metabolite_name 05_UK21 07_UK21 13_UK21 15_UK21 (S)-Methylmalonic acid semialdehyde-13C0[-H+]- 87912.82 135224.30 69049.71 66478.87 (S)-Methylmalonic acid semialdehyde-13C3[-H+]- 15290.66 11909.33 22206.13 22659.78 (S)-Methylmalonic acid semialdehyde-13C4[-H+]- 3817365.03 2795726.61 3688604.22 4030830.65 13BPG-13C3[-H+]- 4733.29 2710.35 27242.95 21100.83 1-Pyrroline-2-carboxylic acid-13C0[-H+]- 32759.79 54004.34 1-Pyrroline-2-carboxylic acid-13C2[-H+]- 4823.15 1-Pyrroline-2-carboxylic acid-13C3[-H+]- 622310.82 1260519.95 31325.05 17141.82 2HG-13C0[-H+]- 2141618.32 2303501.93 1699396.63 1074764.04 2HG-13C1[-H+]- 2HG-13C2[-H+]- 141786.88 198361.91 39307.19 13121.62 2HG-13C3[-H+]- 23949.57 43761.08 6473.02 5342.80 2HG-13C4[-H+]- 27547.65 38826.79 2HG-13C5[-H+]- 9795.58 11907.05 3PG-13C0[-H+]- 13250.50 12424.17 3PG-13C3[-H+]- 818820.63 810538.46 420696.39 247077.40 ADP-13C0[-H+]- 5157247.94 8995964.45 5351117.56 1769385.25 ADP-13C1[-H+]- ADP-13C2[-H+]- 30532.36 16387.57 ADP-13C3[-H+]- 48696.31 94242.79 45570.31 19611.33 ADP-13C4[-H+]- 61936.30 106738.09 115070.46 40568.13 ADP-13C5[-H+]- 3824106.17 6258774.50 6352693.26 2130189.74 ADP-13C6[-H+]- aKG-13C0[-H+]- 738276.38 1051119.25 609859.08 655932.37 aKG-13C1[-H+]- aKG-13C2[-H+]- 44997.93 155267.94 36539.70 12270.49 aKG-13C3[-H+]- 11231.85 34548.17 6736.80 aKG-13C4[-H+]- 13652.15 26542.72 aKG-13C5[-H+]- 3409.47 8889.75 Aminofructose 6-phosphate-13C0[-H+]- 135788537.12 226670628.89 80724681.51 68535789.21 Aminofructose 6-phosphate-13C1[-H+]- 26910.97 777490.95 Aminofructose 6-phosphate-13C2[-H+]- Aminofructose 6-phosphate-13C3[-H+]- 7288626.56 12504524.25 5888767.57 3668421.69 Aminofructose 6-phosphate-13C4[-H+]- Aminofructose 6-phosphate-13C6[-H+]- 19533.59 10268.81 AMP-13C0[-H+]- 5571930.19 7688065.99 7025584.86 1993842.89 AMP-13C1[-H+]- AMP-13C2[-H+]- 15510.84 AMP-13C3[-H+]- 42572.45 10558.34 AMP-13C4[-H+]- 105830.00 15596.39 AMP-13C5[-H+]- 1390196.66 1955641.64 6889162.94 1386765.19 AMP-13C6[-H+]- ATP-13C0[-H+]- 3269462.80 6040730.81 99656.54 41451.14 ATP-13C1[-H+]- ATP-13C2[-H+]- ATP-13C3[-H+]- 35279.45 54570.72 ATP-13C4[-H+]- 37067.87 86063.78 ATP-13C5[-H+]- 2614127.36 4669508.39 143305.32 51242.04 ATP-13C6[-H+]- CDP-13C0[-H+]- 35453.90 93663.67 93870.57 64333.86 CDP-13C5[-H+]- 3718.28 3671.58 16114.85 cis-Aconitate-13C0[-H+]- 470452.62 558828.09 59481.05 28259.38 cis-Aconitate-13C1[-H+]- Citrate-13C0[-H+]- 1975890.31 2463193.39 2745065.87 1855000.34 Citrate-13C1[-H+]- 5128.60 88601.97 87097.55 Citrate-13C2[-H+]- 991370.23 1695269.99 858166.85 277363.24 Citrate-13C3[-H+]- 198984.00 393167.72 167060.01 49880.67 Citrate-13C4[-H+]- 264446.71 571172.96 109936.32 16493.32 Citrate-13C5[-H+]- 101333.47 320149.31 23715.09 4505.20 Citrate-13C6[-H+]- 16293.80 47942.34 3786.84 CMP -13C6[-H+]- 4605.22 10527.10 11964.53 1774.21 CMP -13C7[-H+]- 8146.54 12571.96 13104.35 2446.43 CMP-13C0[-H+]- 7756591.08 9388191.78 1695514.30 1256683.68 CMP-13C1[-H+]- CMP-13C2[-H+]- CMP-13C5[-H+]- 135125.68 100494.01 102187.96 31091.54 CTP-13C0[-H+]- 10629.49 14077.39 3394.92 Cyclic AMP-13C0[-H+]- 4855113.65 6025230.63 397468.33 120966.90 Cyclic AMP-13C1[-H+]- Cyclic AMP-13C2[-H+]- Cyclic AMP-13C3[-H+]- 8503.94 45816.44 Cyclic AMP-13C4[-H+]- 22007.87 60476.05 4217.04 Cyclic AMP-13C5[-H+]- 1582001.46 5710727.08 174438.10 176966.69 Cyclic AMP-13C6[-H+]- Cyclic AMP-13C8[-H+]- 5234.05 Deoxycytidine-13C0[-H+]- 1271380.99 1221223.22 1194655.07 1147708.45 Deoxycytidine-13C1[-H+]- Deoxycytidine-13C2[-H+]- 70952.66 83955.72 58701.44 24605.80 Deoxycytidine-13C3[-H+]- 10965.91 30876.44 Deoxycytidine-13C4[-H+]- 7332.76 9361.44 dGDP-13C0[-H+]- 5157247.94 8995964.45 5351117.56 1769385.25 dGDP-13C1[-H+]- dGDP-13C2[-H+]- 31512.61 16432.20 dGDP-13C3[-H+]- 48696.31 94242.79 45483.34 19607.37 dGDP-13C4[-H+]- 61936.30 106738.09 115073.83 dGDP-13C5[-H+]- 3824106.17 6258774.50 6352693.18 2132889.15 dGDP-13C6[-H+]- D-Glucuronic acid 1-phosphate-13C0[-H+]- 5375.81 D-Glucuronic acid 1-phosphate-13C6[-H+]- 87002.56 49800.32 6863.68 5194.53 dGTP-13C0[-H+]- 3269462.80 6040730.81 99656.54 41738.93 dGTP-13C1[-H+]- dGTP-13C2[-H+]- dGTP-13C3[-H+]- 35279.45 54570.72 dGTP-13C4[-H+]- 37067.87 86063.78 dGTP-13C5[-H+]- 2614127.36 4669508.39 143305.32 51242.04 dGTP-13C6[-H+]- D-Ribose and L-Arabinose-13C0[-H+]- 106162.32 87634.09 46483.37 33250.25 D-Ribose and L-Arabinose-13C5[-H+]- 272674.20 167571.64 258103.74 347505.47 D-Ribulose 5-phosphate -13C0[-H+]- 123177.41 238383.44 10194.07 8254.92 D-Ribulose 5-phosphate -13C3[-H+]- 5116.17 6255.61 D-Ribulose 5-phosphate -13C4[-H+]- 4231.46 7477.23 D-Ribulose 5-phosphate -13C5[-H+]- 816543.21 1226633.28 85693.71 49418.09 dTMP-13C0[-H+]- 4416.78 D-Xylose-13C0[-H+]- 106380.09 98330.55 50924.59 46782.82 D-Xylose-13C5[-H+]- 272674.20 167571.64 258103.74 347505.47 E4P-13C0[-H+]- 7434.34 E4P-13C4[-H+]- 11708.33 20519.09 Erythrose-13C0[-H+]- 929943.61 1042235.58 1016058.19 863686.46 Erythrose-13C4[-H+]- 9913.58 13370.95 22403.77 12288.01 F16P-13C5[-H+]- 8768.21 8477.21 F16P-13C6[-H+]- 493843.95 735671.90 108431.86 31519.14 F26P-13C0[-H+]- 73243.65 159754.53 400950.99 239377.56 F26P-13C1[-H+]- F6P-13C5[-H+]- 21547.32 F6P-13C6[-H+]- 183589.70 295572.35 1117247.25 667989.51 Fumarate-13C0[-H+]- 2412403.21 2484271.60 1663701.73 1136898.92 Fumarate-13C1[-H+]- 2703.28 Fumarate-13C2[-H+]- 402372.42 478526.33 134223.43 27030.09 Fumarate-13C3[-H+]- 189066.95 259404.45 62156.08 14248.83 Fumarate-13C4[-H+]- 41690.26 43769.45 11602.93 G1P-13C0[-H+]- 9199.04 64741.02 57739.86 G1P-13C5[-H+]- 13084.44 G1P-13C6[-H+]- 992950.17 1518898.93 358687.12 272002.56 G6P-13C0[-H+]- 12436.03 G6P-13C4[-H+]- 3330.29 G6P-13C5[-H+]- 44991.70 13646.56 G6P-13C6[-H+]- 511971.23 464901.46 2588341.07 1738661.90 GalactitolAndSorbitol-13C0[-H+]- 1513921.17 1843139.59 4949523.76 1409996.13 GalactitolAndSorbitol-13C1[-H+]- GalactitolAndSorbitol-13C4[-H+]- 3344.28 GalactitolAndSorbitol-13C5[-H+]- 557644.31 710945.33 234590.60 89404.04 GalactitolAndSorbitol-13C6[-H+]- 18993815.72 23492115.20 10197398.39 4871371.88 Galactose 6-phosphate-13C0[-H+]- 5033.71 8918.24 52723.80 22576.62 Galactose 6-phosphate-13C3[-H+]- 7897.39 9211.90 13434.90 9945.55 Galactose 6-phosphate-13C5[-H+]- 29247.14 34600.83 59160.12 43695.93 Galactose 6-phosphate-13C6[-H+]- 2081027.27 2423413.62 3770873.90 2970407.29 Galacturonic acid-13C0[-H+]- 520638.65 541190.85 113719.20 198873.07 Galacturonic acid-13C1[-H+]- Galacturonic acid-13C5[-H+]- 4563.82 3667.37 Galacturonic acid-13C6[-H+]- 737356.07 665741.56 436420.61 520861.88 GDP-13C0[-H+]- 56830.15 101019.41 29625.01 13452.31 GDP-13C5[-H+]- 93922.87 197769.14 73476.76 30566.52 Glyceric acid-13C0[-H+]- 4467.84 Glyceric acid-13C3[-H+]- 274851.52 250680.07 111048.15 80997.63 GMP -13C0[-H+]- 2470781.38 3093769.85 918815.94 508960.44 GMP -13C1[-H+]- GMP -13C4[-H+]- 5902.54 GMP -13C5[-H+]- 47462.41 179792.53 719846.13 167605.58 GMP -13C6[-H+]- GMP -13C9[-H+]- 6584.52 GSH-13C0[-H+]- 315269111.42 432656546.52 238128796.92 157634555.71 GSH-13C1[-H+]- 7822494.09 11498443.60 13060623.29 6177680.35 GSH-13C2[-H+]- 54654837.41 88952383.11 35753908.47 14145406.99 GSH-13C3[-H+]- 13877519.25 23665331.14 10246004.91 3300866.79 GSH-13C4[-H+]- 12739111.60 26080754.77 4756071.64 820359.78 GSH-13C5[-H+]- 5928208.82 11096222.91 1909766.23 189072.01 GSH-13C6[-H+]- GTP-13C0[-H+]- 13909.90 36103.29 GTP-13C5[-H+]- 50826.64 70709.26 Gulonic and Galactonic and Gluconic acid-13C0[-H+]- 8235343.42 10412420.73 799173.58 1085953.56 Gulonic and Galactonic and Gluconic acid-13C1[-H+]- Gulonic and Galactonic and Gluconic acid-13C3[-H+]- 24800.48 27607.28 1131.57 4586.43 Gulonic and Galactonic and Gluconic acid-13C4[-H+]- 3881.55 9684.03 Gulonic and Galactonic and Gluconic acid-13C5[-H+]- 215307.79 283175.46 208660.74 150059.01 Gulonic and Galactonic and Gluconic acid-13C6[-H+]- 9440388.99 11496858.36 2678960.35 2905714.14 Hexoses-13C0[-H+]- 44692605.13 51321651.82 32503712.82 21384021.59 Hexoses-13C1[-H+]- Hexoses-13C2[-H+]- Hexoses-13C5[-H+]- 349285.74 217767.68 352414.30 388944.25 Hexoses-13C6[-H+]- 15496126.42 11297584.96 14996091.73 16395686.61 IMP-13C0[-H+]- 4603.38 IMP-13C5[-H+]- 8712.89 Isocitrate-13C0[-H+]- 16873.26 Isocitrate-13C2[-H+]- 5403.72 Itaconic acid-13C0[-H+]- 79705.70 100716.81 149572.88 114323.34 Lactate-13C0[-H+]- 31124056.13 38465610.90 32675088.83 25436936.24 Lactate-13C1[-H+]- 226654.94 431708.08 Lactate-13C2[-H+]- 10904604.30 13223140.49 3013455.22 1779474.46 Lactate-13C3[-H+]- 436878997.61 532853249.81 151966536.22 100980230.93 L-Aspartic acid-13C0[-H+]- 20598668.66 19134803.89 43079449.19 37537675.38 L-Aspartic acid-13C1[-H+]- 432934.09 327439.34 4467341.20 2112342.61 L-Aspartic acid-13C2[-H+]- 2426326.57 2293630.70 9196085.64 3999088.15 L-Aspartic acid-13C3[-H+]- 1748776.49 1590117.26 6338161.36 2757529.40 L-Aspartic acid-13C4[-H+]- 209934.72 248821.89 797181.48 111513.57 L-Glutamic acid-13C0[-H+]- 392274490.33 411306675.84 506467603.41 429281517.71 L-Glutamic acid-13C1[-H+]- 9616910.47 14312473.13 25347435.80 11433656.29 L-Glutamic acid-13C2[-H+]- 11188997.95 117771747.25 89246611.13 39601894.50 L-Glutamic acid-13C3[-H+]- 28144565.52 36660975.94 25534423.20 8080667.56 L-Glutamic acid-13C4[-H+]- 24449659.37 38277292.81 15074363.78 1934042.28 L-Glutamic acid-13C5[-H+]- 11425376.36 18170835.04 4766645.17 568348.38 L-Xylonate-13C0[-H+]- 224229.09 212975.20 345792.02 447998.11 L-Xylonate-13C4[-H+]- 4527.70 L-Xylonate-13C5[-H+]- 650250.44 453554.71 327191.91 308157.30 Malate-13C0[-H+]- 8965200.03 9883511.65 6712692.75 4097450.92 Malate-13C1[-H+]- 368902.97 493731.86 366288.85 74468.57 Malate-13C2[-H+]- 1667250.25 2049557.74 947474.30 301479.42 Malate-13C3[-H+]- 1157608.06 1375945.39 643101.39 126016.81 Malate-13C4[-H+]- 323500.86 513527.49 87081.62 11431.52 Mannose 6-phosphate-13C0[-H+]- 26726.81 42050.23 13880.68 8291.14 Mannose 6-phosphate-13C5[-H+]- 16220.71 20451.53 10423.99 16210.62 Mannose 6-phosphate-13C6[-H+]- 1213260.40 1195143.25 1931781.94 1099952.82 N-Acetylglutamic acid -13C0[-H+]- 3400242.48 4544723.13 2384333.67 1933503.71 N-Acetylglutamic acid -13C1[-H+]- 21071.64 55201.30 N-Acetylglutamic acid -13C2[-H+]- 1677693.91 2628822.55 2303894.25 N-Acetylglutamic acid -13C3[-H+]- 85779.67 227759.50 148148.74 77408.00 N-Acetylglutamic acid -13C4[-H+]- 388246.22 813490.05 493161.43 102647.77 N-Acetylglutamic acid -13C5[-H+]- 54172.84 178434.48 79025.11 17846.96 N-Acetylglutamic acid -13C6[-H+]- 35379.59 89075.93 38466.43 N-Acetylglutamic acid -13C7[-H+]- 17887.99 34747.84 NADH-13C0[-H+]- 69121.70 87493.75 35143.08 11661.98 NADH-13C10[-H+]- 345677.42 297877.06 143922.51 76275.70 NADH-13C11[-H+]- NADH-13C3[-H+]- 5217.61 NADH-13C4[-H+]- 9777.64 NADH-13C5[-H+]- 525114.06 482235.85 168389.04 84756.69 NADH-13C6[-H+]- NADH-13C7[-H+]- 4477.92 462.32 NADH-13C8[-H+]- 8129.83 5639.45 NADH-13C9[-H+]- 18492.92 16020.62 Pantothenic acid-13C0[-H+]- 31951181.75 34162336.20 19789832.30 17578677.85 Pantothenic acid-13C1[-H+]- Pantothenic acid-13C2[-H+]- PEP-13C3[-H+]- 64852.34 47440.10 35328.26 23648.32 Phosphocreatine-13C0[-H+]- 1039670.59 1531381.78 243717.27 115881.63 Phosphocreatine-13C1[-H+]- Phosphoserine-13C0[-H+]- 26957.10 33257.82 22041.76 35570.36 Pyroglutamic acid-13C0[-H+]- 59105509.46 54558931.81 56462150.36 45465776.51 Pyroglutamic acid-13C1[-H+]- 145969.44 376973.28 Pyroglutamic acid-13C2[-H+]- 1385054.52 1840307.62 438890.62 126425.36 Pyroglutamic acid-13C3[-H+]- 308665.19 537964.54 69638.90 20290.72 Pyroglutamic acid-13C4[-H+]- 269790.62 569150.20 32925.13 6747.81 Pyroglutamic acid-13C5[-H+]- 95376.90 189222.36 Pyruvate-13C0[-H+]- 818361.29 887233.33 1126770.79 1126422.81 Pyruvate-13C1[-H+]- Pyruvate-13C2[-H+]- 15078.68 20608.80 9591.29 8546.75 Pyruvate-13C3[-H+]- 4585358.61 5300700.65 2661658.15 2959750.49 R1P-13C0[-H+]- 104345.45 259488.95 21304.96 3819.86 R1P-13C5[-H+]- 178326.42 356677.15 61532.98 21564.36 R5P-13C0[-H+]- 123177.41 238383.44 10194.07 9458.91 R5P-13C3[-H+]- 5048.52 6255.61 R5P-13C4[-H+]- 4232.96 7339.94 R5P-13C5[-H+]- 816543.20 1226634.80 85693.71 40651.08 S7P-13C0[-H+]- 3503.71 6856.14 S7P-13C2[-H+]- 60883.09 58284.83 8327.09 5680.18 S7P-13C5[-H+]- 38958.80 49808.60 6169.83 S7P-13C6[-H+]- 13633.50 19807.88 4653.69 4339.45 S7P-13C7[-H+]- 501167.90 718276.60 203757.57 124246.55 Succinate-13C0[-H+]- 6694212.20 8681363.03 9062971.51 5736296.45 Succinate-13C1[-H+]- 22379.40 Succinate-13C2[-H+]- 355891.81 499842.90 381640.47 72950.37 Succinate-13C3[-H+]- 198314.19 219570.90 187651.59 10873.94 Succinate-13C4[-H+]- 43366.82 59897.06 21687.82 SucroseAndDischarrides-13C1[-H+]- 7377.68 24544.54 SucroseAndDischarrides-13C11[-H+]- 29555.30 29459.42 116663.00 60065.98 SucroseAndDischarrides-13C12[-H+]- 1154214.65 1283608.51 3134934.37 2080085.54 SucroseAndDischarrides-13C6[-H+]- 16408.41 13047.37 SucroseAndDischarrides-13C8[-H+]- 9503.12 11222.44 Taurine-13C0[-H+]- 164631273.97 179969591.42 121683985.11 96222378.14 Taurine-13C1[-H+]- UDP-13C0[-H+]- 32781.36 50924.42 109696.04 62109.83 UDP-13C5[-H+]- 15257.75 21074.71 29626.49 3819.41 UDP-13C7[-H+]- 5199.66 UDP-N-acetyl-alpha-D-galactosamine-13C0[-H+]- 4042777.77 8823340.19 295773.53 192979.80 UDP-N-acetyl-alpha-D-galactosamine-13C1[-H+]- UDP-N-acetyl-alpha-D-galactosamine-13C10[-H+]- 88253.06 132876.29 11768.19 UDP-N-acetyl-alpha-D-galactosamine-13C11[-H+]- 1160139.00 2181323.30 251560.11 88081.70 UDP-N-acetyl-alpha-D-galactosamine-13C12[-H+]- 167818.15 345859.61 31199.44 5165.20 UDP-N-acetyl-alpha-D-galactosamine-13C13[-H+]- 736836.06 1539490.11 54959.66 13385.19 UDP-N-acetyl-alpha-D-galactosamine-13C14[-H+]- 131086.35 256291.81 13986.84 UDP-N-acetyl-alpha-D-galactosamine-13C15[-H+]- 77136.16 192705.64 UDP-N-acetyl-alpha-D-galactosamine-13C16[-H+]- 25599.91 63124.20 UDP-N-acetyl-alpha-D-galactosamine-13C2[-H+]- 55061.19 270127.60 UDP-N-acetyl-alpha-D-galactosamine-13C3[-H+]- 26507.94 51871.63 UDP-N-acetyl-alpha-D-galactosamine-13C4[-H+]- 33914.59 59791.75 UDP-N-acetyl-alpha-D-galactosamine-13C5[-H+]- 1275641.65 2615399.67 123560.77 54319.54 UDP-N-acetyl-alpha-D-galactosamine-13C6[-H+]- 3428386.48 7656771.93 1266671.41 1058885.08 UDP-N-acetyl-alpha-D-galactosamine-13C7[-H+]- 136014.59 284310.43 UDP-N-acetyl-alpha-D-galactosamine-13C8[-H+]- 1085061.84 2799096.02 34501.43 13822.97 UDP-N-acetyl-alpha-D-galactosamine-13C9[-H+]- 4519.73 UMP-13C0[-H+]- 13045811.23 17910351.02 13377484.40 11387445.40 UMP-13C1[-H+]- 143020.54 86418.44 UMP-13C2[-H+]- 15226.08 UMP-13C3[-H+]- 68369.78 122430.23 60497.53 27803.97 UMP-13C4[-H+]- 97045.64 178227.50 101695.38 39164.53 UMP-13C5[-H+]- 8251528.02 9868259.54 6541810.99 2684714.22 UMP-13C6[-H+]- 890876.54 1262953.09 640077.24 99121.59 UMP-13C7[-H+]- 969588.76 1452722.01 713407.86 113334.58 UMP-13C8[-H+]- 246462.00 476661.86 161479.47 34020.71 Uracil-13C0[-H+]- 3219194.48 4441909.64 846790.89 636467.10 Uracil-13C1[-H+]- Uracil-13C2[-H+]- 31879.57 51391.93 Uracil-13C3[-H+]- 5115.59 Uric acid-13C0[-H+]- 7001675.97 7110217.53 572204.11 656928.06 Uric acid-13C1[-H+]- Uridine diphosphate-N-acetylglucosamine-13C0[-H+]- 965453.69 1861020.15 100433.10 68310.25 Uridine diphosphate-N-acetylglucosamine-13C1[-H+]- Uridine diphosphate-N-acetylglucosamine-13C10[-H+]- 22673.96 25054.30 4318.55 Uridine diphosphate-N-acetylglucosamine-13C11[-H+]- 320840.10 471208.22 50566.95 28477.44 Uridine diphosphate-N-acetylglucosamine-13C12[-H+]- 46097.62 93522.57 Uridine diphosphate-N-acetylglucosamine-13C13[-H+]- 220088.56 321753.27 9307.01 Uridine diphosphate-N-acetylglucosamine-13C14[-H+]- 41085.35 57864.60 3279.89 Uridine diphosphate-N-acetylglucosamine-13C15[-H+]- 39543.82 34827.53 Uridine diphosphate-N-acetylglucosamine-13C16[-H+]- 15299.85 Uridine diphosphate-N-acetylglucosamine-13C2[-H+]- 13454.48 59331.95 Uridine diphosphate-N-acetylglucosamine-13C3[-H+]- 6923.34 Uridine diphosphate-N-acetylglucosamine-13C4[-H+]- 16102.12 11924.44 Uridine diphosphate-N-acetylglucosamine-13C5[-H+]- 340239.53 547391.84 33695.98 17588.41 Uridine diphosphate-N-acetylglucosamine-13C6[-H+]- 873012.35 1364828.80 279738.36 254842.60 Uridine diphosphate-N-acetylglucosamine-13C7[-H+]- 62562.18 87031.68 Uridine diphosphate-N-acetylglucosamine-13C8[-H+]- 316611.84 614303.55 18673.73 Uridine diphosphate-N-acetylglucosamine-13C9[-H+]- 1832.89 3860.17 UTP-13C0[-H+]- 10536.09 28614.70 12763.42 XMP-13C0[-H+]- 315181.15 423165.19 32060.83 12499.20 XMP-13C1[-H+]- 22394.59 21336.72 XMP-13C2[-H+]- 8737.88 2845.13 XMP-13C3[-H+]- 17697.26 17852.32 XMP-13C4[-H+]- 4621.55 7201.80 XMP-13C5[-H+]- 3186.64 metabolite_name assignment%method compound corrected_mz formula isotopologue isotopologue%type retention_time(min) (S)-Methylmalonic acid semialdehyde-13C0[-H+]- database (S)-Methylmalonic acid semialdehyde_2-Ketobutyric acid_2-Methyl-3-oxopropanoic acid_Succinic acid semialdehyde 101.02442 C4H6O3 13C0 13C 2.57 (S)-Methylmalonic acid semialdehyde-13C3[-H+]- database (S)-Methylmalonic acid semialdehyde_2-Ketobutyric acid_2-Methyl-3-oxopropanoic acid_Succinic acid semialdehyde 104.03448 C4H6O3 13C3 13C 2.57, 2.59 (S)-Methylmalonic acid semialdehyde-13C4[-H+]- database (S)-Methylmalonic acid semialdehyde_2-Ketobutyric acid_2-Methyl-3-oxopropanoic acid_Succinic acid semialdehyde 105.03784 C4H6O3 13C4 13C 2.38, 2.57 13BPG-13C3[-H+]- indirectly to standard 13BPG 267.96205 C3H8O10P2 13C3 13C 36.19 1-Pyrroline-2-carboxylic acid-13C0[-H+]- database 1-Pyrroline-2-carboxylic acid_1-Pyrroline-5-carboxylic acid 112.0404 C5H7N1O2 13C0 13C 20.35 1-Pyrroline-2-carboxylic acid-13C2[-H+]- database 1-Pyrroline-2-carboxylic acid_1-Pyrroline-5-carboxylic acid 114.04711 C5H7N1O2 13C2 13C 20.35 1-Pyrroline-2-carboxylic acid-13C3[-H+]- database 1-Pyrroline-2-carboxylic acid_1-Pyrroline-5-carboxylic acid 115.05046 C5H7N1O2 13C3 13C 20.35 2HG-13C0[-H+]- database 2HG 147.0299 C5H8O5 13C0 13C 16.11 2HG-13C1[-H+]- database 2HG 148.03325 C5H8O5 13C1 13C 16.11 2HG-13C2[-H+]- database 2HG 149.03661 C5H8O5 13C2 13C 16.11 2HG-13C3[-H+]- database 2HG 150.03996 C5H8O5 13C3 13C 16.11 2HG-13C4[-H+]- database 2HG 151.04332 C5H8O5 13C4 13C 16.11 2HG-13C5[-H+]- database 2HG 152.04667 C5H8O5 13C5 13C 16.11 3PG-13C0[-H+]- directly to standard 3PG 184.98566 C3H7O7P 13C0 13C 26.76 3PG-13C3[-H+]- indirectly to standard 3PG 187.99572 C3H7O7P 13C3 13C 26.71 ADP-13C0[-H+]- directly to standard ADP 426.02214 C10H15N5O10P2 13C0 13C 32.76 ADP-13C1[-H+]- indirectly to standard ADP 427.02549 C10H15N5O10P2 13C1 13C 32.74 ADP-13C2[-H+]- indirectly to standard ADP 428.02885 C10H15N5O10P2 13C2 13C 32.76 ADP-13C3[-H+]- indirectly to standard ADP 429.0322 C10H15N5O10P2 13C3 13C 32.72 ADP-13C4[-H+]- indirectly to standard ADP 430.03556 C10H15N5O10P2 13C4 13C 32.76 ADP-13C5[-H+]- indirectly to standard ADP 431.03891 C10H15N5O10P2 13C5 13C 32.76 ADP-13C6[-H+]- indirectly to standard ADP 432.04227 C10H15N5O10P2 13C6 13C 32.76 aKG-13C0[-H+]- directly to standard aKG 145.01425 C5H6O5 13C0 13C 19.22 aKG-13C1[-H+]- indirectly to standard aKG 146.0176 C5H6O5 13C1 13C 19.22 aKG-13C2[-H+]- indirectly to standard aKG 147.02096 C5H6O5 13C2 13C 19.22 aKG-13C3[-H+]- indirectly to standard aKG 148.02431 C5H6O5 13C3 13C 19.22 aKG-13C4[-H+]- indirectly to standard aKG 149.02767 C5H6O5 13C4 13C 19.22 aKG-13C5[-H+]- indirectly to standard aKG 150.03102 C5H6O5 13C5 13C 19.22 Aminofructose 6-phosphate-13C0[-H+]- database Aminofructose 6-phosphate_Glucosamine 6-phosphate 258.03843 C6H14N1O8P 13C0 13C 13.44 Aminofructose 6-phosphate-13C1[-H+]- database Aminofructose 6-phosphate_Glucosamine 6-phosphate 259.04178 C6H14N1O8P 13C1 13C 13.44 Aminofructose 6-phosphate-13C2[-H+]- database Aminofructose 6-phosphate_Glucosamine 6-phosphate 260.04514 C6H14N1O8P 13C2 13C 13.52 Aminofructose 6-phosphate-13C3[-H+]- database Aminofructose 6-phosphate_Glucosamine 6-phosphate 261.04849 C6H14N1O8P 13C3 13C 13.44 Aminofructose 6-phosphate-13C4[-H+]- database Aminofructose 6-phosphate_Glucosamine 6-phosphate 262.05185 C6H14N1O8P 13C4 13C 13.39 Aminofructose 6-phosphate-13C6[-H+]- database Aminofructose 6-phosphate_Glucosamine 6-phosphate 264.05856 C6H14N1O8P 13C6 13C 13.39 AMP-13C0[-H+]- directly to standard AMP 346.05581 C10H14N5O7P 13C0 13C 21.1 AMP-13C1[-H+]- indirectly to standard AMP 347.05916 C10H14N5O7P 13C1 13C 21.1 AMP-13C2[-H+]- indirectly to standard AMP 348.06252 C10H14N5O7P 13C2 13C 21.1 AMP-13C3[-H+]- indirectly to standard AMP 349.06587 C10H14N5O7P 13C3 13C 21.1 AMP-13C4[-H+]- indirectly to standard AMP 350.06923 C10H14N5O7P 13C4 13C 21.1 AMP-13C5[-H+]- indirectly to standard AMP 351.07258 C10H14N5O7P 13C5 13C 21.1 AMP-13C6[-H+]- indirectly to standard AMP 352.07594 C10H14N5O7P 13C6 13C 21.1 ATP-13C0[-H+]- directly to standard ATP 505.98847 C10H16N5O13P3 13C0 13C 37.81 ATP-13C1[-H+]- indirectly to standard ATP 506.99182 C10H16N5O13P3 13C1 13C 37.81 ATP-13C2[-H+]- indirectly to standard ATP 507.99518 C10H16N5O13P3 13C2 13C 37.81 ATP-13C3[-H+]- indirectly to standard ATP 508.99853 C10H16N5O13P3 13C3 13C 37.81 ATP-13C4[-H+]- indirectly to standard ATP 510.00189 C10H16N5O13P3 13C4 13C 37.81 ATP-13C5[-H+]- indirectly to standard ATP 511.00524 C10H16N5O13P3 13C5 13C 37.83 ATP-13C6[-H+]- indirectly to standard ATP 512.0086 C10H16N5O13P3 13C6 13C 37.83 CDP-13C0[-H+]- directly to standard CDP 402.0109 C9H15N3O11P2 13C0 13C 28.23 CDP-13C5[-H+]- indirectly to standard CDP 407.02767 C9H15N3O11P2 13C5 13C 28.16 cis-Aconitate-13C0[-H+]- directly to standard cis-Aconitate 173.00916 C6H6O6 13C0 13C 35.43 cis-Aconitate-13C1[-H+]- indirectly to standard cis-Aconitate 174.01251 C6H6O6 13C1 13C 35.43 Citrate-13C0[-H+]- directly to standard Citrate 191.01973 C6H8O7 13C0 13C 28.57 Citrate-13C1[-H+]- indirectly to standard Citrate 192.02308 C6H8O7 13C1 13C 28.55 Citrate-13C2[-H+]- indirectly to standard Citrate 193.02644 C6H8O7 13C2 13C 28.57 Citrate-13C3[-H+]- indirectly to standard Citrate 194.02979 C6H8O7 13C3 13C 28.59 Citrate-13C4[-H+]- indirectly to standard Citrate 195.03315 C6H8O7 13C4 13C 28.57 Citrate-13C5[-H+]- indirectly to standard Citrate 196.0365 C6H8O7 13C5 13C 28.55 Citrate-13C6[-H+]- indirectly to standard Citrate 197.03986 C6H8O7 13C6 13C 28.55 CMP -13C6[-H+]- indirectly to standard CMP 328.0647 C9H14N3O8P 13C6 13C 16.32 CMP -13C7[-H+]- indirectly to standard CMP 329.06805 C9H14N3O8P 13C7 13C 16.32 CMP-13C0[-H+]- directly to standard CMP 322.04457 C9H14N3O8P 13C0 13C 16.17, 16.22 CMP-13C1[-H+]- indirectly to standard CMP 323.04792 C9H14N3O8P 13C1 13C 16.17 CMP-13C2[-H+]- indirectly to standard CMP 324.05128 C9H14N3O8P 13C2 13C 16.17 CMP-13C5[-H+]- indirectly to standard CMP 327.06134 C9H14N3O8P 13C5 13C 16.17, 16.32 CTP-13C0[-H+]- directly to standard CTP 481.97723 C9H16N3O14P3 13C0 13C 34.62 Cyclic AMP-13C0[-H+]- directly to standard Cyclic AMP 328.04524 C10H12N5O6P 13C0 13C 19.5 Cyclic AMP-13C1[-H+]- indirectly to standard Cyclic AMP 329.04859 C10H12N5O6P 13C1 13C 19.52 Cyclic AMP-13C2[-H+]- indirectly to standard Cyclic AMP 330.05195 C10H12N5O6P 13C2 13C 19.52 Cyclic AMP-13C3[-H+]- indirectly to standard Cyclic AMP 331.0553 C10H12N5O6P 13C3 13C 19.52 Cyclic AMP-13C4[-H+]- indirectly to standard Cyclic AMP 332.05866 C10H12N5O6P 13C4 13C 19.52 Cyclic AMP-13C5[-H+]- indirectly to standard Cyclic AMP 333.06201 C10H12N5O6P 13C5 13C 19.45 Cyclic AMP-13C6[-H+]- indirectly to standard Cyclic AMP 334.06537 C10H12N5O6P 13C6 13C 19.54 Cyclic AMP-13C8[-H+]- indirectly to standard Cyclic AMP 336.07208 C10H12N5O6P 13C8 13C 19.52 Deoxycytidine-13C0[-H+]- directly to standard Deoxycytidine 226.08333 C9H13N3O4 13C0 13C 30.17 Deoxycytidine-13C1[-H+]- indirectly to standard Deoxycytidine 227.08668 C9H13N3O4 13C1 13C 30.28 Deoxycytidine-13C2[-H+]- indirectly to standard Deoxycytidine 228.09004 C9H13N3O4 13C2 13C 30.28 Deoxycytidine-13C3[-H+]- indirectly to standard Deoxycytidine 229.09339 C9H13N3O4 13C3 13C 30.28 Deoxycytidine-13C4[-H+]- indirectly to standard Deoxycytidine 230.09675 C9H13N3O4 13C4 13C 30.28 dGDP-13C0[-H+]- directly to standard dGDP 426.02214 C10H15N5O10P2 13C0 13C 32.76 dGDP-13C1[-H+]- indirectly to standard dGDP 427.02549 C10H15N5O10P2 13C1 13C 32.74 dGDP-13C2[-H+]- indirectly to standard dGDP 428.02885 C10H15N5O10P2 13C2 13C 32.76 dGDP-13C3[-H+]- indirectly to standard dGDP 429.0322 C10H15N5O10P2 13C3 13C 32.72 dGDP-13C4[-H+]- indirectly to standard dGDP 430.03556 C10H15N5O10P2 13C4 13C 32.76 dGDP-13C5[-H+]- indirectly to standard dGDP 431.03891 C10H15N5O10P2 13C5 13C 32.76 dGDP-13C6[-H+]- indirectly to standard dGDP 432.04227 C10H15N5O10P2 13C6 13C 32.76 D-Glucuronic acid 1-phosphate-13C0[-H+]- database D-Glucuronic acid 1-phosphate 273.00171 C6H11O10P 13C0 13C 26.48 D-Glucuronic acid 1-phosphate-13C6[-H+]- database D-Glucuronic acid 1-phosphate 279.02184 C6H11O10P 13C6 13C 26.48 dGTP-13C0[-H+]- directly to standard dGTP 505.98847 C10H16N5O13P3 13C0 13C 37.81 dGTP-13C1[-H+]- indirectly to standard dGTP 506.99182 C10H16N5O13P3 13C1 13C 37.78 dGTP-13C2[-H+]- indirectly to standard dGTP 507.99518 C10H16N5O13P3 13C2 13C 37.78 dGTP-13C3[-H+]- indirectly to standard dGTP 508.99853 C10H16N5O13P3 13C3 13C 37.78 dGTP-13C4[-H+]- indirectly to standard dGTP 510.00189 C10H16N5O13P3 13C4 13C 37.78 dGTP-13C5[-H+]- indirectly to standard dGTP 511.00524 C10H16N5O13P3 13C5 13C 37.83 dGTP-13C6[-H+]- indirectly to standard dGTP 512.0086 C10H16N5O13P3 13C6 13C 37.83 D-Ribose and L-Arabinose-13C0[-H+]- directly to standard D-Ribose and L-Arabinose 149.04555 C5H10O5 13C0 13C 2.42 D-Ribose and L-Arabinose-13C5[-H+]- indirectly to standard D-Ribose and L-Arabinose 154.06232 C5H10O5 13C5 13C 2.42 D-Ribulose 5-phosphate -13C0[-H+]- directly to standard D-Ribulose 5-phosphate 229.01188 C5H11O8P 13C0 13C 20.43 D-Ribulose 5-phosphate -13C3[-H+]- indirectly to standard D-Ribulose 5-phosphate 232.02194 C5H11O8P 13C3 13C 20.43 D-Ribulose 5-phosphate -13C4[-H+]- indirectly to standard D-Ribulose 5-phosphate 233.0253 C5H11O8P 13C4 13C 20.43 D-Ribulose 5-phosphate -13C5[-H+]- indirectly to standard D-Ribulose 5-phosphate 234.02865 C5H11O8P 13C5 13C 20.43 dTMP-13C0[-H+]- directly to standard dTMP 321.04933 C10H15N2O8P 13C0 13C 28.72 D-Xylose-13C0[-H+]- directly to standard D-Xylose_D-Xylulose 149.04555 C5H10O5 13C0 13C 2.42 D-Xylose-13C5[-H+]- indirectly to standard D-Xylose_D-Xylulose 154.06232 C5H10O5 13C5 13C 2.42 E4P-13C0[-H+]- directly to standard E4P 199.00131 C4H9O7P 13C0 13C 32.8 E4P-13C4[-H+]- indirectly to standard E4P 203.01473 C4H9O7P 13C4 13C 32.8 Erythrose-13C0[-H+]- database Erythrose 119.03498 C4H8O4 13C0 13C 6.79 Erythrose-13C4[-H+]- database Erythrose 123.0484 C4H8O4 13C4 13C 6.84 F16P-13C5[-H+]- indirectly to standard F16P 344.00554 C6H14O12P2 13C5 13C 34.05 F16P-13C6[-H+]- indirectly to standard F16P 345.0089 C6H14O12P2 13C6 13C 34.05 F26P-13C0[-H+]- database F26P 338.98877 C6H14O12P2 13C0 13C 39.83 F26P-13C1[-H+]- database F26P 339.99212 C6H14O12P2 13C1 13C 39.81 F6P-13C5[-H+]- indirectly to standard F6P 264.03921 C6H13O9P 13C5 13C 19.35 F6P-13C6[-H+]- indirectly to standard F6P 265.04257 C6H13O9P 13C6 13C 19.35 Fumarate-13C0[-H+]- directly to standard Fumarate 115.00368 C4H4O4 13C0 13C 20.36 Fumarate-13C1[-H+]- indirectly to standard Fumarate 116.00703 C4H4O4 13C1 13C 20.36 Fumarate-13C2[-H+]- indirectly to standard Fumarate 117.01039 C4H4O4 13C2 13C 20.34 Fumarate-13C3[-H+]- indirectly to standard Fumarate 118.01374 C4H4O4 13C3 13C 20.3 Fumarate-13C4[-H+]- indirectly to standard Fumarate 119.0171 C4H4O4 13C4 13C 20.3 G1P-13C0[-H+]- directly to standard G1P 259.02244 C6H13O9P 13C0 13C 15.2 G1P-13C5[-H+]- indirectly to standard G1P 264.03921 C6H13O9P 13C5 13C 15.15 G1P-13C6[-H+]- indirectly to standard G1P 265.04257 C6H13O9P 13C6 13C 15.15 G6P-13C0[-H+]- directly to standard G6P 259.02244 C6H13O9P 13C0 13C 18.87 G6P-13C4[-H+]- indirectly to standard G6P 263.03586 C6H13O9P 13C4 13C 18.87 G6P-13C5[-H+]- indirectly to standard G6P 264.03921 C6H13O9P 13C5 13C 18.87 G6P-13C6[-H+]- indirectly to standard G6P 265.04257 C6H13O9P 13C6 13C 18.87 GalactitolAndSorbitol-13C0[-H+]- directly to standard GalactitolAndSorbitol 181.07176 C6H14O6 13C0 13C 2.24 GalactitolAndSorbitol-13C1[-H+]- indirectly to standard GalactitolAndSorbitol 182.07511 C6H14O6 13C1 13C 2.24 GalactitolAndSorbitol-13C4[-H+]- indirectly to standard GalactitolAndSorbitol 185.08518 C6H14O6 13C4 13C 2.24 GalactitolAndSorbitol-13C5[-H+]- indirectly to standard GalactitolAndSorbitol 186.08853 C6H14O6 13C5 13C 2.24 GalactitolAndSorbitol-13C6[-H+]- indirectly to standard GalactitolAndSorbitol 187.09189 C6H14O6 13C6 13C 2.24 Galactose 6-phosphate-13C0[-H+]- directly to standard Galactose 6-phosphate 259.02244 C6H13O9P 13C0 13C 17.84 Galactose 6-phosphate-13C3[-H+]- indirectly to standard Galactose 6-phosphate 262.0325 C6H13O9P 13C3 13C 17.84 Galactose 6-phosphate-13C5[-H+]- indirectly to standard Galactose 6-phosphate 264.03921 C6H13O9P 13C5 13C 17.77 Galactose 6-phosphate-13C6[-H+]- indirectly to standard Galactose 6-phosphate 265.04257 C6H13O9P 13C6 13C 17.77 Galacturonic acid-13C0[-H+]- database Galacturonic acid_D-Glucuronic acid 193.03538 C6H10O7 13C0 13C 10.78 Galacturonic acid-13C1[-H+]- database Galacturonic acid_D-Glucuronic acid 194.03873 C6H10O7 13C1 13C 10.78 Galacturonic acid-13C5[-H+]- database Galacturonic acid_D-Glucuronic acid 198.05215 C6H10O7 13C5 13C 10.78 Galacturonic acid-13C6[-H+]- database Galacturonic acid_D-Glucuronic acid 199.05551 C6H10O7 13C6 13C 10.73 GDP-13C0[-H+]- directly to standard GDP 442.01705 C10H15N5O11P2 13C0 13C 40.43 GDP-13C5[-H+]- indirectly to standard GDP 447.03382 C10H15N5O11P2 13C5 13C 40.41 Glyceric acid-13C0[-H+]- database Glyceric acid 105.01933 C3H6O4 13C0 13C 26.69 Glyceric acid-13C3[-H+]- database Glyceric acid 108.02939 C3H6O4 13C3 13C 26.71 GMP -13C0[-H+]- directly to standard GMP 362.05072 C10H14N5O8P 13C0 13C 35.35 GMP -13C1[-H+]- indirectly to standard GMP 363.05407 C10H14N5O8P 13C1 13C 35.35 GMP -13C4[-H+]- indirectly to standard GMP 366.06414 C10H14N5O8P 13C4 13C 35.35 GMP -13C5[-H+]- indirectly to standard GMP 367.06749 C10H14N5O8P 13C5 13C 35.35 GMP -13C6[-H+]- indirectly to standard GMP 368.07085 C10H14N5O8P 13C6 13C 35.35 GMP -13C9[-H+]- indirectly to standard GMP 371.08091 C10H14N5O8P 13C9 13C 35.35 GSH-13C0[-H+]- directly to standard GSH 306.07653 C10H17N3O6S 13C0 13C 25.5 GSH-13C1[-H+]- indirectly to standard GSH 307.07988 C10H17N3O6S 13C1 13C 25.48 GSH-13C2[-H+]- indirectly to standard GSH 308.08324 C10H17N3O6S 13C2 13C 25.5 GSH-13C3[-H+]- indirectly to standard GSH 309.08659 C10H17N3O6S 13C3 13C 25.44 GSH-13C4[-H+]- indirectly to standard GSH 310.08995 C10H17N3O6S 13C4 13C 25.44 GSH-13C5[-H+]- indirectly to standard GSH 311.0933 C10H17N3O6S 13C5 13C 25.5 GSH-13C6[-H+]- indirectly to standard GSH 312.09666 C10H17N3O6S 13C6 13C 25.5 GTP-13C0[-H+]- directly to standard GTP 521.98338 C10H16N5O14P3 13C0 13C 44.03 GTP-13C5[-H+]- indirectly to standard GTP 527.00015 C10H16N5O14P3 13C5 13C 44.03 Gulonic and Galactonic and Gluconic acid-13C0[-H+]- database Gulonic and Galactonic and Gluconic acid 195.05103 C6H12O7 13C0 13C 6.75 Gulonic and Galactonic and Gluconic acid-13C1[-H+]- database Gulonic and Galactonic and Gluconic acid 196.05438 C6H12O7 13C1 13C 6.7 Gulonic and Galactonic and Gluconic acid-13C3[-H+]- database Gulonic and Galactonic and Gluconic acid 198.06109 C6H12O7 13C3 13C 6.7 Gulonic and Galactonic and Gluconic acid-13C4[-H+]- database Gulonic and Galactonic and Gluconic acid 199.06445 C6H12O7 13C4 13C 6.7 Gulonic and Galactonic and Gluconic acid-13C5[-H+]- database Gulonic and Galactonic and Gluconic acid 200.0678 C6H12O7 13C5 13C 6.75 Gulonic and Galactonic and Gluconic acid-13C6[-H+]- database Gulonic and Galactonic and Gluconic acid 201.07116 C6H12O7 13C6 13C 6.75 Hexoses-13C0[-H+]- directly to standard Hexoses 179.05611 C6H12O6 13C0 13C 2.2 Hexoses-13C1[-H+]- indirectly to standard Hexoses 180.05946 C6H12O6 13C1 13C 2.24 Hexoses-13C2[-H+]- indirectly to standard Hexoses 181.06282 C6H12O6 13C2 13C 2.27 Hexoses-13C5[-H+]- indirectly to standard Hexoses 184.07288 C6H12O6 13C5 13C 2.27 Hexoses-13C6[-H+]- indirectly to standard Hexoses 185.07624 C6H12O6 13C6 13C 2.53 IMP-13C0[-H+]- directly to standard IMP 347.03982 C10H13N4O8P 13C0 13C 34.6 IMP-13C5[-H+]- indirectly to standard IMP 352.05659 C10H13N4O8P 13C5 13C 34.6 Isocitrate-13C0[-H+]- directly to standard Isocitrate 191.01973 C6H8O7 13C0 13C 29.01 Isocitrate-13C2[-H+]- indirectly to standard Isocitrate 193.02644 C6H8O7 13C2 13C 29.01 Itaconic acid-13C0[-H+]- directly to standard Itaconic acid 129.01933 C5H6O4 13C0 13C 17.88 Lactate-13C0[-H+]- directly to standard Lactate 89.02442 C3H6O3 13C0 13C 7.05 Lactate-13C1[-H+]- indirectly to standard Lactate 90.02777 C3H6O3 13C1 13C 7.05 Lactate-13C2[-H+]- indirectly to standard Lactate 91.03113 C3H6O3 13C2 13C 6.99 Lactate-13C3[-H+]- indirectly to standard Lactate 92.03448 C3H6O3 13C3 13C 7.05 L-Aspartic acid-13C0[-H+]- directly to standard L-Aspartic acid 132.03023 C4H7N1O4 13C0 13C 15.46 L-Aspartic acid-13C1[-H+]- indirectly to standard L-Aspartic acid 133.03358 C4H7N1O4 13C1 13C 15.44 L-Aspartic acid-13C2[-H+]- indirectly to standard L-Aspartic acid 134.03694 C4H7N1O4 13C2 13C 15.5 L-Aspartic acid-13C3[-H+]- indirectly to standard L-Aspartic acid 135.04029 C4H7N1O4 13C3 13C 15.46 L-Aspartic acid-13C4[-H+]- indirectly to standard L-Aspartic acid 136.04365 C4H7N1O4 13C4 13C 15.3 L-Glutamic acid-13C0[-H+]- directly to standard L-Glutamic acid 146.04588 C5H9N1O4 13C0 13C 18.18 L-Glutamic acid-13C1[-H+]- indirectly to standard L-Glutamic acid 147.04923 C5H9N1O4 13C1 13C 18.23 L-Glutamic acid-13C2[-H+]- indirectly to standard L-Glutamic acid 148.05259 C5H9N1O4 13C2 13C 18.23 L-Glutamic acid-13C3[-H+]- indirectly to standard L-Glutamic acid 149.05594 C5H9N1O4 13C3 13C 18.23 L-Glutamic acid-13C4[-H+]- indirectly to standard L-Glutamic acid 150.0593 C5H9N1O4 13C4 13C 18.16 L-Glutamic acid-13C5[-H+]- indirectly to standard L-Glutamic acid 151.06265 C5H9N1O4 13C5 13C 18.21 L-Xylonate-13C0[-H+]- database L-Xylonate 165.04046 C5H10O6 13C0 13C 6.77 L-Xylonate-13C4[-H+]- database L-Xylonate 169.05388 C5H10O6 13C4 13C 6.77 L-Xylonate-13C5[-H+]- database L-Xylonate 170.05723 C5H10O6 13C5 13C 6.79 Malate-13C0[-H+]- directly to standard Malate 133.01425 C4H6O5 13C0 13C 16.5 Malate-13C1[-H+]- indirectly to standard Malate 134.0176 C4H6O5 13C1 13C 16.5 Malate-13C2[-H+]- indirectly to standard Malate 135.02096 C4H6O5 13C2 13C 16.5 Malate-13C3[-H+]- indirectly to standard Malate 136.02431 C4H6O5 13C3 13C 16.5 Malate-13C4[-H+]- indirectly to standard Malate 137.02767 C4H6O5 13C4 13C 16.5 Mannose 6-phosphate-13C0[-H+]- directly to standard Mannose 6-phosphate 259.02244 C6H13O9P 13C0 13C 19.89 Mannose 6-phosphate-13C5[-H+]- indirectly to standard Mannose 6-phosphate 264.03921 C6H13O9P 13C5 13C 19.76 Mannose 6-phosphate-13C6[-H+]- indirectly to standard Mannose 6-phosphate 265.04257 C6H13O9P 13C6 13C 19.8 N-Acetylglutamic acid -13C0[-H+]- database N-Acetylglutamic acid 188.05645 C7H11N1O5 13C0 13C 14.54 N-Acetylglutamic acid -13C1[-H+]- database N-Acetylglutamic acid 189.0598 C7H11N1O5 13C1 13C 14.57 N-Acetylglutamic acid -13C2[-H+]- database N-Acetylglutamic acid 190.06316 C7H11N1O5 13C2 13C 14.54 N-Acetylglutamic acid -13C3[-H+]- database N-Acetylglutamic acid 191.06651 C7H11N1O5 13C3 13C 14.59 N-Acetylglutamic acid -13C4[-H+]- database N-Acetylglutamic acid 192.06987 C7H11N1O5 13C4 13C 14.5 N-Acetylglutamic acid -13C5[-H+]- database N-Acetylglutamic acid 193.07322 C7H11N1O5 13C5 13C 14.57 N-Acetylglutamic acid -13C6[-H+]- database N-Acetylglutamic acid 194.07658 C7H11N1O5 13C6 13C 14.57 N-Acetylglutamic acid -13C7[-H+]- database N-Acetylglutamic acid 195.07993 C7H11N1O5 13C7 13C 14.57 NADH-13C0[-H+]- directly to standard NADH 664.11749 C21H29N7O14P2 13C0 13C 28.4 NADH-13C10[-H+]- indirectly to standard NADH 674.15104 C21H29N7O14P2 13C10 13C 28.42 NADH-13C11[-H+]- indirectly to standard NADH 675.15439 C21H29N7O14P2 13C11 13C 28.4 NADH-13C3[-H+]- indirectly to standard NADH 667.12755 C21H29N7O14P2 13C3 13C 28.4 NADH-13C4[-H+]- indirectly to standard NADH 668.13091 C21H29N7O14P2 13C4 13C 28.4 NADH-13C5[-H+]- indirectly to standard NADH 669.13426 C21H29N7O14P2 13C5 13C 28.38 NADH-13C6[-H+]- indirectly to standard NADH 670.13762 C21H29N7O14P2 13C6 13C 28.4 NADH-13C7[-H+]- indirectly to standard NADH 671.14097 C21H29N7O14P2 13C7 13C 28.4 NADH-13C8[-H+]- indirectly to standard NADH 672.14433 C21H29N7O14P2 13C8 13C 28.4 NADH-13C9[-H+]- indirectly to standard NADH 673.14768 C21H29N7O14P2 13C9 13C 28.4 Pantothenic acid-13C0[-H+]- database Pantothenic acid 218.1034 C9H17N1O5 13C0 13C 7.05 Pantothenic acid-13C1[-H+]- database Pantothenic acid 219.10675 C9H17N1O5 13C1 13C 7.05 Pantothenic acid-13C2[-H+]- database Pantothenic acid 220.11011 C9H17N1O5 13C2 13C 7.05 PEP-13C3[-H+]- indirectly to standard PEP 169.98516 C3H5O6P 13C3 13C 30.32 Phosphocreatine-13C0[-H+]- directly to standard Phosphocreatine 210.02853 C4H10N3O5P 13C0 13C 12.49 Phosphocreatine-13C1[-H+]- indirectly to standard Phosphocreatine 211.03188 C4H10N3O5P 13C1 13C 12.46 Phosphoserine-13C0[-H+]- database Phosphoserine 184.00165 C3H8N1O6P 13C0 13C 24.99 Pyroglutamic acid-13C0[-H+]- directly to standard Pyroglutamic acid 128.03532 C5H7N1O3 13C0 13C 6.66 Pyroglutamic acid-13C1[-H+]- indirectly to standard Pyroglutamic acid 129.03867 C5H7N1O3 13C1 13C 6.66 Pyroglutamic acid-13C2[-H+]- indirectly to standard Pyroglutamic acid 130.04203 C5H7N1O3 13C2 13C 6.62 Pyroglutamic acid-13C3[-H+]- indirectly to standard Pyroglutamic acid 131.04538 C5H7N1O3 13C3 13C 6.66 Pyroglutamic acid-13C4[-H+]- indirectly to standard Pyroglutamic acid 132.04874 C5H7N1O3 13C4 13C 6.62 Pyroglutamic acid-13C5[-H+]- indirectly to standard Pyroglutamic acid 133.05209 C5H7N1O3 13C5 13C 6.62 Pyruvate-13C0[-H+]- directly to standard Pyruvate 87.00877 C3H4O3 13C0 13C 8.64 Pyruvate-13C1[-H+]- indirectly to standard Pyruvate 88.01212 C3H4O3 13C1 13C 8.64 Pyruvate-13C2[-H+]- indirectly to standard Pyruvate 89.01548 C3H4O3 13C2 13C 8.64 Pyruvate-13C3[-H+]- indirectly to standard Pyruvate 90.01883 C3H4O3 13C3 13C 8.64 R1P-13C0[-H+]- directly to standard R1P 229.01188 C5H11O8P 13C0 13C 14.31 R1P-13C5[-H+]- indirectly to standard R1P 234.02865 C5H11O8P 13C5 13C 14.31 R5P-13C0[-H+]- directly to standard R5P 229.01188 C5H11O8P 13C0 13C 20.43 R5P-13C3[-H+]- indirectly to standard R5P 232.02194 C5H11O8P 13C3 13C 20.43 R5P-13C4[-H+]- indirectly to standard R5P 233.0253 C5H11O8P 13C4 13C 20.43 R5P-13C5[-H+]- indirectly to standard R5P 234.02865 C5H11O8P 13C5 13C 20.43 S7P-13C0[-H+]- directly to standard S7P 289.03301 C7H15O10P 13C0 13C 21.01 S7P-13C2[-H+]- indirectly to standard S7P 291.03972 C7H15O10P 13C2 13C 21.01 S7P-13C5[-H+]- indirectly to standard S7P 294.04978 C7H15O10P 13C5 13C 21.01 S7P-13C6[-H+]- indirectly to standard S7P 295.05314 C7H15O10P 13C6 13C 21.01 S7P-13C7[-H+]- indirectly to standard S7P 296.05649 C7H15O10P 13C7 13C 20.99 Succinate-13C0[-H+]- directly to standard Succinate 117.01933 C4H6O4 13C0 13C 16.39 Succinate-13C1[-H+]- indirectly to standard Succinate 118.02268 C4H6O4 13C1 13C 16.39 Succinate-13C2[-H+]- indirectly to standard Succinate 119.02604 C4H6O4 13C2 13C 16.39 Succinate-13C3[-H+]- indirectly to standard Succinate 120.02939 C4H6O4 13C3 13C 16.41 Succinate-13C4[-H+]- indirectly to standard Succinate 121.03275 C4H6O4 13C4 13C 16.41 SucroseAndDischarrides-13C1[-H+]- indirectly to standard SucroseAndDischarrides 342.11228 C12H22O11 13C1 13C 2.68 SucroseAndDischarrides-13C11[-H+]- indirectly to standard SucroseAndDischarrides 352.14583 C12H22O11 13C11 13C 2.68 SucroseAndDischarrides-13C12[-H+]- indirectly to standard SucroseAndDischarrides 353.14919 C12H22O11 13C12 13C 2.68 SucroseAndDischarrides-13C6[-H+]- indirectly to standard SucroseAndDischarrides 347.12906 C12H22O11 13C6 13C 2.68 SucroseAndDischarrides-13C8[-H+]- indirectly to standard SucroseAndDischarrides 349.13577 C12H22O11 13C8 13C 2.68 Taurine-13C0[-H+]- database Taurine 124.00739 C2H7N1O3S 13C0 13C 7.12 Taurine-13C1[-H+]- database Taurine 125.01074 C2H7N1O3S 13C1 13C 7.14 UDP-13C0[-H+]- directly to standard UDP 402.99492 C9H14N2O12P2 13C0 13C 37.12 UDP-13C5[-H+]- indirectly to standard UDP 408.01169 C9H14N2O12P2 13C5 13C 37.16 UDP-13C7[-H+]- indirectly to standard UDP 410.0184 C9H14N2O12P2 13C7 13C 37.16 UDP-N-acetyl-alpha-D-galactosamine-13C0[-H+]- directly to standard UDP-N-acetyl-alpha-D-galactosamine 606.07429 C17H27N3O17P2 13C0 13C 29.37 UDP-N-acetyl-alpha-D-galactosamine-13C1[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 607.07764 C17H27N3O17P2 13C1 13C 29.37 UDP-N-acetyl-alpha-D-galactosamine-13C10[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 616.10784 C17H27N3O17P2 13C10 13C 29.31 UDP-N-acetyl-alpha-D-galactosamine-13C11[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 617.11119 C17H27N3O17P2 13C11 13C 29.31 UDP-N-acetyl-alpha-D-galactosamine-13C12[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 618.11455 C17H27N3O17P2 13C12 13C 29.29 UDP-N-acetyl-alpha-D-galactosamine-13C13[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 619.1179 C17H27N3O17P2 13C13 13C 29.31 UDP-N-acetyl-alpha-D-galactosamine-13C14[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 620.12126 C17H27N3O17P2 13C14 13C 29.31 UDP-N-acetyl-alpha-D-galactosamine-13C15[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 621.12461 C17H27N3O17P2 13C15 13C 29.31 UDP-N-acetyl-alpha-D-galactosamine-13C16[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 622.12797 C17H27N3O17P2 13C16 13C 29.31 UDP-N-acetyl-alpha-D-galactosamine-13C2[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 608.081 C17H27N3O17P2 13C2 13C 29.37 UDP-N-acetyl-alpha-D-galactosamine-13C3[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 609.08435 C17H27N3O17P2 13C3 13C 29.37 UDP-N-acetyl-alpha-D-galactosamine-13C4[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 610.08771 C17H27N3O17P2 13C4 13C 29.37 UDP-N-acetyl-alpha-D-galactosamine-13C5[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 611.09106 C17H27N3O17P2 13C5 13C 29.37 UDP-N-acetyl-alpha-D-galactosamine-13C6[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 612.09442 C17H27N3O17P2 13C6 13C 29.37 UDP-N-acetyl-alpha-D-galactosamine-13C7[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 613.09777 C17H27N3O17P2 13C7 13C 29.37 UDP-N-acetyl-alpha-D-galactosamine-13C8[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 614.10113 C17H27N3O17P2 13C8 13C 29.37 UDP-N-acetyl-alpha-D-galactosamine-13C9[-H+]- indirectly to standard UDP-N-acetyl-alpha-D-galactosamine 615.10448 C17H27N3O17P2 13C9 13C 29.31 UMP-13C0[-H+]- directly to standard UMP 323.02859 C9H13N2O9P 13C0 13C 31.01 UMP-13C1[-H+]- indirectly to standard UMP 324.03194 C9H13N2O9P 13C1 13C 30.99 UMP-13C2[-H+]- indirectly to standard UMP 325.0353 C9H13N2O9P 13C2 13C 30.99 UMP-13C3[-H+]- indirectly to standard UMP 326.03865 C9H13N2O9P 13C3 13C 30.99 UMP-13C4[-H+]- indirectly to standard UMP 327.04201 C9H13N2O9P 13C4 13C 30.95 UMP-13C5[-H+]- indirectly to standard UMP 328.04536 C9H13N2O9P 13C5 13C 30.97 UMP-13C6[-H+]- indirectly to standard UMP 329.04872 C9H13N2O9P 13C6 13C 30.99 UMP-13C7[-H+]- indirectly to standard UMP 330.05207 C9H13N2O9P 13C7 13C 30.97 UMP-13C8[-H+]- indirectly to standard UMP 331.05543 C9H13N2O9P 13C8 13C 31.01 Uracil-13C0[-H+]- directly to standard Uracil 111.02 C4H4N2O2 13C0 13C 29.33 Uracil-13C1[-H+]- indirectly to standard Uracil 112.02335 C4H4N2O2 13C1 13C 29.33 Uracil-13C2[-H+]- indirectly to standard Uracil 113.02671 C4H4N2O2 13C2 13C 29.33 Uracil-13C3[-H+]- indirectly to standard Uracil 114.03006 C4H4N2O2 13C3 13C 29.33 Uric acid-13C0[-H+]- database Uric acid 167.02106 C5H4N4O3 13C0 13C 28.94 Uric acid-13C1[-H+]- database Uric acid 168.02441 C5H4N4O3 13C1 13C 28.94 Uridine diphosphate-N-acetylglucosamine-13C0[-H+]- directly to standard Uridine diphosphate-N-acetylglucosamine 606.07429 C17H27N3O17P2 13C0 13C 28.92 Uridine diphosphate-N-acetylglucosamine-13C1[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 607.07764 C17H27N3O17P2 13C1 13C 28.92 Uridine diphosphate-N-acetylglucosamine-13C10[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 616.10784 C17H27N3O17P2 13C10 13C 28.9 Uridine diphosphate-N-acetylglucosamine-13C11[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 617.11119 C17H27N3O17P2 13C11 13C 28.83 Uridine diphosphate-N-acetylglucosamine-13C12[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 618.11455 C17H27N3O17P2 13C12 13C 28.9 Uridine diphosphate-N-acetylglucosamine-13C13[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 619.1179 C17H27N3O17P2 13C13 13C 28.9 Uridine diphosphate-N-acetylglucosamine-13C14[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 620.12126 C17H27N3O17P2 13C14 13C 28.9 Uridine diphosphate-N-acetylglucosamine-13C15[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 621.12461 C17H27N3O17P2 13C15 13C 28.9 Uridine diphosphate-N-acetylglucosamine-13C16[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 622.12797 C17H27N3O17P2 13C16 13C 28.9 Uridine diphosphate-N-acetylglucosamine-13C2[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 608.081 C17H27N3O17P2 13C2 13C 28.92 Uridine diphosphate-N-acetylglucosamine-13C3[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 609.08435 C17H27N3O17P2 13C3 13C 28.92 Uridine diphosphate-N-acetylglucosamine-13C4[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 610.08771 C17H27N3O17P2 13C4 13C 28.92 Uridine diphosphate-N-acetylglucosamine-13C5[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 611.09106 C17H27N3O17P2 13C5 13C 28.96 Uridine diphosphate-N-acetylglucosamine-13C6[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 612.09442 C17H27N3O17P2 13C6 13C 28.88 Uridine diphosphate-N-acetylglucosamine-13C7[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 613.09777 C17H27N3O17P2 13C7 13C 28.88 Uridine diphosphate-N-acetylglucosamine-13C8[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 614.10113 C17H27N3O17P2 13C8 13C 28.9 Uridine diphosphate-N-acetylglucosamine-13C9[-H+]- indirectly to standard Uridine diphosphate-N-acetylglucosamine 615.10448 C17H27N3O17P2 13C9 13C 28.9 UTP-13C0[-H+]- directly to standard UTP 482.96125 C9H15N2O15P3 13C0 13C 40.78 XMP-13C0[-H+]- database XMP 363.03474 C10H13N4O9P 13C0 13C 35.37 XMP-13C1[-H+]- database XMP 364.03809 C10H13N4O9P 13C1 13C 35.43 XMP-13C2[-H+]- database XMP 365.04145 C10H13N4O9P 13C2 13C 35.43 XMP-13C3[-H+]- database XMP 366.0448 C10H13N4O9P 13C3 13C 35.43 XMP-13C4[-H+]- database XMP 367.04816 C10H13N4O9P 13C4 13C 35.43 XMP-13C5[-H+]- database XMP 368.05151 C10H13N4O9P 13C5 13C 35.43