Data for ST004291
| Metabolite structure | All data | F1 | F2 | F3 |
|---|---|---|---|---|
| 11,14,17-Eicosatrienoic acid | 413685.95 | 449684.41 | 427864.31 | |
| 12a-Hydroxyisomillettone | 60935.21 | 43369.96 | 44849.90 | |
| 1,2-Di-(octadecadienoyl)-sn-glycero-3-phosphate | 1263656.22 | 1443265.80 | 1318315.10 | |
| 1-(2-methoxy-octadecanyl)-sn-glycero-3-phosphoserine | 251462.39 | 244964.77 | 255407.38 | |
| 1-[(3-Carboxypropyl)amino]-1-deoxyfructose | 114374.49 | 77769.55 | 95565.57 | |
| 1-(4-Hydroxy-3-methoxyphenyl)-3-decanone | 244372.44 | 266415.41 | 288914.79 | |
| 15(R)-hydroperoxy-EPE | 251556108.00 | 247287784.00 | 302966273.60 | |
| 1,8-Diazacyclotetradecane-2,9-dione | 191256.20 | 160432.05 | 104897.91 | |
| 19-dimethylarsinoyl-nonadecanoic acid | 88700.09 | 87029.46 | 96300.24 | |
| 1-amino-2-phosphorylethylphosphonate | 87665.28 | 65622.10 | 106447.21 | |
| 1-Aminocyclopropanecarboxylic acid | 99582.39 | 90065.87 | 92765.32 | |
| 1-deoxy-1-morpholino-D-fructose | 68186.27 | 64095.94 | 64670.34 | |
| 1-(eicosatetraenoyl)-sn-glycero-3-phosphoserine | 186298.64 | 251668.42 | 300768.68 | |
| 1-Oleoylglycerophosphoserine | 193837.63 | 178234.12 | 248647.52 | |
| 1-(sn-Glycero-3-phospho)-myo-inositol | 104036.82 | 99528.81 | 151601.04 | |
| 1-Stearoylglycerophosphoinositol | 228411.32 | 224498.80 | 237522.83 | |
| 1-Stearoylglycerophosphoserine | 227646.28 | 250596.68 | 327422.29 | |
| 2,3,4,5,6,7-Hexahydroxyheptanoic acid | 63446.62 | 42224.47 | 57394.79 | |
| 2-{[(3,5-dimethoxyphenyl)(hydroxy)methylidene]amino}acetic a... | 2517394.75 | 2466097.88 | 2411641.70 | |
| 2-(4-sulfophenyl)decane | 1729890.58 | 2197232.72 | 2121359.79 | |
| 2,5-Dioxopentanoate | 103749.52 | 95136.42 | 101888.12 | |
| (2,6-anhydro-3-deoxy-D-arabino-heptulopyranosid)onate 7-phos... | 137924.86 | 122648.93 | 125784.79 | |
| 2-Aceto-2-hydroxybutanoic acid | 81460.21 | 82933.83 | 85195.92 | |
| 2(alpha-D-Mannosyl)-D-glycerate | 184080.06 | 172827.27 | 182455.99 | |
| 2-amino-2-deoxy-isochorismate | 170627.77 | 152006.73 | 187109.53 | |
| 2-amino-3-(3,4-dihydroxyphenyl)-3-hydroxyprop-2-enoate | 132655.45 | 112449.49 | 136560.58 | |
| 2-amino-3-(4-hydroxy-3-methoxyphenyl)-2-methylpropanoic acid | 1318453.28 | 1380172.41 | 1328151.75 | |
| 2-Aminobenzoic acid | 205936.53 | 203860.17 | 187465.37 | |
| (2-aminobenzoyl)acetate | 224328.48 | 223750.05 | 247441.15 | |
| 2^-azido-2^-deoxyuridine-5^-diphosphate | 253036.69 | 213652.99 | 259363.88 | |
| 2-dehydro-3-deoxy-D-fuconate | 340578.24 | 316436.13 | 262665.30 | |
| 2-Deoxy-2,3-dehydro-N-acetylneuraminic acid | 1605357.00 | 1534809.78 | 1686121.80 | |
| 2-Dodecylbenzenesulfonic acid | 5580285.03 | 7151027.75 | 7047690.95 | |
| 2-Hydroxy-1,3-dimethoxy-8,9-methylenedioxycoumestan | 1127567.69 | 1203760.33 | 1162337.60 | |
| 2-{[hydroxy(2,3,4-trimethoxyphenyl)methylidene]amino}acetic ... | 541047.66 | 588145.86 | 530501.63 | |
| 2-Hydroxy-3-(phosphonatooxy)propanoate | 639247.30 | 696221.27 | 916259.31 | |
| 2-{[hydroxy(4-hydroxy-3,5-dimethoxyphenyl)methylidene]amino}... | 106761.01 | 107332.45 | 110011.61 | |
| 2-Hydroxyethanesulfonate | 387870.88 | 343114.56 | 326663.53 | |
| 2-Hydroxyglutaric acid | 3772757.25 | 3097977.12 | 3418094.50 | |
| 2-Hydroxyhexadecanoic acid | 172857.51 | 120960.68 | 140577.82 | |
| 2-Hydroxystearic acid | 184376.29 | 161850.43 | 208947.63 | |
| 2-hydroxysuccinamate | 7820644.25 | 6729526.75 | 9011674.90 | |
| 2-isocapryloyl-hydroxymethyl--butyrolactone | 263172.07 | 330838.15 | 263497.44 | |
| 2-Keto-glutaramic acid | 97178.73 | 98533.55 | 86975.83 | |
| 3,3^-Thiobispropanoic acid | 70113.07 | 120802.01 | 124284.02 | |
| 3,5-dioxohexanoate | 111672.57 | 101880.04 | 102653.25 | |
| 3-Deoxy-D-manno-octulosonate 8-phosphate | 261247.68 | 156208.27 | 144659.96 | |
| 3-Hydroxynonanoic acid | 297351.82 | 243661.53 | 209757.87 | |
| 3-Propylmalate | 105015.67 | 102057.33 | 114138.22 | |
| (3S,8R,9S)-3,9-dihydroxy-4,8-dimethyldeca-4,6-dienoate | 206238.61 | 190895.76 | 216171.59 | |
| 3-thiodimethylarsenopropanoic acid | 483920.37 | 384917.18 | 403860.09 | |
| 4-Hydroxy-2-oxopentanoate | 141104.03 | 112258.34 | 113387.82 | |
| 4-Hydroxyphenylacetaldehyde-oxime | 85760.18 | 67626.21 | 78387.55 | |
| 5-deoxy-D-glucuronate | 4556115.06 | 3968822.12 | 4879273.45 | |
| 5-Hexyltetrahydro-2-oxo-3-furancarboxylic acid | 141621.62 | 121373.75 | 154154.53 | |
| 6,7-Dihydroxy-5,4^-dimethoxy-flavylium | 6442489.19 | 6123610.44 | 7466275.00 | |
| 6-Butyryl-5,7-dihydroxy-8-(3^,3^-dimethylallyl)-4-phenylcoum... | 136621.45 | 126033.74 | 165366.29 | |
| 6-Hydroxy-R-acenocoumarol | 51519.75 | 33556.18 | 81495.23 | |
| 6-Phosphogluconic acid | 74120.34 | 73480.11 | 109777.70 | |
| Acetoacetic acid | 189312.05 | 183923.08 | 173316.89 | |
| Acetylcarnitine | 107213.05 | 108091.26 | 93973.22 | |
| ADP | 844216.70 | 729727.53 | 923083.36 | |
| Ajoene | 165446.98 | 128635.82 | 108674.84 | |
| Ala/Ala/Ala/Ser | 94606.55 | 66112.97 | 79476.05 | |
| Ala/Asp/Cys/Tyr | 78059.84 | 92508.40 | 97618.06 | |
| Ala/Asp/Ile/Ile/Gln | 468882.10 | 436870.58 | 506254.43 | |
| Ala/Glu/Ile/Pro/Thr | 1203700.60 | 1322304.12 | 1526932.45 | |
| Ala/Ile/Ile/Ile/Val | 88588.19 | 74285.58 | 86796.96 | |
| Ala/Leu/Thr/Ala | 608745.72 | 559874.34 | 599978.83 | |
| Ala/Lys/Ala/Ala | 48089.07 | 39780.72 | 56602.86 | |
| Ala/Lys/Leu/Asn/Thr | 230136.99 | 227987.66 | 183765.67 | |
| Ala/Lys/Lys/Val/Trp | 119248.91 | 97352.78 | 150237.80 | |
| Ala/Met/Asp/Tyr | 10852025.44 | 12075820.12 | 13298020.45 | |
| Alanyl-Proline | 257372.82 | 194393.27 | 241823.78 | |
| Alanyl-Serine | 119172.46 | 139922.16 | 195410.02 | |
| Ala/Phe/Phe/Met/Gln | 168280.67 | 143403.61 | 168224.98 | |
| Ala/Pro/Gln/Gln/Arg | 187687.43 | 182371.98 | 218251.27 | |
| alpha-Irone | 787162.45 | 742765.43 | 809547.66 | |
| Alpha-Linolenic acid | 681706.97 | 646610.27 | 797793.99 | |
| aminopyrrolnitrin | 85287.13 | 89660.80 | 81277.84 | |
| ancymidol | 880266.00 | 863991.02 | 992719.53 | |
| a phenothiazine | 98174.22 | 93210.37 | 80866.60 | |
| Arabinonate | 1856019.84 | 1433917.91 | 1689935.85 | |
| Arachidic acid | 1399715.73 | 1379645.19 | 1470229.95 | |
| Arg/Lys/Thr/Asp | 184131.64 | 160384.14 | 204245.08 | |
| Asparagine | 5732509.12 | 5415882.25 | 5795930.00 | |
| Avenic acid A | 235675.97 | 220207.37 | 247790.28 | |
| avenolide | 435173.04 | 572956.39 | 303285.77 | |
| Carglumic acid | 81306.68 | 86391.52 | 96676.63 | |
| CDP-Ethanolamine | 216979.33 | 263453.68 | 325152.49 | |
| Cer(d18:1/22:1) | 533886.70 | 544037.62 | 537640.73 | |
| Cer(d18:1/24:1) | 4080640.05 | 3954068.38 | 3486429.98 | |
| Cholesterol sulfate | 2307779.19 | 2147355.75 | 2391966.35 | |
| Citicoline | 94065.74 | 99689.89 | 128612.56 | |
| Cladinose | 123985.89 | 122832.65 | 119515.20 | |
| CMP-2-aminoethylphosphonate | 544758.80 | 498076.01 | 543197.98 | |
| Convicine | 81867.66 | 85165.57 | 94744.40 | |
| coptisine | 457489.73 | 439398.73 | 523191.00 | |
| creatinine phosphate | 207412.25 | 241952.75 | 289559.13 | |
| Cyanidin-3-O-(6^^-O-malonyl-2^^-O-glucuronyl)glucoside | 134625.02 | 74579.48 | 153571.71 | |
| Cyclobrassinin | 91939.04 | 54133.49 | 92532.84 | |
| Cys/Cys/Cys/Asn/Tyr | 884288.06 | 1248251.58 | 1056722.35 | |
| Cys/Leu/Cys/Tyr | 1245586.84 | 1255613.52 | 1430011.99 | |
| Cys/Lys/Arg/Thr/Val | 161499.81 | 184981.59 | 174161.43 | |
| Cysteinosuccinic acid | 92436.27 | 79869.06 | 108035.65 | |
| cytidine 5^-{[hydroxy(2-hydroxyethyl)phosphonoyl]phosphate} | 122147.71 | 107870.28 | 116116.69 | |
| Decitabine | 86419.01 | 86128.45 | 97638.26 | |
| DeHA | 191033.71 | 163257.88 | 190215.32 | |
| D-galactopyranosyl trimethylammonium bromide | 76630.50 | 67067.81 | 72648.12 | |
| DGCC(20:5/20:5) | 3623229.19 | 3670922.19 | 3749844.00 | |
| Dictyoquinazol C | 141385.31 | 136429.44 | 130460.29 | |
| Dihydrocaffeic acid 3-O-glucuronide | 207119.78 | 248189.63 | 189060.55 | |
| dihydrogeranylgeranyl-bacteriopheophytin | 816585.73 | 852217.95 | 843898.94 | |
| Dihydrozeatin-O-glucoside | 157511.17 | 148596.47 | 194184.48 | |
| Docosahexaenoic acid | 109689.29 | 103543.70 | 143143.80 | |
| Docosapentaenoic acid (22n-3) | 528816.31 | 519471.86 | 549520.04 | |
| Dopamine | 2740263.19 | 2789559.06 | 2581827.25 | |
| Enicoflavine | 477625.21 | 535147.88 | 401786.41 | |
| erythro-D-galacto-octitol | 270342.99 | 259080.64 | 245807.11 | |
| erythro-L-galacto-Nonulose | 150187.30 | 145629.61 | 131932.60 | |
| erythronate | 1969166.22 | 2209258.03 | 2445352.80 | |
| Erythrose 4-phosphate | 90353.14 | 65327.33 | 105492.06 | |
| Eucaglobulin | 1519441.79 | 1679389.12 | 1132950.93 | |
| FA (19:1) | 177373.94 | 142058.97 | 195068.04 | |
| FA methyl(14:0) | 1086276.95 | 964152.56 | 1080673.85 | |
| FA methyl(16:1) | 420811.62 | 384106.03 | 453441.62 | |
| FA oxo(16:0) | 138583.99 | 99083.46 | 167735.20 | |
| Fenugreekine | 8885208.62 | 9475924.50 | 11401329.50 | |
| Formylfusarochromanone | 79247.12 | 56988.57 | 71678.23 | |
| Fructose 6-phosphate | 3230959.75 | 449487.43 | 461815.39 | |
| fumiquinazoline F-indoline-3^-ol | 226634.85 | 131791.98 | 148897.14 | |
| Galactinoldihydrate | 801005.11 | 636525.13 | 901199.03 | |
| Galactose | 1275745.05 | 1049763.56 | 852880.98 | |
| Galactosylglycerol | 341509.43 | 319170.45 | 373749.04 | |
| gamma-Aminobutyric acid | 512037.90 | 446777.07 | 536483.71 | |
| gamma-Glutamyl-gamma-aminobutyraldehyde | 267000.55 | 202382.61 | 221582.31 | |
| gamma-Glutamylglycine | 89089.16 | 89623.99 | 125761.53 | |
| gamma-Glutamylisoleucine | 199905.43 | 156635.56 | 216038.28 | |
| GDP-3,6-dideoxy-D-galactose | 49849.27 | 75614.41 | 75365.15 | |
| GDP-L-fucose | 53546.56 | 43425.74 | 66359.93 | |
| Genipinic acid | 301628.42 | 330138.45 | 302987.66 | |
| Gentisyl alcohol | 107015.64 | 116334.28 | 118017.79 | |
| Gluconic acid | 17969033.00 | 16130993.25 | 19661892.20 | |
| Glucosylsphingosine | 596466.10 | 522155.46 | 491907.07 | |
| Glucuronate | 118363.01 | 98370.41 | 112113.72 | |
| Glu/Ile/Ile/Ile/Ile | 203160.89 | 206215.32 | 214944.65 | |
| Glutaminyltyrosine | 135115.78 | 151352.82 | 157958.31 | |
| glutathione sulfinate | 1156655.83 | 1033736.89 | 1047705.76 | |
| Glyceric acid | 112160.58 | 111475.09 | 110408.02 | |
| Glycerol 3-phosphate | 2272527.73 | 1691123.61 | 1862203.61 | |
| glycero-L-galacto-Octulose | 369310.86 | 289340.82 | 326200.61 | |
| Glycerophosphoglycerol | 131699.53 | 134442.63 | 189490.55 | |
| glycerophosphoserine | 91474.28 | 93571.21 | 115046.61 | |
| Gly/His/His/Arg/Trp | 244974.50 | 201341.68 | 201379.59 | |
| GSK1059615 | 240437.78 | 247099.10 | 257858.59 | |
| Guanidinoethyl methyl phosphate | 350858.66 | 322566.69 | 356856.94 | |
| Guanosine diphosphate mannose | 119948.32 | 112792.80 | 145845.18 | |
| Heptadecanoic acid | 2170678.91 | 2039632.50 | 2313515.80 | |
| Histidine | 251875.68 | 250368.83 | 325704.67 | |
| Histidine trimethylbetaine | 208481.77 | 188471.46 | 165301.78 | |
| Hydantoin-5-propionic acid | 83285.22 | 73696.20 | 102744.29 | |
| Hydrogen phosphate | 13688639.00 | 12558287.00 | 13305735.20 | |
| Hydroxymethylphosphonate | 154205.41 | 158492.09 | 163351.27 | |
| Hydroxyprolyl-Isoleucine | 120786.31 | 100059.68 | 135177.31 | |
| Hypoxanthine | 12045637.16 | 14004894.25 | 16173561.20 | |
| Ile/Ile/Ile/Ile/Asn | 87611.23 | 85782.56 | 84797.82 | |
| Ile/Ile/Ile/Ile/Gln | 332056.55 | 379242.28 | 351890.48 | |
| Ile/Ile/Ile/Ile/Ser | 289744.55 | 248569.93 | 291618.64 | |
| Ile/Ile/Ile/Ile/Thr | 66075.75 | 85192.30 | 55149.17 | |
| Ile/Ile/Ser | 102232.02 | 83446.43 | 99272.07 | |
| Ile/Lys/Gln/Tyr | 102206.08 | 70779.55 | 137566.58 | |
| Ile/Met/Met/Gln/Val | 211867.22 | 204693.77 | 235610.35 | |
| indole-3-acetyl-proline | 177360.99 | 165317.02 | 152341.58 | |
| Inosine | 124426.47 | 84691.01 | 115177.28 | |
| Inosinic acid | 1131229.66 | 871771.46 | 980840.41 | |
| kauralexin A1 | 693848.33 | 738667.59 | 695268.28 | |
| Ketoleucine | 202322.52 | 189622.56 | 208022.07 | |
| Lactic acid | 1793427.75 | 1779388.94 | 2901207.15 | |
| Leucine | 8003040.06 | 7435533.19 | 9064012.00 | |
| Lysine | 342696.54 | 343714.46 | 485108.09 | |
| Lys/Lys/Lys/Trp | 78727.22 | 63182.26 | 86070.50 | |
| LysoPA(0:0/16:0) | 202509.27 | 187795.76 | 202906.37 | |
| LysoPA(0:0/18:1) | 118692.54 | 128655.92 | 130052.57 | |
| LysoPE(0:0/18:2) | 166400.55 | 242678.20 | 298436.94 | |
| LysoPE(0:0/18:3) | 119746.29 | 141049.06 | 160558.57 | |
| LysoPE(0:0/20:4) | 211596.69 | 386228.15 | 461090.29 | |
| LysoPE(0:0/22:4) | 107603.96 | 83913.11 | 158061.39 | |
| Lysyl-Glycine | 75735.04 | 57775.64 | 70824.30 | |
| Malic acid | 10862447.44 | 11510854.75 | 14403666.60 | |
| Malonic semialdehyde | 346836.44 | 314953.79 | 372499.03 | |
| mercaptosuccinate | 1697754.56 | 1282516.69 | 1511218.77 | |
| Met/Cys/Cys | 3700936.12 | 3991605.00 | 3839777.75 | |
| methanofuran biosynththesis intermediate MF3 | 173162.09 | 177972.61 | 268796.64 | |
| Met/Met/Met | 80746.51 | 76259.48 | 129616.70 | |
| Monoethylhexyl phthalic acid | 142112.81 | 138227.25 | 190545.43 | |
| Monoglyceride citrate | 105509.14 | 105199.28 | 120661.42 | |
| N2-hydroxy-L-tryptophan | 72403.32 | 74259.30 | 113312.70 | |
| N2-Succinyl-L-ornithine | 68705.09 | 78530.10 | 119021.67 | |
| N-[-3-methylhex-2-enoyl]-L-glutamine | 144387.31 | 146696.49 | 154689.17 | |
| N-(4-oxoglutaryl)-L-cysteinylglycine | 176554.60 | 172553.90 | 189943.09 | |
| N6-Acetyl-N6-hydroxy-L-lysine | 94839.43 | 88721.25 | 103619.39 | |
| N-acetyldemethylphosphinothricyl-L-alanyl-L-leucine | 52165.17 | 36242.95 | 47088.07 | |
| N-Acetyl-D-glucosaminate | 497173.35 | 474258.01 | 557604.19 | |
| N-Acetylglucosamine 6-phosphate | 82885.20 | 80592.48 | 80145.16 | |
| N-Acetylglutamic acid | 190520.68 | 107611.78 | 273782.25 | |
| NADP | 183891.44 | 170797.39 | 217371.37 | |
| N-Benzyloxycarbonylglycine | 1345188.25 | 1258416.28 | 1331546.30 | |
| N-Butyl-beta-carboline-3-carboxylate | 3863152.50 | 4669526.88 | 3596009.35 | |
| N-(Carboxyaminomethyl)urea | 711662.09 | 870642.53 | 617969.56 | |
| N-D-Glucosylarylamine | 322185.91 | 324696.56 | 346613.12 | |
| N-(docosanoyl)-tetradecasphing-4-enine | 368336.96 | 338266.88 | 278316.56 | |
| N-(eicosanoyl)-tetradecasphing-4-enine | 1326210.11 | 1312420.28 | 1238526.15 | |
| N-hydroxy-N-succinylcadaverine | 87000.11 | 87371.97 | 117174.06 | |
| N-Nitrosoproline | 90817.71 | 96936.62 | 121039.74 | |
| N-Succinyl-L-glutamate | 168914.47 | 147018.00 | 171157.97 | |
| N-Undecylbenzenesulfonic acid | 6001771.94 | 7645303.25 | 7194948.40 | |
| O-Acetylserine | 444325.11 | 343936.54 | 658309.11 | |
| O-Carbamoyl-L-serine | 4467506.19 | 4738769.88 | 4745796.25 | |
| Oleic acid | 11127506.12 | 11113667.25 | 12942271.10 | |
| Ophthalmic acid | 146723.41 | 135218.72 | 165430.73 | |
| Orotidine | 1437643.97 | 1254187.59 | 1512667.62 | |
| Oxoglutaric acid | 860651.57 | 1042994.44 | 1220277.15 | |
| PA(14:0/20:1) | 2880712.41 | 3096235.25 | 3161736.50 | |
| PA(14:1/20:1) | 2052102.88 | 2187681.81 | 2143093.52 | |
| PA(14:1/22:0) | 947614.36 | 1089932.52 | 1017389.03 | |
| PA(14:1/22:2) | 953557.53 | 1037283.02 | 1090785.50 | |
| PA(18:1/18:1) | 1342802.81 | 1437436.16 | 1516294.38 | |
| Palmitoleic acid | 1099459.06 | 943255.44 | 1009568.47 | |
| PA(O-38:5) | 250611.29 | 288838.80 | 343880.57 | |
| PA(P-42:4) | 324570.57 | 315502.67 | 362611.79 | |
| PC(15:0/18:4) | 2298572.94 | 2301084.12 | 2472690.90 | |
| PC(15:0/20:5) | 1879371.50 | 1960579.75 | 2021311.98 | |
| PC(15:1) | 496076.79 | 715989.63 | 878979.60 | |
| PE | 174886.65 | 166640.33 | 175636.11 | |
| PE(14:1/22:0) | 573952.21 | 658187.08 | 648413.29 | |
| PE(16:0/22:4) | 1667269.88 | 1797020.94 | 1753821.77 | |
| PE(16:0/22:6) | 1025181.06 | 1135215.97 | 1030797.85 | |
| PE(18:1/18:1) | 1057278.55 | 1040525.92 | 1123816.99 | |
| PE(18:1/P-18:0) | 237363.41 | 213134.41 | 252169.76 | |
| PE(20:4/P-18:1) | 1202779.50 | 1394669.84 | 1419578.44 | |
| PE(P-16:0e/0:0) | 118669.15 | 168257.03 | 174536.21 | |
| PE(P-18:1/22:5) | 810652.19 | 724803.80 | 1308607.59 | |
| PG(16:0/18:1) | 1885342.18 | 2246441.03 | 2620169.42 | |
| PG(16:0/22:5) | 678239.47 | 617078.91 | 623609.15 | |
| PG(18:0/18:1) | 1365072.09 | 1479305.75 | 1700884.99 | |
| PG(18:0/18:2) | 1498266.96 | 1976171.81 | 2043838.19 | |
| Phe/His/His/Lys/Pro | 48427.83 | 56938.01 | 56430.92 | |
| Phe/Ile/Arg/Val/Val | 222218.93 | 199012.63 | 255226.17 | |
| Phe/Ile/Lys/Lys/Asn | 63846.59 | 81765.76 | 88902.63 | |
| Phenolsulfonphthalein | 30852439.00 | 33410179.00 | 33859057.60 | |
| Phenylalanine | 3594135.50 | 3530012.38 | 4059367.25 | |
| Phosphodimethylethanolamine | 224911.33 | 91638.87 | 203503.27 | |
| Phosphoenolpyruvic acid | 300416.65 | 394210.64 | 509494.68 | |
| phosphoglycolohydroxamate | 1722340.66 | 1489534.72 | 2078784.32 | |
| PI(14:0/22:1) | 1872997.22 | 1884306.66 | 1993875.23 | |
| PI(16:0/20:2) | 1492230.94 | 1668010.69 | 1645978.10 | |
| PI(16:0/20:3) | 1251189.22 | 1257534.61 | 1277178.82 | |
| PI(16:0/20:4) | 2381863.34 | 2245285.47 | 2117753.73 | |
| Polystyrene sulfonate | 192878.68 | 256627.57 | 214956.07 | |
| potassium dihydrogen phosphate | 706401.38 | 655977.09 | 733093.40 | |
| PS(16:0/20:3) | 1208023.52 | 1580309.55 | 1787715.00 | |
| PS(16:0/20:4) | 1650959.16 | 1672294.03 | 1895148.30 | |
| PS(18:0/18:1) | 9172570.38 | 9737740.25 | 10478312.20 | |
| PS(18:0/20:4) | 54375572.00 | 52764063.00 | 53755250.40 | |
| PS(18:0/22:4) | 6755015.38 | 6558575.00 | 6529382.30 | |
| PS(18:0/22:5) | 12516928.50 | 12549860.50 | 12948007.40 | |
| PS(18:1/20:4) | 5922490.88 | 6274506.62 | 6656771.80 | |
| PS(18:2/22:6) | 1014148.73 | 1011213.58 | 999319.43 | |
| PS(20:3/18:3) | 953861.67 | 970196.91 | 1104436.90 | |
| PS(20:3/22:6) | 1876996.00 | 1746763.97 | 1922872.30 | |
| PS(O-36:1) | 4442362.81 | 4766152.44 | 5142597.55 | |
| Pyridoxine 5^-phosphate | 139605.98 | 113918.93 | 127830.71 | |
| Pyroglutamic acid | 9637063.75 | 7904061.88 | 10879622.70 | |
| Pyrophosphate | 98839.46 | 120267.18 | 147419.96 | |
| ribose 1,3-cyclic phosphate | 199951.86 | 223951.63 | 224404.90 | |
| Ribose 5-phosphate | 342693.46 | 190840.47 | 232306.83 | |
| Rishitin | 253097.83 | 518446.73 | 254195.76 | |
| Sambutoxin | 452107.38 | 639606.56 | 804010.85 | |
| Sanguinarine | 299428.87 | 252467.68 | 299615.38 | |
| Secobarbital | 797235.27 | 767993.36 | 740741.28 | |
| Sedoheptulose | 159876.23 | 131583.05 | 169402.57 | |
| Sedoheptulose 7-phosphate(2-) | 562126.04 | 321598.38 | 346033.42 | |
| selenium dioxide | 1222442.03 | 1125705.31 | 1214195.48 | |
| Serine | 2040419.38 | 1871433.12 | 2121475.60 | |
| sn-glycero-3-Phosphoethanolamine | 271922.91 | 265010.27 | 326658.60 | |
| Sorbitol | 20159770.00 | 13433581.25 | 16394640.40 | |
| Sorbitol-6-phosphate | 625196.99 | 708542.48 | 796061.47 | |
| Sphinganine 1-phosphate | 423141.79 | 330860.37 | 307742.46 | |
| [ST (12:0) homo-seco-cholestatrien-tetrol | 1114939.55 | 1299959.09 | 1137802.68 | |
| Stearic acid | 52702468.00 | 48595233.50 | 65167758.00 | |
| Taurine | 387281.56 | 340066.31 | 386228.96 | |
| tetrahydrogeranylgeranyl-bacteriopheophytin | 4678751.50 | 4190580.62 | 4328913.50 | |
| trans-Dodec-2-enoic acid | 237471.05 | 323782.11 | 242324.75 | |
| Trigonelline | 19649838.50 | 21012247.50 | 19388136.80 | |
| Tuberculostearic acid | 352276.37 | 313288.46 | 356489.82 | |
| Ureidoglycolic acid | 1244167.89 | 1216596.38 | 1313884.40 | |
| Uridine diphosphate glucose | 805643.55 | 800216.61 | 975078.95 | |
| Uridine diphosphate glucuronic acid | 62158.99 | 66192.32 | 91258.63 | |
| Uridine diphosphate-N-acetylglucosamine | 384256.77 | 379180.73 | 416745.37 | |
| Urocanic acid | 108633.72 | 97660.78 | 82401.36 | |
| Valine | 1767753.94 | 1645185.06 | 1923756.82 | |
| Xylobiose | 108395.65 | 102516.49 | 105605.14 | |
| Xylose | 215049.93 | 131359.32 | 180004.21 | |
| Zapotidine | 112296.37 | 92977.94 | 122857.69 |
Factors:
| F1 | Sample source:iRBC | factor:DMSO |
| F2 | Sample source:iRBC | factor:WEHI-024 |
| F3 | Sample source:iRBC | factor:WEHI-601 |
