Data for ST003794
| Metabolite structure | All data | F1 | F2 | F3 | F4 |
|---|---|---|---|---|---|
| 2-Methylcitrate | 602991.00 | 409217.33 | 472749.50 | 434560.00 | |
| 3^,5^-Cyclic AMP | 135900.67 | 251425.00 | 148415.00 | 136468.00 | |
| 4-Acetamidobutanoate | 554952.00 | 57389.67 | 115422.50 | 110455.00 | |
| 5-10-Methenyltetrahydrofolate | 211065.17 | 46392.00 | 80256.00 | 44258.00 | |
| 5-6-Dihydrothymine | 2123195.50 | 2264239.00 | 1425235.00 | 1496257.00 | |
| 5-6-Dihydrouracil | 175434.67 | 155856.67 | 99084.50 | 137506.00 | |
| 5-Hydroxyisourate | 5488596.33 | 6211192.00 | 5188604.50 | 5207448.00 | |
| (5-L-Glutamyl)-L-glutamine | 240979.17 | 412387.33 | 381522.50 | 316832.00 | |
| 5-L-Glutamyl-taurine | 22285.33 | 198091.33 | 10753547.00 | 10529786.00 | |
| 6-Hydroxykynurenic acid | 122156.17 | 184088.00 | 58421.50 | 27236.00 | |
| 8-Methoxykynurenate | 229012.17 | 179423.33 | 128901.00 | 125509.00 | |
| acetyl-carnitine (acyl-C2) | 84477608.67 | 74332504.00 | 83930227.00 | 88523416.00 | |
| Acetylcholine | 25741677.67 | 24951699.33 | 20721278.00 | 20506688.00 | |
| acyl-C18:2 (Linoleoyl-CoA) | 10407693.50 | 8542261.33 | 9936608.50 | 8988575.00 | |
| acyl-C18:2-OH | 1728653.67 | 1529732.33 | 1898916.50 | 1727456.00 | |
| acyl-C20 | 109826.33 | 44778.67 | 92229.50 | 49239.00 | |
| acyl-C20:4 | 531232.17 | 480516.00 | 453055.50 | 393916.00 | |
| acyl-C4-DC | 19069305.33 | 26527257.33 | 23040107.00 | 22063216.00 | |
| acyl-C4-OH | 4652570.67 | 635177.67 | 800504.50 | 474418.00 | |
| acyl-C5:1 | 300902.00 | 137230.33 | 141133.00 | 157429.00 | |
| acyl-C5-OH | 6701537.50 | 1624861.67 | 1227417.00 | 824894.00 | |
| acyl-C6-DC | 318230.50 | 390254.33 | 352006.00 | 327764.00 | |
| Adenine | 175088.17 | 427799.67 | 386001.50 | 429412.00 | |
| Adenosine | 165484.17 | 587042.00 | 331226.50 | 312705.00 | |
| Adenylosuccinic acid | 97202.33 | 277873.67 | 206736.50 | 148772.00 | |
| ADP-D-ribose | 4542056.17 | 1423280.67 | 2260754.50 | 2022883.00 | |
| Allantoate | 198658.67 | 57766.00 | 109670.50 | 72834.00 | |
| alpha-D-Glucosamine 1-phosphate | 206939.50 | 319686.00 | 299848.00 | 270617.00 | |
| AMP | 44048043.00 | 134178128.00 | 125697112.00 | 125419800.00 | |
| Anthranilate | 936552.00 | 657912.67 | 677404.50 | 666859.00 | |
| Argininosuccinate | 77323.67 | 62061.67 | 25409.50 | 17966.00 | |
| Ascorbate | 87054.83 | 47429.67 | 53920.50 | 61478.00 | |
| Biliverdin | 150942.17 | 88905.00 | 123748.50 | 112771.00 | |
| Bis-gamma-glutamylcystine | 152074.83 | 135282.33 | 155742.00 | 159773.00 | |
| butanoyl-l-carnitine (acyl-C4) | 5172498.00 | 1266145.67 | 3314282.50 | 3091963.00 | |
| Carnosine | 1099264.50 | 1192698.00 | 1068352.00 | 1001756.00 | |
| CDP-choline | 295193.50 | 546379.00 | 499401.50 | 523697.00 | |
| Choline | 68376325.33 | 85272998.67 | 61745718.00 | 57943420.00 | |
| CMP | 111762.67 | 165210.67 | 155205.50 | 156821.00 | |
| CMP-N-acetylneuraminate | 4944455.33 | 7320966.00 | 3590115.00 | 3380196.00 | |
| Creatine | 116562071.33 | 133424034.67 | 128070040.00 | 126243112.00 | |
| Creatinine | 11966738.83 | 14254465.33 | 16038218.00 | 15794416.00 | |
| Cys-Gly | 1549736.00 | 2090964.00 | 1048648.50 | 1179690.00 | |
| Cytosine | 369785.33 | 1194174.33 | 992529.50 | 943279.00 | |
| dCMP | 295694.67 | 728107.33 | 662875.50 | 623284.00 | |
| Dehydroascorbate | 293239.17 | 61126.33 | 138569.00 | 104253.00 | |
| D-Glucosamine | 986419.17 | 1013729.33 | 1292408.50 | 1318231.00 | |
| Dihydrofolate | 187812.17 | 63303.67 | 184215.50 | 142516.00 | |
| Dimethylglycine | 1605117.50 | 747001.33 | 890734.00 | 772062.00 | |
| dTMP | 643978.33 | 752788.67 | 353762.50 | 256773.00 | |
| Ectoine | 228614.33 | 207978.00 | 210432.50 | 200150.00 | |
| Folate | 91279.67 | 29965.67 | 44808.00 | 117880.00 | |
| gamma-Glutamyl-gamma-aminobutyrate | 1066910.33 | 1876592.00 | 1021928.50 | 940087.00 | |
| gamma-L-Glutamyl-D-alanine | 452575.33 | 651873.33 | 535372.00 | 448473.00 | |
| gamma-L-Glutamyl-L-cysteine | 159809.83 | 786563.67 | 319361.50 | 275267.00 | |
| Glutathione | 210472633.50 | 271651825.33 | 158677964.00 | 175285296.00 | |
| Glutathione disulfide | 69599860.00 | 103939542.67 | 49522114.00 | 46512480.00 | |
| GMP | 762296.50 | 6888138.67 | 3020967.00 | 2816775.00 | |
| g-Oxalo-crotonate | 450008.50 | 964754.00 | 520873.00 | 662440.00 | |
| Guanine | 1508512.83 | 1550545.67 | 1700241.50 | 1522314.00 | |
| Guanosine | 23737.17 | 135624.33 | 23613.50 | 40374.00 | |
| Hexadecenoyl-carnitine (acyl-C16:1) | 1277407.50 | 1157609.00 | 1049097.00 | 779209.00 | |
| Hypoxanthine | 76078754.67 | 196945106.67 | 86539104.00 | 87588408.00 | |
| Indole-3-acetaldehyde | 98653.17 | 71598.33 | 112717.50 | 60469.00 | |
| Inosine | 1814971.50 | 6418266.00 | 2072567.50 | 1530401.00 | |
| kynurenine | 3620554.50 | 3695468.33 | 4657748.00 | 4602948.00 | |
| L-Adrenaline | 289153.67 | 229242.67 | 348280.00 | 241094.00 | |
| L-alanine | 6427232.67 | 5794765.00 | 5131496.00 | 4712234.00 | |
| L-arginine | 689454.50 | 1099988.33 | 1349145.50 | 1295247.00 | |
| L-asparagine | 968537.33 | 1219194.33 | 1219017.00 | 1166671.00 | |
| L-aspartate | 1362323.83 | 2302836.00 | 1952096.50 | 1928767.00 | |
| L-Carnitine | 65198542.67 | 75039772.00 | 83046036.00 | 80385376.00 | |
| L-Citrulline | 4117798.67 | 4076870.33 | 4470863.50 | 4317126.00 | |
| L-Cysteate | 64702.00 | 40643.33 | 50421.00 | 75262.00 | |
| L-cysteine | 157658.33 | 41400.67 | 223986.50 | 137434.00 | |
| L-glutamate | 13226258.17 | 17659393.00 | 14838041.00 | 13898365.00 | |
| L-glutamine | 11965057.33 | 11386465.00 | 11320346.50 | 10840696.00 | |
| L-histidine | 2682127.33 | 3234401.33 | 3360571.00 | 3293184.00 | |
| L-Homocysteine | 219416.00 | 289961.33 | 134049.00 | 116471.00 | |
| L-Isoleucine | 73987360.00 | 187263722.67 | 168707948.00 | 172530160.00 | |
| L-Leucine | 135463718.67 | 253779296.00 | 219551704.00 | 211668240.00 | |
| L-leucine/isoleucine | 73987360.00 | 187263722.67 | 168707948.00 | 172530160.00 | |
| L-lysine | 3229331.33 | 3122191.00 | 2965157.50 | 2996528.00 | |
| L-methionine | 34886136.33 | 33201629.33 | 36364866.00 | 36504524.00 | |
| L-Methionine S-oxide | 690938.17 | 658577.33 | 720440.00 | 684049.00 | |
| L-octanoylcarnitine (acyl-C8) | 3789387.67 | 745942.33 | 343175.00 | 379739.00 | |
| L-Palmitoylcarnitine (acyl-C16) | 16850528.00 | 10022492.67 | 13161149.00 | 10674159.00 | |
| L-phenylalanine | 335743626.67 | 351002522.67 | 390497472.00 | 371806496.00 | |
| L-proline | 96806817.33 | 71230180.00 | 71609314.00 | 68999768.00 | |
| L-serine | 865901.33 | 1056503.67 | 1004792.50 | 958791.00 | |
| L-threonine | 3843977.17 | 4673646.00 | 4930218.50 | 4584020.00 | |
| L-tryptophan | 68292194.67 | 62476574.67 | 78978724.00 | 69251664.00 | |
| L-tyrosine | 91932110.00 | 96798404.00 | 78067736.00 | 75282104.00 | |
| L-valine | 151348489.33 | 220237706.67 | 200139520.00 | 187455488.00 | |
| N-Acetyl-L-citrulline | 170157.00 | 296957.00 | 267298.50 | 293187.00 | |
| NAD+ | 97069.83 | 68344.33 | 48402.00 | 75741.00 | |
| Nicotinamide | 69826847.33 | 78283484.00 | 58620388.00 | 60673244.00 | |
| N-Methylethanolamine phosphate | 6343408.33 | 3426163.67 | 1543087.50 | 1089725.00 | |
| Octadecanoyl-L-carnitine (acyl-C18) | 13085002.67 | 6172408.33 | 8444327.50 | 6837076.00 | |
| octenoyl-l-carnitine (acyl-C8:1) | 3389605.50 | 2691119.00 | 1764077.00 | 1675572.00 | |
| O-Decenoyl-L-carnitine (acyl-C10:1) | 2752324.67 | 706972.00 | 498565.50 | 473620.00 | |
| O-dodecanoyl-carnitine (acyl-C12) | 1137706.83 | 300322.67 | 435298.00 | 365291.00 | |
| O-dodecenoyl-carnitine (acyl-C12:1) | 890354.83 | 325193.67 | 267118.50 | 176776.00 | |
| O-octadecenoyl-L-carnitine (acyl-C18:1) | 26396808.67 | 17007675.00 | 17936563.00 | 17240694.00 | |
| Ornithine | 467377.83 | 849190.67 | 662220.00 | 699032.00 | |
| O-tetradecanoyl-L-carnitine (acyl-C14) | 1908600.83 | 927895.67 | 1380219.00 | 1049063.00 | |
| Pantetheine | 426031.50 | 527571.00 | 463901.50 | 396302.00 | |
| Pantothenate | 1135391.17 | 987330.33 | 6188561.00 | 5767044.00 | |
| Phosphocreatine | 395524.00 | 790641.00 | 752821.00 | 743823.00 | |
| Phosphoserine | 758144.00 | 1192354.00 | 782804.00 | 690967.00 | |
| Picolinic acid | 61782.00 | 59914.67 | 410739.50 | 396212.00 | |
| propionyl-carnitine (acyl-C3) | 33852748.50 | 41974960.00 | 55410126.50 | 35215728.00 | |
| (R)-S-Lactoylglutathione | 2608085.67 | 14061640.33 | 3013140.00 | 1694081.00 | |
| S-Adenosyl-L-homocysteine | 319944.33 | 701702.33 | 386357.00 | 326782.00 | |
| S-Adenosyl-L-methionine | 145939.00 | 79079.67 | 143660.00 | 199807.00 | |
| (S)(+)-Allantoin | 332630.67 | 513772.67 | 384195.50 | 379754.00 | |
| S-Glutathionyl-L-cysteine | 255413.17 | 683313.50 | 190584.00 | 101049.00 | |
| Spermidine | 13194082.67 | 15414437.00 | 12230742.00 | 12614683.00 | |
| Spermine | 20230074.83 | 15724292.00 | 12945792.00 | 14749435.00 | |
| Sphinganine 1-phosphate | 181474.50 | 139861.67 | 196295.00 | 111634.00 | |
| Sphingosine | 454150.50 | 355066.33 | 323854.00 | 260505.00 | |
| Taurine | 2137759.50 | 2876935.33 | 2938672.50 | 2827215.00 | |
| Tetradecenoyl Carnitine (acyl-C14:1) | 834890.50 | 227091.33 | 178864.50 | 159896.00 | |
| UMP | 92436.83 | 466082.67 | 383712.50 | 432084.00 | |
| Uracil | 266413.83 | 461780.33 | 269244.50 | 264313.00 | |
| Xanthine | 348536.50 | 713137.67 | 538425.50 | 498975.00 |
Factors:
| F1 | Disease state:Healthy control |
| F2 | Disease state:MSUD |
| F3 | Disease state:MSUD with transplant |
| F4 | Disease state:Pool of MSUD with transplant |
