3 93059857.06 57926182.44 110341239.4 65629373.59 106886429.6 162341180.9 103314946.6 117086070.6 ADPr1 71669833.46 24727772 29311025.91 58816532.09 79121293.72 20056271.19 36804483.82 48971759.84 36891307.05 45314495.48 39289078.22 70956129.84 95235704.58 64562970.24 55329188.62 83014588.38 47326106.35 37532408.81 45285215.12 94788951.17 1788105.412 59251355.72 88012951.3 45832087.99 25819134.07 54144642.53 32732677.81 50825824.29 83602168.11 49823209.56 57770109.99 ADPr2 72083182.59 24493528.41 29230791.17 56418032.91 83933638.44 19552720.38 37393123.31 49512299.04 38044877.45 45484315.04 40179721.08 69784696.58 94171752.94 64412413.42 57451678.57 84417209.27 48213380.24 37885709.76 46476076.85 93767148.05 2389270.476 64279663.39 87029260.81 45587925.74 24971943.42 54188922.44 33888466.7 51955137.15 84332091.91 52620265.4 59156522.3 NAM1 302805729.9 48277821.76 193053750.1 268218138.5 194630084.1 74222062.85 75556922.97 171150885.6 155103342.4 215517193.1 234374262 209627079 515151986 322758532.8 123083315.7 469610407.9 188951142.3 263100034.7 246746898.8 522957357 30332.376 422335323.8 396995037.9 212347404.8 139903405.4 93950573.45 83586048.03 266650262.4 457034718.3 355920636.7 297858675.1 NAM2 110733333.3 16142737.27 58442928.66 92333772.74 67632865.95 23629048.54 25658665.12 57734844.85 48447178.86 72634197.84 83005048.38 67743231.37 186660833.4 109699097.6 41798074.69 156640962.9 67018590.45 95304380.42 93181882.86 177698440.5 5473.419 150187613.5 133184716.7 71797375.32 45559772.31 31807319.74 28148844.35 92917341.87 167428160.5 127632538.8 105954349.4 NAM3 62682560.07 9710942.521 36241309.84 52755710.99 39100892.08 13784006.86 14774326.82 33724510 29918334.6 44075303.58 50280710.13 42130038.7 103933126.5 63624727.6 24272866.72 94693999.59 37855014.84 56142879.11 53408644.97 109612622.4 4643.136 84439775.04 81023766.88 44507346.27 29354396.08 18548719.9 17210574.96 54941531.72 101191421.7 70920457.41 59230094.37 NMN1 6701158.084 3274720.613 2730810.351 3936123.358 2437604.385 3864894.854 3174732.902 3711413.082 4323393.053 5010018.289 4861342.976 4569829.667 3857958.516 4269879.022 1619434.113 4038590.765 2675315.532 3109171.511 5523162.578 3199760.35 155917.6997 3695483.174 5619172.279 5854011.068 5670468.394 4452688.734 3023906.9 3372647.279 5116631.343 3749944.965 4766210.281 NMN2 2211434.515 1347767.856 941618.8393 1263121.24 874605.5354 1337968.061 1104987.405 1378517.166 1299146.038 1684810.792 1595238.423 1422108.618 1210072.4 1354676.745 589634.2226 1186418.623 956505.8062 935592.0951 1752715.443 1122704.435 45406.4005 1257899.425 1426494.487 1934116.058 1782308.52 1371216.665 1091994.691 1185792.203 1712617.167 1387494.499 1818851.505 NMN3 1873367.879 1054597.409 752201.9006 1037944.103 703257.743 1001201.483 892769.8497 1102608.472 1152820.226 1472238.725 1204972.816 1255972.696 961872.0647 1258664.109 471168.044 947987.3559 874542.069 809416.886 1419420.864 935753.2248 29231.258 965187.6772 1347491.21 1272594.645 1518338.927 1069671.501 831984.5406 889534.1502 1459699.853 1304636.854 1486259.342 NR1 860347.9493 1796184.702 903056.9892 1000821.013 1223955.667 1229046.76 1332336.13 2945034.115 1022451.659 1913218.229 1357639.024 1330956.52 1174219.009 1362050.952 2034148.207 1418645.483 1537495.29 1308102.762 1273288.078 1052858.061 13321.336 1283827.745 1361979.08 1239119.022 999383.5478 1330528.616 1056827.472 1971932.167 2164202.4 1907501.914 1108997.37 NR2 117504.4891 252305.7555 130741.1442 145898.7794 176290.0715 165270.9216 189871.4492 436431.9008 143975.5165 272145.9138 183510.6324 180841.8801 162432.1324 184535.5592 279160.3431 208229.5393 218875.5969 179277.1161 185835.5747 146091.4017 3614.0195 175913.3543 196060.3593 170494.6312 135983.7495 185200.7871 143855.3465 278346.0135 303636.1894 266630.0213 153645.4234 NR3 66763.32399 140921.4787 73445.92391 76316.63336 94972.61507 92865.95975 105942.6641 239157.5302 80019.7453 147214.5555 109215.1769 101925.4967 92393.94924 104197.6876 153111.754 109383.3401 123082.9244 106701.8696 99883.2571 81943.16209 1950.851 99669.46866 110209.9629 101718.7209 75056.70228 102796.575 79246.74176 150443.3486 173174.6932 161120.7175 82640.69303 NAD1 233859558.4 257838886.1 228458359.4 207267014.6 188906485.2 241229212.6 225532584 230035041.8 177252449.3 207854154.9 242988313 263957728.8 143265508.9 244606625.7 152075304 237341954.3 230935944.2 203790168 207215819.9 172398601.8 3433793.427 201911277.9 328831535.4 192707072.4 210721579.7 153284594.1 170782776 215731428.6 203237030.2 213935869.5 176937554.6 NAD2 6390324.497 7215869.513 5988879.88 5781802.539 5209820.606 6436318.686 6351172.747 6411093.048 4815645.116 5696420.735 6252156.745 7036927.363 4008765.448 6670816.643 4163321.558 6426993.063 6561347.587 5500479.266 5785550.99 4648702.341 98367.394 5474875.503 9848310.381 5239851.69 5938690.713 4147240.482 4771995.352 6306730.614 5634022.013 5997869.247 4778629.83 NAD3 1656719.847 1962087.767 1644373.562 1548259.282 1380332.607 1801934.667 1663155.524 1700042.57 1325880.692 1542678.39 1701844.211 1907889.813 1066585.17 1804614.442 1119255.857 1760673.28 1722896.476 1498328.374 1537959.723 1231981.161 35921.964 1478753.978 2680174.305 1441079.206 1593994.688 1086951.285 1273639.308 1625885.391 1487558.167 1518842.23 1309951.837 NADP1_pos 3712340.853 3529718.103 3089921.043 3389013.292 2932869.629 2478599.846 2855214.988 3309514.099 2728126.3 3412090.601 3940633.698 4510084.276 2341415.174 3459392.34 1485155.56 3980710.986 3348124.743 3413529.217 3616623.732 3445748.348 74061.03643 3398155.021 5421755.303 3001315.561 3440735.621 2556794.498 2061976.57 3256398.469 3936140.214 3694930.231 2954731.104 NADP2_pos 1750227.395 1521432.442 1486858.134 1638323.42 1357725.922 1278163.775 1263110.966 1570414.271 1228077.204 1565463.965 1693870.421 2019142.611 1025740.173 1688557.925 605534.544 1833630.9 1584701.498 1486530.998 1635959.95 1504355.058 24686.2795 1545125.581 2534760.074 1404557.65 1567820.393 1083374.655 864572.4685 1405740.042 1830604.258 1650765.691 1430407.97 NADP3_pos 2293910.113 2077271.698 2009196.65 2084912.255 1743943.749 1602490.082 1659182.363 2170705.47 1671023.443 1968557.304 2370547.572 2735788.047 1460071.726 2194137.091 861319.7015 2443011.759 2026330.121 1946989.554 2134421.922 2015867.658 37459.94265 2065551.465 3376107.197 2060550.529 2046775.805 1512446.096 1206156.212 2096961.209 2245359.631 2109399.026 1840267.669 NAMN1 853053.6466 455303.7586 336230.2872 448523.513 252612.1288 399645.7238 349025.253 408542.6246 472095.7492 550207.5313 471150.9765 484707.5112 369642.0744 415335.3581 204521.6156 423696.0442 346820.5159 312674.0461 521076.4939 391195.6107 7211.452 440177.696 574272.7297 628181.5463 562486.9366 406123.4061 363557.6063 347414.6486 578679.273 547315.2087 610335.8568 NAMN2 155413.4981 108263.8083 86141.9125 112648.5437 86607.09448 101014.2986 101643.8205 121818.3124 108314.9168 122871.5519 135698.3191 115486.2818 107519.6484 117254.3705 80731.78881 103566.8175 98770.10721 86498.461 134911.9601 108584.4763 5225.44 105214.8614 129284.3965 150847.4638 127621.3264 120947.9544 108993.9411 102232.7102 147262.2734 124279.2841 131691.2717 NAMN3 163308.5166 97534.96817 92325.29186 119131.6932 75548.61978 106016.1097 87649.05364 113333.2367 98291.1188 129904.5332 97783.97629 122030.6704 97803.56178 108295.4891 59318.415 101412.6568 81695.94133 90307.97227 134250.9229 92750.5313 11874.3185 108466.4715 136701.8494 136861.3935 121452.4031 103211.7968 88604.10361 75271.10556 137864.3862 124130.5202 147428.7611 MeNAM1 10358465.72 10363853.33 7748104.834 5476489.014 8108099.041 9603936.356 8006434.836 10098967.48 17785935.11 8776824.52 8846849.565 14140284.2 8396325.835 11147396.86 11870708.39 17279135.82 17727073.15 14428144.39 14634745.25 12233077.14 18517.281 10975429.4 24122655.84 13683964.17 7992434.319 7308526.189 6007426.058 5793543.068 9014059.448 9271395.968 8649244.089 MeNAM2 4682697.809 4443773.369 3152954.767 2388597.438 3394108.5 4064946.667 3529268.343 4419214.311 8163816.73 4152471.162 3899610.657 5899333.182 3384490.693 4785202.847 5212895.646 7784658.845 7615391.697 6501557.055 6668081.274 5566998.315 14011.0335 4939065.718 10967321.72 6455445.38 3600576.884 3210227.923 2399756.156 2306526.023 3883786.003 3943246.147 3636148.746 MeNAM3 3438996.636 3255582.954 2582504.529 1720036.683 2560947.885 3233760.5 2704542.787 3217782.351 6136066.754 3129242.869 3211985.032 4668754.642 2521256.193 3811447.114 3997730.147 5847125.052 5976332.013 5043288.805 4759840.755 4125485.825 3877.645 3689663.756 8378653.621 4873582.56 2523716.051 2260234.264 1673690.581 1799250.944 2908406.904 2952383.692 2836955.168 ATP 181895532.1 34434937.68 35663682.07 117815174.8 12637088.2 35339925.79 24139958.38 38982523.17 52266053.63 153026932.6 99767139.24 85262665.98 34300469 44570877.78 4137928.578 29974961.64 35817683.02 31026130.58 30349123.51 53394379.05 592515.4485 69175567.81 56970178.26 37253275.69 201059548.8 44142962.67 19123117.95 27465676.53 30520928.69 41676846.63 30144972.85 NADneg540 1353149.036 1439528.509 1412192.902 1040664.507 1050157.147 1341510.8 1307335.967 1263374.747 933412.1233 1236022.512 1500959.016 1743815.512 789750.5133 1423352.38 877910.3091 1376427.834 1320693.557 1146980.151 1266848.74 1066737.832 23618.79346 1199985.51 2145134.323 1093273.149 1194271.971 785826.7168 958812.7985 1227302.619 1275763.959 1375925.958 1039028.218 NADneg159 1040814.169 1121476.8 1178417.434 1042509.266 1018307.386 1073590.409 1192427.767 1200371.494 810863.827 1045952.344 1240423.169 1226287.046 716330.6625 1302840.228 716265.389 1160882.987 1189624.197 1071984.535 1110566.866 881907.3564 26041.0665 939542.6494 1790830.449 858365.9308 1097334.581 730360.1136 884889.4677 1135001.343 1056256.17 1156858.442 876581.131 NADPneg621 944347.3705 966593.6795 965937.5835 1020721.927 925553.265 770889.944 838811.744 1023375.289 789453.042 917423.087 1196007.384 1168630.913 724741.062 1021503.365 437055.2485 1153019.658 1005766.931 1040323.779 1023894.47 1047732.284 32717.574 1042915.106 1502234.526 862491.7735 1024395.56 741390.551 603016.3 1021024.304 1087420.551 1081865.928 918939.396 NADPneg159 192274.7878 176686.8677 182401.65 188389.4681 163932.7429 151930.7383 157746.9021 193556.4024 144359.4655 174210.5218 240955.2353 231480.399 131850.5536 186897.1605 78991.31729 224371.7174 187169.3005 194262.6003 194989.0706 187023.3336 5322.38 197576.9596 294582.7704 167914.1405 207163.6253 131005.7005 117040.8758 178937.8463 192998.0977 199190.8162 166599.0321 NADHneg 20344944.36 19032564.42 19464063.63 13083815.81 10611932.7 20049405.78 15533847.7 15267284.44 14560807.91 15543201.15 18144009.89 13006549.77 6846965.485 11648904.05 4461562.647 15780681.45 9728032.862 15947268.65 18219309.36 10362205.14 N/A 12506033.67 16702249.31 10619390.65 14879004.93 4017997.317 8499005.32 18369886.72 14672139.9 15571880.58 5306155.115 NADPHneg 1091241.757 815585.2775 642966.105 711223.4595 477164.7365 685005.3415 613521.4555 589924.5075 549904.127 594601.6705 976667.489 920458.498 556615.0125 929618.465 231405.1825 895193.5025 722984.226 630143.477 800572.115 540276.933 7980.576 675273.953 1383064.357 560036.318 695633.6815 224909.965 388431.663 709091.2165 643452.0975 665417.474 485169.0155 cADPribose.1 981745.2018 285274.664 352033.8269 662409.8692 973395.3204 246589.776 440491.0685 604458.2435 421882.9112 621235.4585 451992.8062 959774.9222 1210101.256 855208.6668 661014.9414 1084829.339 567390.6761 465613.0939 605268.8374 1170260.623 16046.34697 702017.5821 1321857.014 557255.315 292334.2846 530322.3495 372959.536 695264.5326 1069727.273 637805.3003 628081.3411 cADPribose.2 44124909.2 13213270.82 17686385.31 30676923.9 42999254.12 10764842.68 18996950.91 24707493.89 17755199.69 25285619.56 23214915.56 43523795.9 58403911.65 40721440.83 28399525.67 52988776 27775641.26 19869426.12 25640317.5 54454523.86 730885.326 30302337.57 57614532.81 24551805.95 12580082.57 22997809.73 16665689.98 28900961.52 46782366.88 26101770.87 28551843.21 NADP1_neg 4615727.292 4844722.418 4580296.258 5057309.421 4459587.115 3769767.168 4075944.56 5217864.148 3816186.482 4686031.602 6105980.514 5485572.924 3662962.474 5085349.59 2137250.362 5843425.251 4881618.174 5330310.81 4895853.033 5588379.196 168988.7455 5254212.401 7650842.401 4311466.177 5106648.405 3653206.353 2950716.734 4817699.042 5633205.513 5641343.273 4348946.671 NADP2_neg 2766425.192 2833486.087 2567292.688 3083598.017 2447528.054 2246248.829 2460582.242 2980783.074 2322300.777 2774459.222 3697427.201 3285482.303 2088773.541 2933418.842 1245715.623 3435944.138 2640179.625 2986493.809 2941102.477 3091988.315 99273.143 3090727.715 4510516.256 2485539.782 3181246.206 2120745.325 1731191.339 2905001.768 3214870.766 3267160.892 2607145.165 NADP3_neg 1539456.157 1621827.237 1470830.785 1613002.63 1439062.059 1231211.972 1322712.528 1708453.766 1306466.953 1536838.191 2022564.208 1848184.297 1166241.374 1619159.546 702754.3919 1907914.615 1466931.556 1687180.16 1634036.425 1734187.41 45158.50357 1785255.959 2442800.384 1400770.381 1613038.376 1191355.377 1021541.479 1602286.016 1756979.023 1818387.425 1473592.187 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name RefMet Name/Standardized name PubChem identifiers KEGG NMN_0_0 Nicotinamide ribotide 14180 C00455 NR_0_0 Nicotinamide riboside 439924 - NaR_0_0 D-Ribosylnicotinate 161233 - NaMN_0_0 Nicotinic acid mononucleotide 53477721 - NR_B Nicotinamide riboside 439924 - NR_C Nicotinamide riboside 439924 - NaR_B D-Ribosylnicotinate 161233 - NaAD_B Nicotinic acid adenine dinucleotide 165491 - NaAD_0_0 Nicotinic acid adenine dinucleotide 165491 - NAM_0_0 Niacinamide 936 - NAM_B_0_0 Niacinamide 936 - NAM_C_0_0 Niacinamide 936 - MeNAM_0_0 1-Methyl nicotinamide 457 - MeNAM_A 1-Methyl nicotinamide 457 - MeNAM_B 1-Methyl nicotinamide 457 - MeNAM_C 1-Methyl nicotinamide 457 - NA_0_0 Nicotinic acid 938 - NA_B_0_0 Nicotinic acid 938 - NA_C_0_0 Nicotinic acid 938 - NAD_0_0 NA-D+ 5893 - NADH_A NADH 439153 - NADH_B NADH 439153 - NADP+_A NA-DP+ 5886 - NADP+_B NA-DP+ 5886 - NADPH NA-DPH 5884 - Me2Py N1-Methyl-2-pyridone-5-carboxamide 69698 - Me4Py N1-Methyl-4-pyridone-3-carboxamide 440810 - ADPr_A ADP-ribose 33576 - ADPr_B ADP-ribose 33576 - ADPr1 ADP-ribose 33576 - ADPr2 ADP-ribose 33576 - NAM1 Niacinamide 936 - NAM2 Niacinamide 936 - NAM3 Niacinamide 936 - NMN1 Nicotinamide ribotide 14180 C00455 NMN2 Nicotinamide ribotide 14180 C00455 NMN3 Nicotinamide ribotide 14180 C00455 NR1 Nicotinamide riboside 439924 - NR2 Nicotinamide riboside 439924 - NR3 Nicotinamide riboside 439924 - NAD1 NA-D+ 5893 - NAD2 NA-D+ 5893 - NAD3 NA-D+ 5893 - NADP1_pos NA-DP+ 5886 - NADP2_pos NA-DP+ 5886 - NADP3_pos NA-DP+ 5886 - NAMN1 Nicotinic acid mononucleotide 53477721 - NAMN2 Nicotinic acid mononucleotide 53477721 - NAMN3 Nicotinic acid mononucleotide 53477721 - MeNAM1 1-Methyl nicotinamide 457 - MeNAM2 1-Methyl nicotinamide 457 - MeNAM3 1-Methyl nicotinamide 457 - ATP ATP - C00002 NADneg540 NA-D+ 5893 - NADneg159 NA-D+ 5893 - NADPneg621 NA-DP+ 5886 - NADPneg159 NA-DP+ 5886 - NADHneg NADH 439153 - NADPHneg NA-DPH 5884 - cADPribose.1 Cyclic ADP-ribose 123847 - cADPribose.2 Cyclic ADP-ribose 123847 - NADP1_neg NA-DP+ 5886 - NADP2_neg NA-DP+ 5886 - NADP3_neg NA-DP+ 5886 - METABOLITES_END #END