Data for Cyclobutene- and cyclobutane-functionalized fatty acids as novel biochemical probes of structure and function in HepG2 cells (Study ST000241)

(Analysis AN000373)

Values for each metabolite have been scaled by dividing by the mean across all factors

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MetaboliteF1F2F3F4F5F6F7F8
1,11-Undecanedicarboxylic acid 0.5475 0.1217 4.2940 0.5627 0.2828 0.1477 0.1353 0.2064
11^-Carboxy-alpha-tocotrienol 0.1861 0.4770 0.5146 1.1066 1.7839 1.3407 1.7122 0.6076
11-Hydroxyeicosatetraenoate glyceryl ester 0.4304 0.7238 1.5720 0.8626 0.5412 NA 2.3835 0.4865
12(13)Ep-9-KODE 4.6166 NA 0.2545 0.1162 0.1512 0.2568 0.1465 0.1251
1,25-Dihydroxyvitamin D3-26,23-lactone 1.3948 0.0623 0.1143 2.1449 1.5688 0.4811 0.0985 2.1354
12-Ketodeoxycholic acid 0.9145 0.4117 0.7528 0.9892 1.5404 0.7899 1.4188 1.3784
13,14-Dihydro-15-oxo-lipoxin A4 NA NA 2.7361 0.1208 0.0554 NA 0.0755 0.2097
13,14-Dihydro- lipoxin A4 6.5306 0.0812 0.1776 0.1050 0.1180 0.1880 0.4154 0.3842
13^-carboxy-alpha-tocotrienol 1.5146 1.2804 1.2251 0.8250 0.2861 0.3156 2.4127 0.4055
13^-Carboxy-gama-tocopherol 5.2234 0.4182 0.5038 0.2017 0.2149 0.3534 0.7882 0.2964
13^-carboxy-gama-tocotrienol 1.4001 0.7593 1.2831 0.6408 0.7008 0.6964 1.0095 1.5099
13^-hydroxy-alpha-tocotrienol 4.5831 0.1705 0.3865 0.1375 0.1725 0.3375 0.9123 0.2974
13-OxoODE 5.7621 0.1821 0.2508 0.2771 0.3254 0.3991 0.4265 0.3769
16b-Hydroxystanozolol 0.9029 0.7074 0.8142 1.2425 1.1309 0.1762 0.5155 2.5103
16-hydroxy hexadecanoic acid 0.5231 1.3278 0.6816 1.8080 1.3203 0.9641 0.3078 1.0672
19-Hydroxy-PGE2 0.0053 0.0160 5.1239 1.7061 0.0785 0.0078 0.0053 0.0633
1D-Myo-inositol 1,4-bisphosphate NA 1.5661 1.4160 NA 0.0497 0.3347 NA NA
24,25-Dihydroxyvitamin D 4.5058 0.6331 0.5234 0.0933 0.0400 0.2169 0.5011 0.8465
24-Hydroxycholesterol 0.9742 0.4861 0.2400 NA NA 0.0702 0.5756 2.6915
2,6 dimethylheptanoyl carnitine 0.8832 0.8163 0.7555 0.8286 0.6804 1.4647 1.4915 1.0798
2-Arachidonylglycerol 2.5441 0.6747 0.2953 0.1694 0.0260 0.0041 1.4338 1.4070
2-Hexaprenyl-3-methyl-6-methoxy-1,4 benzoquinone 2.0328 0.7789 0.2858 1.0529 1.2802 0.6291 0.1690 0.1959
2-Hexaprenyl-6-methoxy-1,4-benzoquinol 3.9814 0.1812 0.1026 0.4277 0.3393 0.2676 0.8948 0.2566
2-Hydroxylauroylcarnitine 3.6116 0.2608 0.6579 0.1124 0.0189 NA 1.4920 0.5195
2-Hydroxymyristic acid 1.4155 0.5174 0.8196 0.6902 0.5689 1.0637 0.7145 2.1151
2-Phosphoglyceric acid 0.8008 0.0531 NA 3.1299 0.8524 NA NA 0.1638
2-trans,4-cis-Decadienoylcarnitine 0.0977 NA 4.1794 0.3085 0.0902 0.0953 0.2499 0.3613
3a,20b-Pregnediol 1.8470 0.6785 0.8256 1.6588 0.1626 1.2132 0.3359 1.3496
3b-Allotetrahydrocortisol 0.0657 0.0564 0.0534 0.4219 0.0969 5.3206 0.0364 0.0408
3D,7D,11D-Phytanic acid 0.2933 0.9081 0.4493 0.4559 0.6928 0.8197 1.4561 2.4535
3-Hydroxy-5, 8-tetradecadiencarnitine 1.1947 0.8116 0.7436 0.9121 0.8548 0.9447 2.0374 0.5010
3-Hydroxy-cis-5-tetradecenoylcarnitine 0.4538 3.5520 0.4127 0.0705 NA NA 1.3486 0.1624
3-Hydroxyhexdecanedioyl-CoA NA NA 0.0115 3.3042 0.0399 0.0132 NA 0.6521
3-Methylcrotonyl-CoA 1.5598 NA 0.1918 0.3647 0.2260 NA 0.6613 1.5180
3-O-Sulfogalactosylceramide (d18:1/24:1(15Z)) 0.0574 0.3178 0.0743 0.1112 5.3785 0.0710 0.0809 0.0642
3-Oxo-4,6-choladienoic acid 1.1372 0.7156 0.7575 0.9127 0.7904 1.0003 0.3260 2.3602
3-Oxododecanoyl-CoA 0.0290 0.0323 0.0334 3.1043 0.0755 0.0727 NA 1.0987
4,4-Dimethyl-14alpha-hydroxymethyl-5alpha-cholesta-8-en-3beta-ol 2.1647 0.0940 0.1509 1.8113 1.2422 0.3912 0.2802 0.0864
4,4-Dimethylcholesta-8,14,24-trienol 0.1992 NA NA 0.9805 2.2010 1.2527 0.0916 0.1037
4Alpha-hydroxymethyl-5alpha-cholesta-8,24-dien-3beta-ol NA 2.0799 0.6734 0.3101 NA NA 0.3984 0.3066
4Alpha-hydroxymethyl-5alpha-cholesta-8-en-3beta-ol 1.4703 0.2523 0.7659 NA NA 0.0465 0.3690 2.4602
4-oxo-Retinoic acid 0.2808 0.4827 2.3973 0.9322 1.3307 1.5525 0.1464 0.8774
4-Phosphopantothenoylcysteine 0.0096 NA 0.0105 0.7728 1.5642 2.3129 NA 0.0102
5,6-Dihydroxyprostaglandin F1a NA 0.2120 2.1113 NA NA NA 0.0301 NA
5a-Cholesta-8,24-dien-3-one 0.2638 0.6553 0.0793 0.5244 1.0273 2.5847 1.0020 1.8632
5a-Cholestane-3a,7a,12a,25-tetrol 0.0780 0.0320 NA 2.9056 NA NA 0.0361 0.0505
5b-Cholestane-3a,7a,12a,23R,25-pentol NA NA 0.6561 0.0491 1.7804 0.0462 0.0415 2.4713
5-b-Cholestane-3a ,7a ,12a-triol NA 1.0447 1.2701 NA NA NA 0.0556 NA
5b-Pregnediol 2.0178 0.0143 0.0162 0.8056 1.4234 1.8752 0.2704 0.9427
5-Taurinomethyl-2-thiouridine 0.0136 0.0114 NA 0.3315 2.9863 NA 0.0102 NA
6,7-Dimethyl-8-(1-D-ribityl)lumazine 1.5521 0.6956 0.6401 0.3181 1.4232 0.1397 1.1094 1.8350
6-Hydroxy flavin adenine dinucleotide 1.3518 NA 0.2964 NA NA NA NA NA
7,7^,8,8^,11,11^,12,12^-Hexahydro-y,y-Carotene 1.2039 0.8471 0.8592 1.0432 0.9239 1.1069 0.5459 1.4698
7a,12a-Dihydroxy-3-oxo-4-cholenoic acid 2.4064 0.4806 0.5813 0.1127 0.0495 0.0311 3.0745 0.9409
7^-carboxy-gama-tocotrienol 4.3649 0.0982 0.0624 0.0536 NA 0.0749 0.0993 0.1160
7-Dehydrocholesterol 0.0362 0.1329 0.0584 0.6079 1.2000 5.5253 0.3376 0.1017
7-Ketocholesterol 4.0917 0.7167 0.8123 0.1424 0.1079 0.1819 1.2137 0.7333
7-Ketodeoxycholic acid 1.0182 0.9324 1.2158 1.0973 0.7722 0.0255 1.9512 0.9874
8,11,14-Eicosatrienoic acid 0.0331 0.0606 0.0300 0.5771 0.8153 3.5350 0.0354 0.0295
8-iso-15-keto-PGE2 0.1645 0.2189 1.2147 3.0232 0.1139 NA NA 0.1701
9^-Carboxy-gama-chromanol 1.5755 1.1637 1.1531 0.7020 1.0727 1.1139 0.6666 0.5526
9^-carboxy-gama-tocotrienol 0.0836 0.0709 3.7577 0.7020 0.3482 0.1506 0.0712 0.4925
9-Decenoylcarnitine NA 0.2890 0.6549 NA NA 0.2448 2.9021 0.1306
Acetylphosphate NA 0.0066 NA NA 0.1235 2.8695 0.0075 0.0071
Adenosine 0.0908 0.0416 0.0385 3.8792 0.0391 0.0476 0.0355 0.3445
Adenosine tetraphosphate NA 0.0067 0.0123 0.3865 0.4532 3.4809 0.0069 NA
Adenosylcobimide-GDP 0.7549 0.6858 0.4579 1.6291 1.5174 1.2942 0.2276 1.4331
Aerobactin NA 0.2559 0.2953 1.4829 NA NA NA NA
Alpha-CEHC 0.0341 0.0595 3.4555 1.5937 1.2062 0.0520 0.0500 0.9164
Aminopterin 2.9211 NA NA 0.3057 0.3705 0.7080 0.0842 NA
Angiotensin III NA NA NA NA NA NA 1.3058 0.0825
Behenic acid NA 1.2600 1.0461 NA NA NA 0.0817 NA
Beta-Cryptoxanthin 4.4700 0.1917 0.2612 0.5472 0.3173 0.7945 0.5341 0.1408
Brompheniramine 0.1598 0.2014 1.6733 0.7982 1.2194 1.2588 NA 1.1290
Capryloylcholine NA 0.1893 NA NA NA NA 1.3564 0.8708
CE(14:0) 0.7290 0.2591 0.1925 2.0654 1.7755 0.5044 0.1512 1.4197
CE(14:1(9Z)) 0.9905 0.3038 0.2707 2.0608 1.6641 0.0722 0.7102 1.9278
CE(18:3(6Z,9Z,12Z)) NA 0.0634 0.2329 1.0764 0.9902 2.3446 0.0045 NA
CE(20:4(5Z,8Z,11Z,14Z) NA 3.2037 1.7548 0.0041 0.0098 0.0276 NA NA
CE(20:5(5Z,8Z,11Z,14Z,17Z) NA 0.0030 0.0115 0.1150 0.3049 4.5654 0.0032 0.0034
CE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)) NA 0.0195 NA 0.0446 0.0223 3.2603 NA 0.0211
CE(5:0) NA 0.0240 NA 0.2495 0.8402 3.5443 0.0182 0.0189
Celastrol 1.8576 0.4111 0.6604 0.5177 0.6544 0.2405 2.7546 0.9037
Ceramide (d18:1/9Z-18:1) 0.0912 0.0861 0.2207 4.1413 1.0576 0.2585 0.0939 0.2315
Cer(d18:0/24:0) 2.3709 0.5967 0.8360 0.7795 0.0197 0.0191 0.7795 1.2911
Cer(d18:1/22:1(13Z)) NA 0.0121 0.0253 3.7078 0.1187 0.0526 NA 1.7586
Cervonoyl ethanolamide 0.6848 0.5937 0.7230 1.6065 0.2367 0.0431 3.4198 0.6924
Chitosan 1.6214 0.3426 1.0579 1.6194 0.6629 NA 0.8512 0.5130
Cholesterol sulfate 0.0688 2.8260 0.0448 0.0502 0.0489 1.3732 0.0711 0.0476
Cholesteryl acetate 1.8507 1.1885 1.6761 0.0240 0.0450 0.0228 1.1000 0.4799
Cholic acid glucuronide NA NA NA 1.6439 0.0345 NA 0.0339 NA
CL(20:1(11Z)/18:2(9Z,12Z)/18:1(11Z)/18:1(11Z)) 0.0922 NA NA NA NA NA NA 1.3026
CL(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:2(9Z,12Z)/18:2(9Z,12Z)) 0.1194 NA NA 2.3055 0.1584 NA NA 0.1113
Cotinineglucuronide 4.3339 0.2847 0.2794 0.1833 0.1713 0.2946 0.1436 0.1627
Cysteineglutathione disulfide 4.1296 0.1973 0.1153 1.0364 0.5408 0.8237 0.1326 0.1604
Cysteinylglycine NA 0.3872 0.3093 NA NA 1.9613 0.3809 NA
Delphinidin 0.3884 0.0215 0.0220 4.0327 1.5325 0.1721 0.2285 0.0233
Dextrorphan O-glucuronide 3.9511 0.1497 0.3858 0.4811 0.5250 0.8100 0.9302 0.7670
DG(14:0/15:0/0:0) 1.9872 NA NA 0.6528 0.3189 NA 0.5312 0.5118
DG(14:0/18:1(11Z)/0:0) 1.8473 0.8404 1.1547 0.1080 NA NA 1.4553 0.5943
DG(14:0/20:2(11Z,14Z)/0:0) 2.6012 NA 0.1149 0.9107 0.3527 0.9895 NA 0.1615
DG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/0:0) 4.1643 0.3814 0.4887 0.5745 0.3622 0.8514 0.7573 0.4202
DG(14:1(9Z)/14:1(9Z)/0:0) 4.7843 0.3685 0.3390 0.2580 0.2569 0.6511 0.5514 0.3698
DG(14:1(9Z)/16:1(9Z)/0:0) NA NA NA NA 0.6687 1.6374 NA 0.0819
DG(14:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0) 0.8467 0.6017 1.0313 0.5732 2.2007 1.4062 0.4472 0.8931
DG(15:0/16:0/0:0) 0.0624 0.0481 NA 4.2065 0.2201 0.1823 NA 0.6508
DG(15:0/22:1(13Z)/0:0) 1.0164 0.3670 0.4341 0.9136 1.1980 0.8809 2.0990 1.0910
DG(15:0/24:0/0:0) 0.1311 1.6812 2.1725 0.0491 NA NA 0.3708 0.0973
DG(15:0/24:1(15Z)/0:0) 0.5099 3.2670 2.5445 0.4573 0.2964 0.1806 0.4093 0.3351
DG(16:0/22:4(7Z,10Z,13Z,16Z)/0:0) 0.0869 0.0507 0.0561 0.1844 1.1302 3.6872 0.2392 0.4240
DG(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) 0.0588 0.3526 2.8908 0.0944 0.0583 NA NA NA
DG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/0:0) NA 0.1356 NA 0.1020 0.4235 2.3767 NA 0.0732
DG(18:1(11Z)/22:2(13Z,16Z)/0:0) 0.0227 3.6222 1.6265 0.0305 0.0155 NA 0.0270 0.0237
DG(18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0) 5.2511 0.2007 0.3043 0.3240 0.4476 0.3522 0.6794 0.2269
DG(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) 0.2269 2.1930 1.3174 1.1410 0.8493 0.1400 1.1289 1.0035
DG(22:4(7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)/0:0) 0.4879 0.8883 1.1042 0.8945 1.8232 0.9587 0.3238 1.5194
DG(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) 0.3630 2.0458 3.9279 0.4104 0.3556 0.1291 0.2374 0.5307
Dihomo-gamma-Linolenoyl ethanolamide NA NA NA 1.6361 NA NA 0.0616 0.0300
Dihydrofolic acid 2.3449 0.6256 0.6472 1.0473 0.7604 1.2264 0.5738 0.7744
Dihydrothymine 3.4935 0.9742 0.1665 0.8685 0.8453 0.8850 0.2822 0.4849
Dihydroxyacetone Phosphate Acyl Ester NA 1.9846 0.6389 NA NA NA 0.0659 0.0636
Dimethylarsinous acid 1.1475 0.0152 0.0153 1.5886 2.2058 1.0866 0.7215 0.5631
Disialyllacto-N-tetraose 1.6334 0.3853 0.3507 1.4111 1.6673 0.8574 0.9506 0.7442
D-Limonene 1.1119 NA 0.1027 1.1702 0.8841 0.2029 0.0823 1.9702
Docosamide 0.0529 0.0518 0.0462 NA NA 2.8908 0.0650 0.0558
Dolichyl beta-D-mannosyl phosphate NA NA NA 2.2345 0.0844 NA NA 0.0433
D-Urobilin 3.7133 0.2327 0.0634 0.2828 0.0813 0.8807 NA 0.0669
Eicosenoic acid NA 0.3864 1.9147 NA NA NA 0.0967 NA
Endomorphin-2 0.6009 2.3474 2.6175 0.3752 0.4042 0.4236 0.7702 0.4610
Erucic acid 0.0180 1.9221 2.1600 0.1467 0.1414 NA NA NA
Estriol 3-sulfate 16-glucuronide 0.6936 0.1197 3.2554 0.2205 0.1360 0.9665 0.5910 0.1210
Fructose 1,6-bisphosphate 1.2306 0.2161 0.1243 3.3603 1.2551 0.2835 0.5670 0.1608
Gabapentin 4.1977 0.2935 0.6171 0.2568 0.2989 0.2104 0.3248 0.3249
Galabiosylceramide (d18:1/26:0) 0.4764 0.2072 0.2311 0.1532 0.3823 5.7751 0.2727 0.2961
Galactosylceramide (d18:1/14:0) NA 1.1873 1.6691 NA 0.0236 0.4690 NA NA
Gamma-Aminobutyryl-lysine 0.0543 1.8386 0.9960 NA NA 0.3908 0.0513 NA
Gamma-Glutamylcysteine NA 0.0732 0.0671 0.3699 0.5842 3.4164 0.0792 0.1802
Gamma-linolenyl carnitine 0.3002 1.2056 1.2709 0.6188 0.0426 0.0426 2.6305 NA
Ganglioside GM3 (d18:0/16:0) NA NA NA 2.7086 0.0702 0.0369 NA 0.2323
Ganglioside GM3 (d18:0/24:0) 1.1482 1.1558 1.1750 1.2965 0.4448 0.6700 1.1827 0.9270
Ganglioside GM3 (d18:0/25:0) 1.1211 0.9700 1.1579 1.1033 0.7359 0.7737 0.9332 1.2051
Ganglioside GM3 (d18:1/23:0) 1.1901 0.8911 0.9470 0.9756 0.9605 1.1946 0.9303 0.9107
Ganglioside GT3 (d18:1/16:0) 1.7185 0.0964 0.4633 0.9278 1.1830 1.1309 NA NA
Ganglioside GT3 (d18:1/18:1(11Z)) 0.6489 0.6058 0.5726 NA NA 0.0896 2.4762 NA
Geranylgeranyl-PP 2.6080 0.1953 0.2130 1.9241 1.6254 0.5549 0.5312 0.3482
Gestrinone 0.2205 0.2074 4.7735 0.3599 0.3729 0.1969 0.1818 0.6226
Glucosylceramide (d18:1/12:0) NA 1.7147 2.2831 0.0464 0.1212 0.1988 NA NA
Glucosylceramide (d18:1/26:0) 0.0195 0.0273 0.0199 4.2002 0.0893 0.0360 NA 0.3724
Glucosylsphingosine NA 0.0082 0.9493 1.2709 1.6419 0.0069 NA 0.7996
Glycocholic acid 0.1398 3.9287 0.1616 0.1158 0.1683 1.9823 0.1731 0.2361
Heptanoic acid 1.5225 0.7378 0.7475 1.0161 0.8090 0.6736 1.2650 1.2285
Hexacosanoic acid 0.0375 0.0539 0.0365 0.3763 3.5363 NA 0.0437 NA
Hexacosanoyl carnitine 1.2397 0.9392 1.0931 0.7582 0.7237 0.5572 0.5096 2.1793
Hexadecanedioic acid 0.0210 0.0318 2.4222 2.5177 0.0199 0.0179 0.0159 0.0169
Homophytanic acid 0.0001 1.9781 1.6881 0.0011 NA NA 0.0001 0.0001
Homoveratric acid 1.3035 0.7165 1.6461 0.4071 0.5942 0.6099 1.0733 1.2489
Hypogeic acid 0.0847 0.1745 0.0855 0.0962 0.0945 4.2568 0.0812 NA
Indoleacetyl glutamine 1.5952 0.6461 0.7872 1.0941 1.4872 1.2353 0.0807 0.4613
Inositol 1,3,4,5,6-pentakisphosphate 1.0202 0.5171 1.6549 0.9460 0.9801 1.3837 1.2002 0.2799
Iodotyrosine NA NA NA 0.1327 0.0947 1.8800 NA NA
Kinetensin 4-7 1.0231 0.9754 0.5907 1.3889 1.5603 1.5143 0.4790 0.4683
Kyotorphin 1.4333 0.0361 0.1499 0.0310 NA NA 1.0857 2.0133
Lactyl-CoA 3.0772 0.6094 0.5862 0.5896 0.4319 1.1644 1.1724 0.3689
L-Aspartyl-4-phosphate NA 0.0057 NA NA NA 1.9928 0.0109 0.0049
Leukotriene A4 0.2096 0.2450 2.7785 0.5258 0.6599 1.9102 0.1883 0.4147
Leukotriene F4 1.0682 1.1251 0.9491 0.9922 1.0785 1.0733 0.8110 0.9025
Linoleoyl ethanolamide 0.8669 0.1584 0.2753 5.0932 0.4774 0.0246 0.5217 0.2573
L(-)-Nicotine pestal 5.4577 0.3981 0.4199 0.2251 0.2681 0.3621 0.6315 0.2375
L-Octanoylcarnitine 0.8279 0.0785 0.1269 0.5317 0.2997 0.0858 4.3289 1.1087
LPA(0:0/16:0) NA 0.2109 0.1717 0.3558 NA 2.3017 0.1816 0.1748
LPA(0:0/18:0) 1.3640 0.7096 1.1949 0.8590 0.6386 0.7624 0.9172 1.5543
L-Palmitoylcarnitine 0.8619 0.2782 1.8664 0.4456 0.4753 0.7724 1.2304 2.0700
L-Urobilinogen NA 0.0042 3.1226 2.1050 0.0568 0.0016 NA 0.0442
LysoPC(14:0) 0.7155 0.3963 0.1205 2.2423 1.3330 2.6208 0.1293 0.4423
LysoPC(14:1(9Z)) 0.0279 0.0316 4.6067 0.6978 0.5963 0.2101 NA 0.8297
LysoPC(15:0) 0.4433 0.4817 0.4982 1.6965 1.7085 2.1025 0.2967 0.7725
LysoPC(16:0) 0.5005 0.4585 0.4465 1.6767 1.7580 2.0800 0.1698 0.9101
LysoPC(16:1(9Z)) 4.9125 0.7326 0.5831 0.1398 0.2767 0.3682 0.6827 0.3043
LysoPC(18:2(9Z,12Z)) 1.5969 0.2980 0.4398 1.2764 1.5560 1.0463 0.3864 1.4002
LysoPC(18:3(6Z,9Z,12Z)) 0.3719 0.4385 0.4989 1.3090 2.2784 1.8748 0.0225 1.2060
LysoPC(18:4(6Z,9Z,12Z,15Z)) 2.5355 0.1509 0.8901 0.4190 0.8306 1.4637 1.0265 0.6105
LysoPC(20:3(5Z,8Z,11Z)) 0.2826 0.4072 0.3030 1.5853 1.5866 2.9120 0.6263 0.2972
LysoPC(20:4(5Z,8Z,11Z,14Z)) 0.4433 0.3378 0.2981 1.6450 2.0132 2.1557 0.5829 0.5240
LysoPC(22:0) 4.6418 0.2700 0.3694 0.2600 0.1289 0.3525 0.4649 0.4424
LysoPC(22:1(13Z)) 4.4613 0.4270 0.5367 0.4058 0.4706 0.5490 0.6873 0.4623
LysoPE(0:0/16:0) 0.5579 0.3942 0.3976 1.6649 1.6207 2.0322 0.1334 1.1991
LysoPE(0:0/16:1(9Z)) 0.7742 0.4956 0.5502 1.5088 1.1979 1.5622 0.1294 1.7816
LysoPE(0:0/18:1(11Z)) 0.5369 0.4213 0.3723 1.6945 1.4563 2.2175 0.6627 0.6386
LysoPE(0:0/18:2(9Z,12Z)) NA 0.7457 2.4982 0.0903 0.0671 0.0439 NA NA
LysoPE(0:0/18:3(6Z,9Z,12Z)) 0.5509 0.4160 0.4625 1.5281 1.9325 1.7182 0.2160 1.1757
LysoPE(0:0/20:1(11Z)) 2.5194 0.0712 0.1567 NA NA NA NA 0.0713
LysoPE(0:0/20:2(11Z,14Z)) 2.8984 NA 0.1349 0.1695 0.4812 0.4305 0.3231 0.1658
LysoPE(0:0/20:3(11Z,14Z,17Z)) 0.3311 0.4962 0.4666 1.3168 1.7064 1.8857 1.0005 0.7969
LysoPE(0:0/20:4(5Z,8Z,11Z,14Z)) 0.6270 0.4557 0.3898 1.4912 1.4254 2.2349 0.7235 0.6525
LysoPE(0:0/22:5(4Z,7Z,10Z,13Z,16Z)) 0.9529 0.3325 0.5133 0.5074 0.4588 1.8876 0.4725 2.1184
LysoPE(0:0/24:6(6Z,9Z,12Z,15Z,18Z,21Z)) 4.5187 0.4273 0.7009 0.1246 0.4624 0.7579 0.5954 0.4127
LysoSM(d18:1) 2.3284 0.8768 1.7083 0.1240 0.0491 0.1872 0.9208 0.6084
Margaroylglycine 0.0032 0.0729 0.0461 NA NA 4.2102 0.0030 0.0029
MG(0:0/20:2(11Z,14Z)/0:0) 0.5239 2.3956 0.5543 0.5440 0.5983 2.1953 0.5960 0.5927
MG(0:0/20:5(5Z,8Z,11Z,14Z,17Z)/0:0) 1.4123 0.9516 0.6104 1.0064 0.7741 NA 1.1574 1.0876
MG(0:0/24:6(6Z,9Z,12Z,15Z,18Z,21Z)/0:0) 1.2474 0.9710 0.3816 NA NA NA 0.7001 1.6999
MG(18:0/0:0/0:0) 0.7399 0.8687 0.8904 1.4063 1.4922 1.0324 0.9204 0.6497
MG(18:0e/0:0/0:0) NA 0.0036 NA NA 0.0316 2.6411 0.0030 0.0068
Molybdenum cofactor (sulfide) 5.2641 0.2665 0.3279 0.3714 0.3093 0.4330 0.4918 0.5360
Myristic acid NA NA NA 0.1730 0.4675 2.3594 NA NA
N-Acetyl-L-glutamate 5-semialdehyde 0.4475 0.3714 0.3682 4.6305 0.4362 0.3304 0.4873 0.3723
Neuroprotectin D1 5.1365 0.1125 0.3316 0.1494 0.1066 0.1608 0.3956 0.1401
N-Heptanoylglycine 1.7396 0.0965 0.2724 1.4848 1.2034 0.9706 0.2570 1.6745
N-Lignoceroylsphingosine 1.9789 0.5644 0.7192 0.7635 0.2154 0.0377 2.1909 1.2093
N,N-Dimethylaniline 0.7731 1.3935 NA NA NA NA 0.1031 1.4786
Nodeca-10(Z)-enoic acid 2.1184 0.7433 1.8490 0.7641 1.6525 0.1163 0.1107 0.6443
Nodecanoic acid NA 0.7554 1.2446 NA NA NA NA NA
N-Undecanoylglycine 4.4707 0.4616 0.1424 0.0083 0.0937 0.0856 0.2805 1.8502
Oleamide 1.5074 0.3083 0.4609 0.1164 0.0727 0.0225 1.1589 4.3529
O-(N-acetyl-a-neuraminosyl)-(2->3)-O-b-D-galactopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-b-D-glucopyranosyl-(1->3)-O-b-D-galactopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-b-D-glucopyranosyl-(1->3)-O-b-D-galactopyranosyl-(1->4)- D-Gluc 1.4287 0.7935 0.8680 1.2745 1.0813 1.1046 0.7351 0.7144
P1,P4-Bis(5^-adenosyl) tetraphosphate NA NA NA 1.5781 NA 0.1320 0.1336 NA
Palmitic acid NA 0.0028 NA NA 0.0115 2.3243 NA 0.0014
Palmitic amide 0.0551 NA 0.0558 0.0558 0.0575 NA NA 3.5177
Palmitoylglycine 1.5444 0.6358 0.7613 0.3209 0.3393 0.2476 3.3926 0.7582
PC(14:0/15:0) 0.8621 0.7115 0.8797 0.9312 1.0063 0.9445 0.4373 2.2272
PC(14:0/18:1(11Z)) 6.4438 0.2317 0.0427 0.0438 0.0154 0.0064 0.0904 1.1259
PC(14:0/18:2(9Z,12Z)) 0.0374 0.6477 6.5810 0.0236 0.0038 0.0025 0.0111 0.0349
PC(14:0/20:5(5Z,8Z,11Z,14Z,17Z)) 4.5226 0.2930 0.4193 0.4365 0.5120 0.5586 0.5957 0.6623
PC(14:0/22:1(13Z)) 0.8195 0.6108 0.7145 1.1523 1.1916 0.9398 0.7944 1.7771
PC(14:1(9Z)/16:1(9Z)) 0.1456 0.0989 5.7999 0.6610 0.9371 0.1329 0.1120 0.1126
PC(14:1(9Z)/18:4(6Z,9Z,12Z,15Z)) 5.5884 0.0677 0.1336 0.0817 0.1137 0.3810 0.1358 0.2990
PC(14:1(9Z)/P-16:0) 1.3949 0.8446 0.9403 0.9663 0.7349 1.2547 0.8261 1.0382
PC(14:1(9Z)/P-18:1(11Z)) 0.1246 0.0202 5.3731 0.8137 0.3280 0.0189 0.0149 0.3260
PC(15:0/16:1(9Z)) 1.1966 0.6737 0.8070 1.2359 0.9093 1.1150 0.9352 1.1274
PC(15:0/20:3(5Z,8Z,11Z)) 0.7874 0.9104 0.6734 0.7729 1.5371 0.6391 1.0677 1.6119
PC(15:0/20:4(5Z,8Z,11Z,14Z)) 3.0359 0.1255 0.6331 0.0829 0.6743 0.3843 2.5650 0.4991
PC(15:0/22:0) 0.1842 0.0061 0.0065 0.7770 1.3144 3.6604 0.0172 0.0069
PC(15:0/22:1(13Z)) 0.8872 NA 2.3975 0.3361 1.0463 1.2550 0.1326 0.8355
PC(15:0/22:2(13Z,16Z)) 3.0273 0.8357 1.3959 0.3582 0.1131 0.0238 0.9027 0.6925
PC(15:0/24:1(15Z)) 0.6101 0.8058 2.5880 0.3574 1.5924 0.8139 0.4996 0.7328
PC(16:1(9Z)/22:2(13Z,16Z)) 0.6287 0.5395 1.7043 1.1007 2.1318 0.5990 0.2997 1.2311
PC(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.1326 0.0750 0.1032 1.4653 1.2905 4.7706 0.0814 0.0814
PC(18:1(9Z)/18:1(9Z)) 0.1373 0.1624 0.1214 1.4016 1.1992 1.7032 0.3232 2.9517
PC(18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.1423 1.4244 1.2450 1.2721 1.6895 1.8564 0.0174 0.0255
PC(18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)) NA 0.0161 2.2608 1.9190 0.1758 NA NA 0.3002
PC(18:3(6Z,9Z,12Z)/P-18:1(11Z)) 0.6717 0.5427 0.8660 1.4245 1.4381 1.2539 0.8022 1.0008
PC(18:4(6Z,9Z,12Z,15Z)/P-16:0) 0.6300 0.4473 0.4571 1.3613 1.0523 1.4258 1.4781 1.1481
PC(20:0/24:0) 0.0031 0.0914 0.2699 6.9232 0.2716 0.0947 0.0099 0.0038
PC(20:2(11Z,14Z)/P-18:1(11Z)) 2.4056 0.2391 0.2965 1.1134 0.9890 2.2732 0.3317 0.3515
PC(20:3(5Z,8Z,11Z)/P-18:1(11Z)) 0.3428 0.4087 0.4367 1.3625 1.2600 3.0766 0.5018 0.6109
PC(20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.0899 0.0871 0.0267 0.8201 0.2404 4.4540 NA 0.0231
PC(20:4(5Z,8Z,11Z,14Z)/P-18:1(11Z)) 0.9005 0.1500 0.0953 0.4391 0.2075 0.2109 5.3309 0.6659
PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(11Z)) 0.5547 0.7694 1.1176 0.7077 0.7519 0.3423 2.9573 0.7992
PC(22:0/24:1(15Z)) NA 0.0599 0.0133 2.1572 4.0370 0.0553 0.0127 0.0034
PC(22:0/P-18:1(11Z)) 0.0605 1.7914 2.0162 0.0855 NA NA NA 0.1302
PC(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.5093 0.7930 1.5812 1.4097 1.2619 0.7755 0.5484 1.1209
PC(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.0059 0.0238 NA 1.0802 1.0187 2.2211 0.0048 NA
PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/P-18:1(11Z)) 0.7852 0.4175 1.1423 0.5214 0.4119 0.2287 3.8499 0.6433
PC(24:0/24:1(15Z)) NA 0.0047 0.0037 2.3120 3.6558 0.0214 0.0023 NA
PC(24:1(15Z)/24:1(15Z)) 0.0019 0.1359 0.1841 0.3805 6.2664 0.0010 0.0303 0.0010
PC(24:1(15Z)/P-18:1(11Z)) 0.0159 1.3499 1.9550 0.0171 NA NA 0.0262 NA
PC(o-18:0/24:0) 0.5705 0.4253 0.2876 0.6363 0.6706 0.6940 2.9836 1.8107
PE(14:0/14:0) 1.5379 1.1288 0.8087 0.9072 1.1629 1.0041 0.5195 0.9310
PE(14:0/14:1(9Z)) 0.0077 0.0080 3.0159 2.5509 0.0578 0.0089 0.0072 0.0290
PE(14:0/P-18:1(11Z)) 1.4938 0.7066 2.4017 0.7050 0.5721 1.0308 0.3298 0.7602
PE(14:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.0100 0.0060 4.8097 1.3008 0.0041 0.0110 0.0039 0.1989
PE(14:1(9Z)/P-16:0) 3.8625 0.8875 0.5608 0.1950 0.2568 0.6609 0.3693 0.2476
PE(15:0/18:4(6Z,9Z,12Z,15Z)) 2.4992 0.1505 NA 0.1294 0.5099 1.6492 0.0708 0.4158
PE(15:0/P-16:0) 2.6456 0.7342 0.7807 0.8193 0.7983 1.3160 0.2109 0.4320
PE(16:0/P-18:1(11Z)) 0.6111 0.1729 1.6762 2.8015 0.4127 0.2391 1.8974 0.1891
PE(16:1(9Z)/P-18:1(11Z)) NA 0.0578 3.0040 0.9710 0.1383 NA NA 0.2008
PE(18:1(11Z)/22:2(13Z,16Z)) 0.2459 0.5515 1.0747 0.8140 1.3707 1.4118 1.4522 1.0791
PE(18:3(6Z,9Z,12Z)/P-16:0) 0.8062 0.5735 0.6489 0.6485 0.7244 0.7146 3.3183 0.5655
PE(18:4(6Z,9Z,12Z,15Z)/P-18:1(11Z)) 1.6783 0.9717 0.7712 0.8749 1.0485 1.1437 0.4555 1.0562
PE(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.2742 0.9103 4.3551 1.8401 0.1024 0.0748 0.3045 0.1386
PE(20:1(11Z)/24:1(15Z)) 0.1480 0.0706 2.7479 2.4651 0.1716 0.1142 0.0322 NA
PE(20:5(5Z,8Z,11Z,14Z,17Z)/24:1(15Z)) 0.0153 0.0857 0.2098 2.2691 1.7825 0.0573 NA NA
PE(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.2691 2.1986 1.7506 0.6444 1.0331 0.1103 1.2781 0.7157
PE(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z)) 0.0135 0.0379 0.0116 2.5953 2.7766 0.2254 0.0262 0.0275
PE(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) NA NA NA 3.2089 0.0366 0.0308 0.0325 0.4020
Pentacosanoylglycine 1.6434 0.0068 0.0138 1.9986 1.4124 0.9347 0.0177 0.9841
PG(16:0/16:0) 1.6470 1.0428 1.0464 0.8244 0.9653 1.0552 0.4448 0.9741
PG(16:0/20:3(5Z,8Z,11Z)) NA NA 0.1975 0.2508 0.4473 1.9643 NA 0.2115
PG(18:0/18:0) NA NA NA 1.5518 1.9027 0.0224 0.2861 0.0194
PG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)) 0.2866 0.1593 0.2258 0.8494 5.7563 0.1190 0.4824 0.1212
PG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.5353 0.1960 0.2761 0.7244 5.6736 0.1695 0.0986 0.3265
PGF2a ethanolamide 0.8437 1.3179 1.0941 0.4146 NA 0.0128 2.1491 0.8388
PGP(16:0/22:5(4Z,7Z,10Z,13Z,16Z)) 0.4534 NA NA NA NA NA 0.0603 2.1731
PGP(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 1.4839 0.3725 0.8068 1.2881 1.2536 1.1440 NA 0.5868
PGP(18:0/18:1(11Z)) 1.5175 0.5296 0.4919 0.6592 0.5035 0.3574 2.2845 1.6563
PGP(18:0/20:3(5Z,8Z,11Z)) 0.3860 0.2446 0.3173 0.1308 0.4802 5.3036 0.5666 0.5708
PGP(18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z)) 1.3378 0.8593 1.0837 0.8905 1.2322 1.2729 0.6106 0.7129
Phosphohydroxypyruvic acid 0.3388 0.1288 NA NA NA NA 1.8960 1.0557
Phytoene NA NA 1.2857 NA NA NA NA 0.1429
Phytosphingosine 0.0011 0.0022 NA 0.7965 1.8690 NA NA NA
Phytosphingosine-1-P 0.0694 0.0765 0.0785 2.8199 0.1765 0.0727 NA 0.0667
PI(16:0/16:0) 5.4034 0.1548 0.3214 0.1399 0.3887 0.3759 0.5241 0.4050
PI(16:0/16:2(9Z,12Z)) NA 0.0974 NA 1.7783 NA NA NA 0.2839
PI(16:0/18:1(11Z)) 0.9977 0.3348 0.5621 0.4756 0.2679 0.3258 3.7324 1.3038
PI(16:0/20:0) 1.2861 0.2838 0.5690 1.0721 1.3426 0.6359 1.1899 1.6205
PI(16:0/20:3(5Z,8Z,11Z)) 0.3541 NA NA 0.9879 3.1839 0.3739 0.1588 0.0708
PI(16:0/22:2(13Z,16Z)) 1.4420 0.6061 0.8967 0.8036 0.5648 0.4563 2.1817 1.0488
PI(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.3382 0.2827 0.3219 1.5358 1.2759 2.2660 NA 0.9375
PIP(16:0/20:1(11Z)) 0.0447 1.5451 2.2910 0.0915 0.0401 NA 0.1363 0.0427
Pregnetriol NA 1.3017 0.9954 NA NA NA NA 0.1087
Procaine 0.0382 0.0674 2.8059 1.0529 0.8868 0.0438 0.0845 1.7691
Propinol adenylate NA 0.0023 NA 0.9513 1.1137 1.2675 NA NA
Propionylcholine NA NA NA 1.7760 1.1617 1.9764 0.0451 0.0365
Prostaglandin E2 ethanolamide 0.9102 0.8633 0.7984 1.5741 1.0522 0.1339 1.4084 1.2596
Prostaglandin F2a 3.1097 0.0821 0.0831 0.1627 0.0818 0.0868 NA 0.0877
PS(14:0/16:1(9Z)) 0.3316 0.0359 2.8741 0.8418 0.6621 NA NA 0.9331
PS(14:1(9Z)/18:3(9Z,12Z,15Z)) 4.0174 0.3745 0.5191 0.4389 0.4563 0.7084 0.7440 0.7415
PS(16:0/16:0) 1.4947 0.7806 1.0030 0.9751 0.7914 0.8284 1.4442 0.6825
PS(18:0/20:0) 0.4735 1.4818 3.4419 1.1722 0.4017 0.1880 0.3321 0.5088
Pseudoephedrine 5.5286 0.1079 0.3062 0.1094 0.1498 0.2738 0.1297 0.3646
(R)-3-Hydroxy-Octadecanoic acid 1.4334 0.6396 0.7806 1.1302 1.0903 1.5015 0.3224 1.1020
(R)-Amphetamine 1.4241 0.8855 1.5337 0.4001 1.3433 0.7400 1.5056 0.3091
Retil 0.6299 0.1695 0.1984 1.2482 0.4913 0.1282 0.7898 3.5004
Retinoic acid 0.0878 0.2281 3.5551 0.6698 0.7502 NA NA 0.7090
Retinoyl b-glucuronide NA NA NA 1.4119 NA NA 0.1762 NA
Ribose 1,5-bisphosphate 2.2904 0.0575 0.0670 1.1378 1.0790 0.4770 2.1898 0.7016
(S)-2,3-Epoxysqualene 2.1737 0.6398 0.8444 1.3795 1.2971 1.3800 0.1053 0.1802
S-Adenosylmethionimine 0.0129 0.0112 0.1010 NA NA 2.9154 0.0138 NA
Selenocysteine 1.0613 0.6366 1.0234 NA NA 0.0489 1.1800 1.7327
SM(d17:1/24:1(15Z)) 1.5347 0.8768 0.7179 0.8782 1.2367 0.5851 0.6460 1.5246
SM(d18:0/12:0) 1.4686 0.9336 0.9059 0.7401 0.4931 0.4059 2.0691 0.9837
SM(d18:0/14:0) 0.1092 2.8669 1.7108 0.0478 0.0578 NA 0.2586 NA
SM(d18:0/26:1(17Z)) 0.1404 2.7969 2.2671 0.0278 NA NA 0.0627 0.0569
SM(d18:1/14:0) 0.0346 3.3220 1.6072 0.0412 NA 0.0219 0.4603 0.0418
SM(d19:1/24:1(15Z)) 1.5195 0.9123 0.7545 0.8496 1.1538 0.4003 0.9353 1.4746
(S)-Succinyldihydrolipoamide 1.2474 1.0302 1.2143 1.3761 0.1160 NA 1.0633 0.9528
Stearoylethanolamide NA NA NA 0.1371 1.8642 0.1333 NA NA
Testosterone glucuronide 4.6713 0.2259 0.2049 0.6045 0.3151 0.7568 0.2119 0.2850
Tetracosahexaenoic acid 3.3386 0.0897 0.3434 NA 0.1069 0.0954 0.5192 0.1044
Tetrahydroaldosterone-3-glucuronide 0.4323 0.0504 0.0772 0.0994 0.1274 0.0924 0.1900 6.4391
TG(15:0/16:0/20:2(11Z,14Z))[iso6] 1.8333 1.2079 0.6215 0.1155 0.0896 0.0444 1.9789 2.1090
TG(15:0/16:0/20:3(8Z,11Z,14Z))[iso6] 0.5635 0.4697 1.0064 0.2002 0.2179 0.0738 2.0262 3.4423
TG(15:0/16:0/20:4(5Z,8Z,11Z,14Z))[iso6] 0.8187 2.2421 0.3043 0.2413 0.1753 0.0498 1.0979 3.0707
TG(15:0/18:1(9Z)/16:0)[iso6] 1.0528 0.2163 0.3496 0.0986 0.0725 0.0302 1.2133 4.9666
TG(15:0/18:1(9Z)/16:1(9Z))[iso6] 0.3151 0.6962 0.9427 0.7285 0.3752 0.5386 1.0245 3.3601
TG(16:0/14:0/16:0)[iso3] 0.0337 2.9657 0.9483 NA NA 0.0245 0.0493 0.0505
TG(16:0/16:0/16:0)[iso] 1.7992 0.7822 0.8623 0.3667 0.2830 0.1104 1.5783 2.2179
TG(16:0/16:0/16:1(9Z))[iso3] 1.0950 0.5704 0.6969 0.1145 0.1293 0.0321 2.0732 2.9661
TG(16:0/16:0/18:1(9Z))[iso3] 1.8612 0.7691 1.4296 0.3053 0.1937 0.0857 0.6136 2.7419
TG(16:0/16:0/18:2(9Z,12Z))[iso3] 0.9454 1.7783 1.9165 0.2112 0.2467 0.4328 1.5272 0.9419
TG(16:0/16:0/20:1(11Z))[iso3] 0.4815 0.0248 0.0245 3.6642 1.5402 1.7174 0.1927 0.3547
TG(16:0/16:1(9Z)/16:1(9Z))[iso3] 0.5038 3.3815 1.2019 0.2146 NA NA 0.3181 0.1184
TG(16:0/18:0/18:2(9Z,12Z))[iso6] 1.8512 1.2274 0.8840 0.3862 0.2416 0.0853 1.6065 1.7178
TG(16:0/18:0/20:1(11Z))[iso6] 1.8054 0.3950 0.4248 1.6256 1.4683 0.8565 0.9764 0.4480
TG(16:0/18:1(9Z)/20:1(11Z))[iso6] 1.7174 0.2434 0.7840 0.3061 0.3192 0.4770 1.2253 2.9274
TG(16:0/18:2(9Z,12Z)/20:1(11Z))[iso6] 0.6897 0.1141 0.1502 1.2767 2.1644 2.0622 0.4659 1.0768
TG(16:0/20:0/20:4(5Z,8Z,11Z,14Z))[iso6] 0.0111 2.0308 3.4444 0.0258 0.0355 0.1231 NA 0.0100
TG(16:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6] NA 1.1372 2.1927 NA 0.0025 0.0028 NA 0.0023
TG(16:1(9Z)/14:0/16:1(9Z))[iso3] 1.4543 0.3351 0.2619 NA NA NA 0.8000 2.3001
TG(18:0/18:2(9Z,12Z)/20:1(11Z))[iso6] 1.2091 0.4100 1.3276 0.2330 1.7340 0.3623 1.5830 1.1410
TG(18:0/20:0/20:0)[iso3] 1.8994 0.0898 0.1385 1.9361 1.3461 1.2290 0.7360 0.6250
TG(18:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6] NA 1.9667 3.9705 0.0093 0.0232 0.0242 NA 0.0061
TG(18:1(9Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6] NA 2.1223 3.7809 0.0144 0.0152 0.0456 0.0216 NA
TG(18:2(9Z,12Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6] NA 1.0048 2.2877 0.0064 NA 0.0279 0.0602 NA
TG(20:0/20:1(11Z)/20:1(11Z))[iso3] 0.2268 2.7888 2.6719 0.1391 0.1121 0.0788 1.8781 0.1043
TG(20:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6] 0.8223 0.2124 0.3908 1.7471 2.1970 0.0238 1.3977 0.8835
TG(20:0/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z))[iso3] 0.0148 0.0040 0.0060 0.1576 0.1274 7.6682 0.0106 0.0113
TG(20:1(11Z)/20:1(11Z)/20:1(11Z)) NA 1.6796 1.4315 NA NA 0.0129 NA NA
TG(20:1(11Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso3] 1.5093 0.4169 0.6973 0.1750 0.1428 0.1623 2.8221 1.7950
TG(20:4(5Z,8Z,11Z,14Z)/14:0/18:3(9Z,12Z,15Z))[iso6] 0.4484 1.1074 0.7742 1.6970 1.0170 0.0635 0.5735 2.0067
TG(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] 0.3352 0.3437 0.3028 0.2131 0.6907 3.3007 0.9767 1.1266
TG(20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3] 1.5246 0.6964 0.8503 1.3742 1.2167 0.1234 1.0520 1.1625
TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] 1.5702 1.3653 1.4401 0.7139 0.4916 0.0660 1.0928 1.2601
TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] 2.0545 0.7480 0.9918 0.7645 0.2697 0.2486 1.3889 1.5339
Thymol 1.1036 0.5976 0.6874 0.8975 0.4050 0.5704 2.2267 1.1703
trans-D-Decenoyl-CoA NA 0.0539 NA 2.1217 0.0962 NA NA 0.7962
Tridecanoic acid 0.7226 0.4657 0.0535 0.9316 3.7355 1.4012 0.0292 0.1670
Trihexosylceramide (d18:1/24:0) NA NA NA 0.0040 1.3320 NA NA NA
Trihexosylceramide (d18:1/24:1(15Z)) 0.0216 0.0148 0.0075 NA 3.9663 0.0070 0.0072 0.0066
Trihexosylceramide (d18:1/9Z-18:1) NA NA 1.1239 3.1253 0.0151 0.0163 NA 0.0633
Triphosphate 1.8849 0.5958 0.5456 0.3903 0.3457 0.6106 1.5561 2.2563
Triterpenoid 0.4304 0.0514 0.0757 0.5298 0.4907 0.4881 NA 4.9340
Ubiquinol-6 5.2710 0.1822 0.3677 0.2779 0.4060 0.2813 0.9246 0.2390
Undecanoylcholine NA 1.7516 1.5245 NA 0.0193 NA 0.0172 0.1179
Uroporphyrinogen III 0.0073 0.0138 0.0446 4.6648 0.4403 0.1195 0.0048 1.7105
Venlafaxine 0.1781 0.0443 0.0450 0.3806 1.2048 3.2631 0.0711 NA
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Factors:

F1Concentration (uM):0 | Treatment_compound:BSA
F2Concentration (uM):500 | Treatment_compound:CB-cis
F3Concentration (uM):500 | Treatment_compound:CB-trans
F4Concentration (uM):500 | Treatment_compound:CK-cis
F5Concentration (uM):500 | Treatment_compound:CK-trans
F6Concentration (uM):500 | Treatment_compound:K-cis
F7Concentration (uM):500 | Treatment_compound:Oleic acid
F8Concentration (uM):500 | Treatment_compound:Palmitic acid
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