Data for (Study ST002787)

(Analysis AN004534)

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

Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

MetaboliteF1F2F3F4F5F6
10-Formyl-Thf 0.8410 0.8528 0.2878 1.1524 2.1977 0.3794
1-(2,4-Dihydroxyphenyl)-2-(4-hydroxyphenyl)propan-1-one 0.2466 0.0362 2.6120 0.9907 0.6681 2.0894
1,3-Dicyclohexylurea 0.9434 0.9501 1.0409 1.0003 1.0539 1.0258
1,4-Dihydro-1-Methyl-4-Oxo-3-Pyridinecarboxamide 0.8993 1.1174 1.5052 0.7090 1.1530 0.4500
15-keto Prostaglandin E1 2.2795 1.7760 0.1404 0.3673 0.9466 0.2481
16-Dehydroprogesterone 1.0441 1.6532 1.3041 0.7051 0.5513 0.4310
1,7-Dimethylxanthine 0.4183 0.5660 0.2959 0.6942 2.0597 2.3439
18ß-Glycyrrhetinic acid 1.9401 1.5914 0.7254 0.4673 0.4956 0.7359
1-Acetylindole 1.1860 1.2949 0.9249 0.9072 0.7596 0.8254
1-amino-1-cyclobutane carboxylic acid 1.1613 1.2020 1.0545 0.8874 1.0014 0.5283
1-deoxyvaleric acid 1.0041 1.0044 0.9692 1.0213 1.0141 0.9729
1-Hydroxylamino-2-phenylethane 1.1034 1.2406 0.9011 1.1140 0.7302 0.7744
1-Methyladenosine 1.0595 1.4680 0.6884 1.0973 0.8070 0.5844
1-Methylguanine 0.9307 1.3064 0.7710 0.8142 0.9288 1.1999
1-Methylguanosine 1.1583 1.0740 1.0286 0.7171 1.0755 0.9700
1-Methyl-hydantoin 0.4576 0.6456 2.3141 0.4180 1.2801 1.0612
1-Methylpiperidine-2-carboxylic acid 0.7004 0.5635 0.9655 0.7412 1.1393 2.4328
(1R,6S)-6-amino-5-oxocyclohexyl-2-ene-1-carboxylic acid ester 1.0252 1.2446 0.8629 1.2242 0.7433 0.7146
20,26-dihydroxyecdysone 1.4549 1.5212 0.8258 0.9024 0.6086 0.4442
2,2^-Cyclouridine 1.2134 1.3914 0.6855 0.8853 0.5004 1.3512
2,2-Dihydroxymethyl-1-azabicyclo[2.2.2]octan-3-one 1.4010 1.2295 0.7222 0.9970 0.8902 0.6321
2,4-diacetamino-2,4,6-triphenoxy-D-mannopyranose 0.5682 0.9883 0.8560 1.1922 1.5742 0.5529
2,4-Dihydroxypteridine 1.1160 1.1548 0.7694 0.6158 1.0379 1.4271
2,4-Quinolinediol 0.8962 0.9818 1.3501 0.9942 0.8545 0.9165
2,5-Dimethyl-2,3-dihydrofuran-3-one 2.3603 0.7063 0.6893 0.5276 0.9013 1.2860
2,6-Diaminopimelic acid 1.0434 0.9720 0.8806 0.7365 0.5880 2.1975
2,8-Quinolinediol 0.8962 0.9818 1.3501 0.9942 0.8545 0.9165
2-Acetyl-5-methylfuran 1.3705 0.9178 0.8152 0.7471 1.1888 1.0889
2-Acetylfuran 1.0683 1.0913 0.9397 0.9075 0.9769 1.0067
2-Amino-3-phosphonopropionic acid 0.6121 1.1163 1.1953 0.6327 1.2161 1.2268
2-Amino-4-methylphenol 1.1144 1.1219 0.9357 1.0630 0.8222 0.8857
2-amino-6-chloropurine 0.7669 1.0667 0.7602 1.6842 0.9337 0.4800
2-amino-6-methylmercaptopurine 0.9876 1.0922 0.9310 0.8269 1.0383 1.1466
2-Aminoethylphosphonate 1.3692 2.3584 0.1956 1.2847 0.0373 0.0314
2-Aminomethylpyrimidine 0.7587 1.2276 0.7704 1.4378 0.7329 0.8591
2-Aminopurine 1.0697 0.9211 0.9016 1.3148 0.7351 1.1000
2^-Deoxyadenosine 0.9842 0.7450 0.9402 1.5072 0.7687 1.1309
2^-Deoxyinosine-5^-monophosphate 0.8585 0.7015 0.7126 0.6140 1.5132 1.9618
2-Hydroxy-2-methylbutanenitrile 1.8914 1.5432 0.6932 0.6526 0.5750 0.5156
2-Hydroxy-3-(4-hydroxyphenyl)propanoic acid 0.6696 0.2030 1.2453 0.7200 1.9839 1.5534
2^-Hydroxy-5^-methylacetophenone 0.8234 0.8118 0.8146 0.9645 0.9608 1.9289
2-Hydroxy-6-Aminopurine 1.0172 0.9412 0.8787 1.1834 0.9240 1.0778
(2-Hydroxyethyl)phosphonic acid 0.4212 0.8154 0.7568 2.0762 0.8704 0.8438
2-Methoxy estrone 0.6563 1.0152 0.4293 0.6400 0.9925 2.7140
2-Methyl-1-Pyrroline 0.7131 1.2028 1.0841 1.1457 0.8300 0.8582
2-Methylguanosine 0.9967 1.0903 0.9013 0.6574 1.3969 0.9094
2-O-Methylcytosine 1.3160 1.1046 0.6268 0.6187 1.0542 1.4509
2^-O-methylguanosine 0.8702 0.6912 1.5225 0.9055 0.8838 1.3705
2-Pentyl-3-phenyl-2-propenal 0.9298 1.0684 1.0470 1.0354 0.9021 0.9788
2-Phenylacetamide 1.4705 0.9830 1.5073 1.2275 0.3869 0.3669
2-Phenylglycine 1.3724 1.0174 0.9986 0.4853 0.6897 1.8144
2-Phenylpropylamine 1.3600 1.4130 0.4891 1.2708 0.5134 0.7708
2-pyridyl amidoxime 1.8123 1.8645 0.3998 0.6588 0.5743 0.3742
(2S,3S)-3-methylphenylalanine 1.0436 1.1655 0.4090 0.9467 0.9809 1.5330
(2S,3S)-butane-2,3-diol 1.0344 1.3032 0.8173 1.2104 0.6998 0.7395
3,3^,5-Triiodo-L-Thyronine 1.0215 1.1082 0.6996 0.8051 0.8857 1.6480
3,6,9,12,15,18,21-Heptaoxatricosane-21,23-diol 2.0716 1.3094 0.4435 0.7151 0.6909 0.8135
3-Amino-2-menacarboxylic acid 0.5447 0.6433 0.9754 0.9022 1.5795 1.5332
3-Amino-2-piperidinone 1.6562 0.6095 2.0123 0.7901 0.4522 0.7872
3-aminobenzamide 1.0042 1.9134 0.5558 0.6912 0.9111 0.4589
3-aminopropionitrile 1.1338 1.1803 1.0116 0.8962 1.0451 0.5795
3-aminoquinoline 1.2211 2.2120 0.6255 0.5838 0.4030 0.4729
3-Carboxypropyltrimethylammonium 1.5947 1.3957 0.4821 0.8619 0.7552 0.8240
3-Chloroaniline 0.6824 0.6649 1.3431 1.0753 1.2196 1.1067
3-Dehydrosphinganine 1.4973 1.5918 0.6109 0.7208 0.3825 1.1727
3^-Deoxyadenosine 1.0392 0.8663 0.8778 1.4384 0.7147 1.1074
3-Guanidinopropionic acid 1.0883 1.2576 0.9407 1.1437 0.6927 0.7159
3-Hydroxyphenylurea 0.9612 0.9585 1.0608 0.9641 1.0788 0.9824
3-(imidazol-4-yl)propionic acid 1.6460 0.9360 0.7848 1.4366 0.6216 0.5322
3-Methoxybenzoic acid 0.2364 0.2418 1.0606 0.8269 2.9489 0.6142
3-Methyladenine 0.6518 0.6748 0.9945 0.9265 1.2340 1.8023
3-(Methylthio)-1-propanol 0.9178 0.9269 1.1133 1.2863 0.8151 0.9090
3-Methylxanthine 0.8053 1.0086 0.6255 0.6740 1.3366 1.7212
3-pyridine aldoxime 1.0212 0.9623 1.0878 0.7913 1.1227 1.0770
4-(4-Hydroxyaniline)-6,7-Dimethoxyquinazoline JANEX-1 1.0020 0.9953 1.0062 0.9222 1.0506 1.0458
4-Acetamidobutyric Acid 0.4451 1.4237 1.1453 0.8507 0.7801 1.2079
4-Amino-3-methylphenol 1.1144 1.1219 0.9357 1.0630 0.8222 0.8857
4-Amino-5-hydroxymethyl-2-methylpyrimidine 1.3538 0.5782 0.7431 0.9525 1.1928 1.5240
4-(Aminomethyl)benzoic acid 1.5918 1.1873 1.2871 0.6142 0.6074 0.7676
4-Chloroaniline 1.0172 0.9765 1.0260 0.8928 1.1046 1.0034
(4-ethoxyphenyl)urea 1.6437 2.1578 0.4524 0.7903 0.2324 0.2436
4-Guanidinobutyric Acid 0.9321 0.7862 1.3541 0.7619 1.2221 1.0607
4-Hydroxybenzaldehyde 0.8687 1.4719 1.5488 0.8445 0.6524 0.2846
4-Hydroxydebrisoquine 1.7240 0.2698 0.6762 0.4410 1.6949 1.8294
4-Methoxy estrone 0.6563 1.0152 0.4293 0.6400 0.9925 2.7140
4-tert-butylbenzoic acid 0.7844 0.8993 1.2623 1.2401 0.8850 0.8872
(4Z,7Z,10Z,13Z,16Z,19Z)-Eicosahexaenoate 1.5917 1.6420 0.4988 0.3314 1.2275 0.4649
5-Aminoimidazole-4-carboxamide 0.8752 0.7057 2.0163 1.0960 0.5481 0.8803
5-Aminoimidazole ribonucleotide 1.1064 1.6640 0.5424 0.6780 0.8239 0.9872
5-Aminolevulinate 0.8522 0.9012 0.6214 0.9163 1.9334 0.5989
5-Aminovaleric Acid 1.1860 1.3686 0.6322 1.0546 0.7752 0.8177
5^-Deoxy-5^-fluoroadenosine 1.2257 1.1891 0.8838 0.8296 0.8291 1.0552
5^-Deoxy-5^-(Methylthio) Adenosine 0.8047 0.5987 0.5102 0.6239 1.6001 2.3454
5^-Deoxyadenosine 1.0392 0.8663 0.8778 1.4384 0.7147 1.1074
5-Hydroxy-DL-lysine 0.4847 1.4664 0.2967 1.0406 1.0508 1.5046
5-methylcytidine 1.5393 1.1181 0.4390 0.4175 1.4293 1.1707
5-Methylcytosine 0.4701 0.9776 0.8807 0.6106 1.4286 1.7941
5-Methyluridine 0.9436 0.7623 1.9008 1.0067 0.6148 0.8874
6-Diazo-5-oxo-L-norleucine 1.3908 0.9775 0.5941 0.9516 0.9988 1.2068
6-Dimethylaminopurine 1.1936 1.1498 1.0692 0.9104 0.6882 1.0043
6-Methylaminopurine 0.7246 0.7985 0.9352 0.8764 1.1743 1.7282
6-Methylnicotinamide 1.2045 1.9436 0.5433 0.7197 0.7349 0.4032
7a,25-Dihydroxycholesterol 1.4699 1.1937 0.6615 0.4389 1.0426 1.3562
7-Methylguanine 0.8600 1.1436 0.8246 0.8330 1.0131 1.3666
7-methylguanosine 0.9967 1.0903 0.9013 0.6574 1.3969 0.9094
7-Methyluric Acid 0.6174 0.6950 2.0020 1.0303 0.8634 0.8519
8,8a-deoxy oleane 1.6458 1.4845 0.4117 0.4134 1.3047 0.5740
8-Azaguanine 0.3784 0.2678 2.0741 1.0312 1.1409 1.4357
8-iso Prostaglandin E2 2.3536 1.7912 0.1420 0.3677 0.8669 0.2492
9-octadecenal 0.9262 1.0628 1.0205 1.2232 0.9583 0.6476
(±)-a-CMBHC 1.2943 0.9197 0.6309 0.2283 0.9434 2.6095
Adenosine 1.0957 0.9787 1.0947 0.9857 0.7801 1.1553
Adrenosterone 1.2907 0.9009 0.2080 0.4116 0.9288 2.9453
Ala-Arg 0.7757 1.1693 0.8027 1.0068 1.0155 1.1662
Ala-Phe 0.6690 0.9270 0.6280 2.2073 0.5970 0.7150
Ala-Pro 0.9869 0.8738 0.7949 0.6914 1.0624 1.9255
Ala-Val 0.5172 0.8081 0.7582 2.1466 0.5656 1.0897
Ala-Val-Ala 0.7918 0.8977 0.6785 1.5964 0.8891 1.0896
Allopurinol 1.0688 0.8900 1.2508 0.9617 0.8155 1.1336
alpha-Asarone 0.6857 0.8449 0.9195 0.7268 1.1417 1.9913
alpha-hexylcinnamaldehyde 1.1139 1.0067 0.9598 0.8864 1.1059 0.9288
Alternaria 0.6002 1.0780 0.7744 1.8210 0.8040 0.6116
Ancitabine 0.5418 0.5657 0.8942 0.8917 1.4001 2.0794
Androstenediol 0.8252 0.8244 1.2206 1.1787 0.9022 1.1101
Aniline 1.0549 1.0616 0.9853 1.0397 0.9082 0.9123
Arachidyl glycine 1.2841 0.9699 1.0852 0.9261 0.8683 0.9272
Arg-Ala 0.7208 1.0512 1.0458 0.7567 1.0238 1.5161
Arg-Asn 0.7495 1.0157 1.0957 0.7174 0.9975 1.5859
Arg-Glu 0.2757 0.8688 1.3911 0.5144 0.9226 2.4600
Arg-Ile 0.6495 0.9751 1.6888 0.6246 1.0259 1.0938
Arg-Leu 0.6718 0.9900 1.6404 0.6236 1.0405 1.0836
Arg-Met 0.5998 0.7820 1.5060 1.8600 0.3961 0.7543
Arg-Phe 0.8582 1.2121 0.8944 0.8401 0.8143 1.4314
Arg-Ser 0.4140 0.7966 1.3703 0.5916 1.0868 2.0962
Arg-Thr 0.5993 1.0213 1.1763 0.6222 1.1185 1.6120
Asn-Asn 1.0590 1.2286 0.7970 0.8210 0.8750 1.2346
Asp-Arg 0.7211 0.4046 0.7416 0.8529 1.4647 2.3472
Asp-Ile 0.5170 0.7963 1.1616 1.7555 0.6115 1.1251
Auraptene 0.9521 0.6967 1.3358 1.0279 0.6780 1.6284
Benzaldehyde 1.1025 1.2492 0.8956 1.1177 0.7220 0.7726
Betaine 0.3728 0.8991 1.9098 1.1946 1.0434 0.3386
Biliverdin 0.9174 1.5869 1.0073 0.7845 0.8460 0.5341
Biotin 1.2957 0.7686 0.9521 1.1257 0.9034 1.1081
Caffeine 0.2720 0.5522 0.2265 1.3677 1.4940 2.4158
Caldine 2.0741 1.7314 0.2127 0.4319 0.7004 0.7437
Carnitine C10:0 0.6925 2.6307 0.3551 0.2865 1.0930 0.0832
Carnitine C10:1 0.8504 2.2117 0.5886 0.4541 1.0639 0.1692
Carnitine C10:2 0.8260 2.3469 0.5097 0.3984 0.9769 0.2623
Carnitine C12:0 1.5891 2.1075 0.1965 0.6366 0.7556 0.2035
Carnitine C12:1-2OH 1.0053 0.9587 1.0631 1.0185 1.0305 0.9139
Carnitine C12-OH 2.1652 0.4528 1.2692 0.6091 1.2224 0.6160
Carnitine C13:0 1.0816 2.3619 0.1830 0.3385 1.0775 0.3149
Carnitine C14:0_A 1.6467 1.7124 0.4825 0.9282 0.6553 0.2006
Carnitine C14:0_B 1.4026 2.0116 0.4331 0.8001 0.5823 0.2904
Carnitine C14:1 2.0052 1.7059 0.2593 0.7062 0.7152 0.3543
Carnitine C14:1-OH 0.8873 2.1054 0.2187 0.8733 0.9077 0.3934
Carnitine C14:2 1.4337 2.3240 0.2069 0.2107 0.8551 0.4809
Carnitine C14:2:DC 1.7849 1.3141 0.5768 1.0430 0.7705 0.3228
Carnitine C14-OH 1.0587 1.1494 0.6557 1.6088 0.8946 0.2985
Carnitine C15 1.3716 2.1640 0.4256 0.4102 0.6849 0.5078
Carnitine C15:DC 1.1442 1.1873 1.1512 0.9341 0.8072 0.6647
Carnitine C16:0 1.2823 1.5662 0.6784 0.8038 0.7510 0.6983
Carnitine C16:1 1.3408 1.6333 0.5620 0.9084 0.7903 0.4322
Carnitine C16:1-2OH 1.1345 1.9622 0.8192 0.7348 0.6676 0.1584
Carnitine C16:1-OH 1.3138 1.2884 0.5813 1.3108 0.8299 0.4024
Carnitine C16-OH 0.9563 1.3444 0.7138 1.0218 0.8852 0.9101
Carnitine C18:0 1.3763 1.2650 0.8730 0.8981 0.7711 0.7271
Carnitine C18:1 1.3775 1.1780 1.0821 0.9848 0.6309 0.6867
Carnitine C18:1-OH 1.4434 1.1700 0.8207 1.0937 0.7581 0.6105
Carnitine C18:2 1.1252 1.8157 0.7076 0.6937 0.8374 0.4092
Carnitine C18:2-OH 1.5050 1.3391 0.5739 1.1894 0.7690 0.3756
Carnitine C18:3 1.4820 1.9861 0.4651 0.4800 0.8869 0.2539
Carnitine C18-OH 1.1487 1.1409 0.9841 0.7551 0.8543 1.1840
Carnitine C19:2 0.9894 1.0486 0.9229 0.9641 1.0202 1.0486
Carnitine C2:0 0.4509 0.7244 1.5381 1.3883 1.1002 0.6863
Carnitine C20:0 0.8809 0.7108 1.6795 0.5852 0.9061 1.5846
Carnitine C20:2 1.9673 0.9120 1.0848 0.9340 0.6547 0.5497
Carnitine C22:0 0.6523 0.7628 1.4221 0.6821 0.9746 1.8391
Carnitine C22:1 0.9642 1.1305 1.1425 1.1010 0.5759 1.0778
Carnitine C22:2 1.0662 0.5269 1.5392 0.4769 0.8826 2.1149
Carnitine C24:0 1.0309 1.2660 0.9133 0.9256 0.8090 0.9739
Carnitine C24:1 0.7653 0.9650 0.8441 0.8836 0.7980 2.0361
Carnitine C3:0 0.7808 0.9239 1.2984 1.1281 0.9706 0.8450
Carnitine C3:1-2OH 0.5483 1.3411 1.2457 0.6881 1.2851 0.6117
Carnitine C4:0 0.6368 0.9283 1.6161 0.6814 1.5349 0.4417
Carnitine C4:1-2OH 1.0384 0.9422 1.1998 0.7072 1.3151 0.7903
Carnitine C4:DC 2.1181 1.1241 0.5109 0.3992 1.4315 0.4138
Carnitine C4-OH 0.5309 1.3626 1.2729 0.6875 1.2737 0.5728
Carnitine C5:0 0.8223 0.9733 1.1624 1.2086 0.9316 0.8143
Carnitine C5:1 0.8609 0.8879 1.3402 0.8804 1.1504 0.8872
Carnitine C5:1-2OH 0.8081 0.8229 1.2681 1.2379 0.9102 0.9639
Carnitine C5-OH 1.0227 0.9557 1.2449 0.7273 1.2319 0.8158
Carnitine C6:0 0.5674 1.3278 1.4665 0.6820 1.0704 0.6523
Carnitine C6:1 0.9697 0.6559 1.4536 0.6966 1.0404 1.5099
Carnitine C6-2OH 0.7405 0.9769 1.2280 1.2702 0.9018 0.7624
Carnitine C6-OH 1.0812 0.8501 1.6972 0.6036 0.9698 0.9359
Carnitine C8:0 0.3860 2.0316 1.2101 0.4727 0.9996 0.2944
Carnitine C8:1 0.3798 1.0148 3.0378 0.3134 0.9499 0.1404
Carnitine C9:0 0.7401 1.5650 0.5190 0.2925 2.2387 0.1238
Catechol 1.0429 1.0284 1.0170 1.0010 0.9834 0.8962
CAY10574 0.9656 0.8421 1.0333 0.8306 1.3770 1.0012
CE(16:0) 1.1151 1.3373 1.3364 1.2411 0.2850 0.4614
CE(18:0) 1.4269 1.4015 0.6759 1.0720 0.5311 0.7538
CE(18:1) 0.9274 1.0099 1.4782 1.5571 0.3333 0.5460
CE(18:2) 0.5863 0.6161 2.4520 1.7995 0.1688 0.2634
CE(20:3) 1.7196 1.4692 1.0140 0.9503 0.2353 0.4683
CE(20:4) 0.6731 0.7655 2.3463 1.6621 0.1283 0.2950
CE(22:0) 0.8346 0.5539 0.5471 2.6109 0.5887 0.7182
CE(22:1) 1.0252 1.0475 1.3964 1.2938 0.5713 0.5289
CE(22:6) 1.3147 0.9335 1.5452 1.0824 0.4697 0.6984
CE(24:1) 1.3239 1.2337 1.1959 1.0425 0.5328 0.5465
Cer(d16:0/16:0(2OH)) 1.3982 0.9663 0.9739 0.8041 0.9628 1.0008
Cer(d16:1/16:0) 1.3006 1.3898 1.0412 0.7480 0.5528 0.9172
Cer(d16:1/18:0) 0.8135 0.9931 1.4260 0.8880 0.6770 1.3247
Cer(d16:1/20:0) 0.7585 0.8387 1.6926 0.7985 0.7677 1.3348
Cer(d16:1/22:0) 1.0001 1.2373 0.7623 1.2226 0.5144 1.2380
Cer(d16:1/23:0) 0.9863 1.1641 0.3820 1.8945 0.4069 0.9987
Cer(d16:1/24:0) 1.0512 1.2219 0.5996 1.5844 0.4347 0.9716
Cer(d16:1/24:1) 0.8302 0.9078 2.0440 0.7817 0.5882 0.9462
Cer(d17:0/15:0(2OH)) 1.0872 0.8498 1.4586 1.3436 0.4874 0.7994
Cer(d17:0/16:0(2OH)) 1.5032 1.0073 1.0141 0.8448 0.7957 0.9323
Cer(d18:0/16:0) 1.1936 1.2386 0.8629 0.5802 0.9883 1.1819
Cer(d18:0/16:0(2OH)) 1.3286 1.1772 0.8064 0.8679 0.7832 1.0694
Cer(d18:0/18:0) 1.5547 1.1986 1.3772 0.4110 0.4519 1.2237
Cer(d18:0/20:0) 1.2855 1.3010 0.8784 0.7089 0.6733 1.2031
Cer(d18:0/22:0) 1.0519 1.5379 0.5673 0.7917 0.9150 0.9427
Cer(d18:0/24:0) 1.1068 1.4787 0.4612 0.7801 1.1397 0.8148
Cer(d18:0/24:1) 1.1209 1.3545 1.1012 0.9303 0.6059 0.7461
Cer(d18:1/14:0) 1.2946 1.7323 1.1204 0.5331 0.3873 0.7507
Cer(d18:1/16:0) 0.9495 1.1028 1.3100 0.6973 0.7134 1.3576
Cer(d18:1/16:1) 1.2261 1.9744 0.4247 0.4351 0.4178 1.4035
Cer(d18:1/18:0) 1.2234 1.3911 1.1101 0.2848 0.5964 1.5807
Cer(d18:1/19:0) 0.8865 1.1914 0.9642 0.4202 0.6769 2.2159
Cer(d18:1/20:0) 0.9342 0.9913 1.0257 0.5107 0.6150 2.4113
Cer(d18:1/20:1) 0.9161 2.0546 0.9248 0.4548 0.4300 0.8951
Cer(d18:1/21:0) 0.9721 1.1801 0.7236 0.7479 0.6881 1.9227
Cer(d18:1/22:0) 0.8876 1.3153 0.7879 0.8715 0.6739 1.5023
Cer(d18:1/22:1) 1.1698 1.7205 0.4106 0.7491 0.7064 1.0445
Cer(d18:1/23:0) 0.8994 1.3125 0.6091 1.1164 0.7168 1.2800
Cer(d18:1/23:0(2OH)) 1.4685 2.0663 0.2325 0.4760 0.7451 0.6450
Cer(d18:1/24:0) 0.8925 1.2936 0.8741 1.0205 0.6809 1.1766
Cer(d18:1/24:1) 1.1659 1.5162 0.9847 0.7277 0.6187 0.8405
Cer(d18:1/25:0) 1.0194 1.2517 0.6485 1.0178 0.7680 1.2834
Cer(d18:1/26:0) 1.1602 1.4345 0.7147 0.9008 0.5563 1.1833
Cer(d18:1/26:1) 1.2557 1.9376 0.4087 0.7398 0.4409 0.9435
Cer(d18:2/16:0) 0.8503 1.0887 2.0874 0.9753 0.3585 0.5562
Cer(d18:2/18:0) 0.7725 1.1520 2.0720 0.9139 0.3963 0.5868
Cer(d18:2/20:0) 0.5928 0.7351 2.7494 1.0079 0.2999 0.6878
Cer(d18:2/22:0) 0.6528 0.8641 2.2135 1.0243 0.3870 0.9284
Cer(d18:2/23:0) 0.7941 0.9864 1.6528 1.2010 0.4651 0.8800
Cer(d18:2/24:0) 0.6572 1.1584 1.7418 1.1759 0.4495 0.6544
Cer(d18:2/24:1) 0.5865 0.7454 3.1624 0.8784 0.2195 0.4504
CerP(d18:1/14:0) 0.5843 0.3685 2.3013 1.3606 0.7857 0.7108
Cer(t17:0/24:0) 0.8888 1.2264 0.5978 0.9780 1.1907 0.9808
Cer(t17:0/24:0(2OH)) 0.8735 1.6532 0.5821 0.6005 1.1035 0.9302
Cer(t18:0/15:0) 1.3194 1.1567 1.0746 0.4710 1.0600 0.9751
Cer(t18:0/16:0) 1.4058 1.8214 0.4529 0.5350 0.6577 0.9311
Cer(t18:0/16:0(2OH)) 1.3864 2.6904 0.1467 0.2532 0.2785 0.7116
Cer(t18:0/18:0) 1.8083 1.5827 0.4518 0.3968 0.7545 0.9944
Cer(t18:0/18:0(2OH)) 1.1636 1.5724 0.7143 0.4700 0.8544 1.1507
Cer(t18:0/22:0) 0.9948 2.2957 0.2921 0.4667 0.5439 0.9950
Cer(t18:0/22:0(2OH)) 1.2872 2.5618 0.1375 0.2737 0.3785 0.9037
Cer(t18:0/23:0(2OH)) 1.1555 2.6289 0.1987 0.3445 0.3976 0.7064
Cer(t18:0/24:0) 1.0571 1.5434 0.4718 0.7645 0.8356 1.2157
Cer(t18:0/24:0(2OH)) 1.0066 2.0495 0.3736 0.4846 0.7781 0.9649
Cer(t18:0/24:1(2OH)) 1.4891 2.8993 0.1010 0.1728 0.1718 0.5398
Cer(t18:0/25:0(2OH)) 0.6416 1.1219 1.5570 0.8038 0.9094 0.8884
Cer(t18:0/25:1(2OH)) 1.2502 2.6966 0.1451 0.3699 0.3291 0.6002
Cer(t18:0/26:0) 1.1919 1.0479 0.5456 0.9763 0.7736 1.6673
Cer(t18:0/26:0(2OH)) 0.6723 1.1160 1.4186 1.0162 0.8273 0.8352
Cer(t18:0/26:1(2OH)) 1.1775 2.1009 0.2696 0.5259 0.7468 0.7872
Cer(t18:1/16:0(2OH)) 0.6043 1.2531 0.3902 1.2026 1.4553 0.7858
Cer(t18:1/20:0(2OH)) 0.7098 2.2119 0.5755 0.4147 0.7376 0.9023
Cer(t18:1/22:0(2OH)) 0.8329 0.7955 0.6298 0.5438 1.4996 2.0535
Cer(t18:1/23:0(2OH)) 0.8673 0.8326 0.5901 0.4546 1.5977 1.9893
Cer(t18:1/24:0) 0.7156 0.7295 0.7846 0.7906 1.8043 1.2625
Cer(t18:1/24:1(2OH)) 0.6262 1.4042 0.3504 1.0405 1.3752 0.9004
Cer(t18:1/26:0) 0.8445 0.8326 0.6166 0.9394 1.4399 1.4495
Cer(t20:0/24:0(2OH)) 1.3458 2.2907 0.2762 0.4970 0.4712 0.6776
Cholesterol 1.2396 1.3579 0.7346 0.8678 0.7937 0.9071
Cinnamic Acid 0.2459 0.2427 3.9894 0.9299 0.4295 0.3121
Cis-4-Hydroxy-D-Proline 0.8588 1.4184 0.4279 0.5724 1.9116 0.4354
cis-5-Dodecenoic acid 0.7961 0.7235 1.4874 1.0163 0.8470 1.3217
cis-Jasmone 0.9079 1.0319 1.1268 1.0367 1.0562 0.7348
Coenzyme Q10 0.8695 0.7687 1.0737 0.7942 1.0864 1.6935
Coenzyme Q8 0.8543 1.1664 0.9954 1.9247 0.2563 0.5087
Coenzyme Q9 1.4633 0.8168 0.7663 0.8182 1.0158 1.3864
Cork oximate 0.9010 0.9954 1.4647 1.1404 0.7554 0.6493
Cortisone acetate 1.1524 1.6373 0.4989 0.5789 1.0081 0.9235
Creatinine 0.4362 0.8529 1.3053 0.8631 1.7794 0.5802
Cyclo(Ala-Pro) 1.0281 0.9265 1.0063 1.0187 1.0496 0.9956
cyclo(leu-phe) 0.2362 0.3757 0.4003 3.8395 0.3584 0.3538
Cyclopentylglycine 0.7004 0.5635 0.9655 0.7412 1.1393 2.4328
Cyclo(Phe-Glu) 0.2929 0.7325 1.8011 1.6086 0.9395 0.3965
Cyclo(Pro-Leu) 0.7357 1.2016 0.6580 0.9425 1.2364 1.1143
Cyclo(Pro-Phe) 1.1828 1.1619 0.7922 1.6041 0.4671 0.5963
cyclo(pro-pro) 0.6033 0.9582 0.7119 1.7315 0.4086 1.6559
Cyclo(Pro-Val) 0.8825 1.4305 0.8094 0.8432 1.0452 0.7464
Cyclo(Tyr-Leu) 0.1235 0.0944 1.0448 2.1798 2.1318 0.1328
Cyromazine 1.4377 1.1996 0.6526 0.7401 0.6826 1.4577
Cytarabine 1.5123 1.2292 0.5365 0.5207 1.1829 1.0654
Cytidine 1.4792 0.9923 0.5837 0.5936 1.3325 1.1554
Cytosine 0.8189 0.5009 0.3931 0.6454 1.0926 3.3996
Dehydroascorbic acid 1.7596 1.0818 0.4982 0.8608 0.8318 1.0987
Delta-Hexalactone 1.0386 1.0567 0.9865 0.9395 1.0047 0.9531
Deoxycytidine 1.0222 0.7705 0.7032 0.7566 1.3495 1.6707
Deoxyguanosine 1.3880 1.3498 0.7977 1.0337 0.6107 0.6772
Dethiobiotin 0.8385 1.5193 1.0660 0.9270 0.5675 0.8694
DG(12:0_16:1) 1.0509 0.9016 0.9511 1.0644 1.0329 1.0431
DG(12:0_20:0) 0.9101 0.9211 1.0840 1.1006 0.9168 1.1097
DG(14:0_16:0) 0.8233 0.9379 0.7175 0.9382 1.0353 1.7468
DG(14:0_16:1) 0.7423 0.8062 0.9943 1.2380 1.1219 1.1199
DG(14:0_18:0) 0.9720 0.8952 0.9276 1.1760 1.0490 0.9779
DG(14:0_18:1) 0.5443 0.5765 0.7577 0.9894 1.1542 2.4520
DG(14:0_18:2) 0.3370 0.3168 0.5377 0.9446 1.3049 3.3296
DG(14:0_20:0) 0.8333 0.8590 1.1247 1.2148 0.9101 1.0930
DG(14:0_22:0) 0.9346 0.9232 1.0996 1.1513 0.9987 0.8530
DG(15:0_16:0) 0.5313 0.7877 0.6903 0.8361 0.7344 3.0244
DG(16:0_16:0) 0.8836 0.9425 1.0309 1.1302 0.9605 1.0579
DG(16:0_16:1) 0.7776 0.7774 0.8122 1.0331 1.0343 1.8328
DG(16:0_18:0) 0.8972 0.8886 1.1059 1.1816 0.9469 0.9845
DG(16:0_18:1) 0.3350 0.2477 1.3417 1.0809 1.2680 2.2321
DG(16:0_18:2) 0.2116 0.1559 1.1843 0.8027 1.8814 2.2821
DG(16:0_18:3) 0.4065 0.2928 0.9483 0.8391 1.3742 2.8102
DG(16:0_20:0) 0.9106 0.7357 1.0871 0.9734 0.8843 1.7103
DG(16:0_20:1) 0.6165 0.3486 1.0703 1.4589 0.6943 2.3341
DG(16:0_20:4) 0.4821 0.5123 1.5815 1.0804 0.6357 2.1830
DG(16:1_18:1) 0.3341 0.3160 0.7988 0.9838 0.9962 3.3873
DG(16:1_18:2) 0.1736 0.1984 0.6690 0.8284 1.2457 3.8450
DG(16:1_18:3) 0.1804 0.2715 0.6936 0.9621 0.9151 3.9485
DG(16:1_20:3) 0.1713 0.1079 1.0859 0.5180 2.4621 2.1321
DG(16:2_18:2) 0.5923 0.4435 1.0794 0.8917 1.8141 1.3869
DG(18:0_18:0) 0.9485 0.8709 1.1602 1.1955 0.9480 0.8624
DG(18:0_18:1) 0.2692 0.1962 1.5653 0.7938 1.3411 2.4543
DG(18:0_18:2) 0.2364 0.0980 1.5378 0.4687 1.8696 2.4395
DG(18:0_20:4) 0.6818 0.6420 2.3242 1.2836 0.4006 0.7419
DG(18:0_22:0) 0.6681 0.4851 1.2444 1.1741 1.1951 1.4800
DG(18:1_18:1) 0.0973 0.0530 1.1986 0.7633 2.1559 2.2444
DG(18:1_18:2) 0.0796 0.0601 1.1304 0.6336 2.0971 2.6358
DG(18:1_20:0) 0.0809 0.0608 1.8957 0.6859 1.7525 2.0467
DG(18:1_20:1) 0.0682 0.0502 1.1042 0.5036 2.1159 2.8807
DG(18:1_20:2) 0.0609 0.0624 1.2873 0.6897 1.4615 3.3086
DG(18:1_20:4) 0.4510 0.3028 2.3400 1.1540 0.5183 1.6688
DG(18:1_22:6) 0.7088 0.7593 1.5923 1.0634 0.7349 1.3085
DG(18:1_24:0) 0.0817 0.0814 1.4124 0.6759 1.9108 2.4293
DG(18:2_18:2) 0.1597 0.1049 1.0490 0.5406 2.5399 2.0481
DG(18:2_18:3) 0.2848 0.1460 1.0053 0.3958 1.2568 4.0358
DG(18:2_20:1) 0.0483 0.0273 0.9540 0.2936 2.7412 2.5426
DG(18:2_20:4) 0.8076 0.4177 1.6633 1.3663 0.5615 1.5338
DG(18:2_22:6) 1.1387 0.9380 0.9177 1.1325 0.6553 1.3742
DG(18:3_18:3) 0.3324 0.1237 0.6074 0.2810 3.0141 2.0992
DG(20:0_18:2) 0.1267 0.0708 1.8629 0.4986 2.0776 1.8267
DG(22:0_18:1) 0.0250 0.0215 1.8783 0.6947 1.9222 1.9420
DG(22:0_18:2) 0.0392 0.0231 1.7082 0.5379 2.2850 1.8532
DG(24:0_18:1) 0.0350 0.0616 2.0917 0.5769 1.6312 2.1919
DG(24:0_18:2) 0.0605 0.0503 1.3613 0.6519 2.4054 1.8776
DG(8:0_16:0) 1.1483 1.0031 0.9835 1.0616 0.9040 0.8895
DGDG(14:0_18:1) 0.9594 0.6311 0.6693 2.4768 0.4993 0.6082
DGDG(16:0_16:0) 0.9132 1.2436 1.2202 1.0630 0.7857 0.5624
DGDG(16:0_18:1) 1.0770 1.1021 0.7771 1.4254 0.7499 0.7134
DGDG(16:0_18:2) 0.7474 2.1259 0.7060 0.8858 0.5169 0.4341
DGDG(16:0_18:3) 0.5262 1.4273 2.0279 0.3924 0.8379 0.5684
DGDG(16:0_20:1) 0.7456 0.5381 1.4721 1.2735 0.9141 1.2485
DGDG(18:0_18:2) 0.6414 2.1182 0.8748 0.8084 0.5701 0.3904
DGDG(18:0_18:3) 0.5487 0.7780 2.6944 0.5977 0.8376 0.5734
DGDG(18:1_18:2) 1.0277 1.7647 0.8018 0.9994 0.4810 0.5459
DGDG(18:1_18:3) 0.6343 1.3968 1.1151 1.3155 0.7286 0.4201
DGDG(18:2_18:2) 0.7415 1.6698 0.9893 1.4152 0.4315 0.2275
DG(O-16:0_12:0) 0.8408 0.8617 1.1149 1.0933 1.0158 1.1262
DG(O-19:0_16:0) 0.8719 0.8440 1.1230 1.1860 1.0147 0.9679
DG(O-21:0_16:0) 0.8003 0.7621 1.0717 1.0072 0.9191 1.7033
Diethanolamine lauric acid 1.0324 0.9164 1.0319 1.0237 0.9145 1.1706
Diethyl 2-methyl-3-oxosuccinate 0.4960 0.7505 1.4953 1.0406 1.2012 1.0397
Diethyl phosphate 1.1109 1.0048 0.7857 0.7363 1.0438 1.4990
Dihydro-D-sphingosine 1.5094 1.6928 0.5738 0.6623 0.3659 1.1320
Di-n-propyl phthalate 0.9649 0.8279 0.7495 0.5578 1.5691 1.5514
DL-Carnitine 1.8709 1.1676 1.0866 0.8318 0.6206 0.3827
DL-Mevalonic Acid Lactone 0.8455 0.5694 0.6560 0.9538 1.3181 2.0603
D-Mannosamine 1.0271 0.9200 0.7236 1.0268 0.9955 1.4543
D-myo-Inositol-1,3,4-triphosphate 0.9657 0.9515 0.9834 0.9986 1.0593 1.0682
D-Proline betaine 0.6971 0.8386 0.4889 0.4424 1.6949 2.1848
D-urobilinogen 1.1499 2.1307 0.0843 0.6991 1.0454 0.2873
(E)-2-Octen-1-ol 0.8957 1.3148 0.9776 1.0812 0.7226 0.8355
(E)-Guggulsterone 0.8519 1.1952 0.9228 0.8434 0.8767 1.3346
Eicosanoyl-EA 1.1051 0.8218 0.9970 1.0840 0.9886 1.1070
Eritadenine 1.4581 1.4248 0.6859 0.6989 0.8509 0.7706
Ethyl 3-Indoleacetate 0.6870 1.3241 0.4123 0.4750 0.8834 2.5336
Ethyl dodecanoate 0.7207 0.9799 1.0777 1.2719 0.8661 1.0312
(E,Z)-2-Amino-3,14-octadecadien-1-ol 0.8080 1.3361 1.2431 1.1167 0.4841 0.8448
Farnesylacetone 0.2377 0.5194 1.0161 0.5074 2.6256 1.1306
FFA(18:5) 0.9317 1.0952 0.7497 0.9362 0.9778 1.3653
FFA(20:6) 0.7242 0.5713 0.7191 0.5261 1.7351 2.1656
Folic acid 0.8410 0.8528 0.2878 1.1524 2.1977 0.3794
gamma-Aminobutyric Acid 1.6274 1.3857 0.3634 0.6524 0.7172 1.3522
gamma-CEHC 0.6719 0.5334 0.8461 0.4861 2.1096 1.6316
gamma-D-GLU-GLY 0.6656 0.8638 1.1915 0.9370 1.0851 1.3679
Glu-Cit 1.9480 0.8997 1.0274 0.8970 0.5670 0.8623
Glu-Gln 0.5935 1.1925 0.7907 1.1943 1.0489 1.0033
Glu-Glu-Ile 1.0114 1.7105 0.5875 0.7147 1.0163 0.6023
Glu-Gly 1.2426 0.9788 0.6995 0.7990 1.2614 1.0844
Glu-His 0.7663 1.0890 0.8593 0.7954 1.2207 1.2824
Glu-Ile 1.1299 1.0994 0.9334 0.9657 0.8480 1.0290
Glu-Leu 2.1532 0.7815 0.7654 0.8528 0.8330 0.8696
Glu-Met 1.6804 0.8695 0.7117 1.0355 0.8376 1.0283
Glu-Phe-Ala 0.8152 0.8801 0.7961 1.0753 1.2041 1.2919
Glu-Pro 0.6911 1.1235 0.3270 0.5081 2.1100 1.1349
Glu-Ser 0.5432 0.9460 0.8329 1.4931 0.9485 1.1559
Glu-Tyr 1.0505 0.5172 1.1499 1.3403 1.0084 1.1151
Glu-Val 0.7968 0.9262 1.2534 1.1592 0.9250 0.9009
Glu-Val-Phe 0.8369 1.0302 0.9027 0.8446 1.1048 1.3510
Gly-Gln 0.9305 1.5632 0.6391 0.7283 0.8919 1.0752
Gly-Gly-Phe 0.7790 1.0147 0.7934 2.2089 0.4154 0.4679
Gly-Ile 1.0374 0.9928 1.0276 0.8085 1.0195 1.2074
Gly-Leu-Ala 0.5820 1.1390 1.1748 1.7229 0.5713 0.4868
Gly-Lys 0.4243 1.5877 0.8507 1.0012 0.5641 1.3962
Gly-Phe-Phe 1.4569 0.9684 0.6077 1.1012 0.7946 1.1985
Gly-Ser-Pro-Met-Phe-Val-NH2 2.3437 1.4827 0.0288 0.2683 0.7798 1.2909
Gly-Thr 0.9927 1.1058 0.8322 1.0020 0.9199 1.1464
Gly-Tyr 0.8318 1.1207 0.8052 1.2468 0.9928 0.8446
Guanosine 1.7355 1.2381 1.2838 0.6281 0.5847 0.5190
H-D-Tyr-OtBu 2.0918 1.5566 0.3689 1.1576 0.2150 0.4290
Heptethylene glycol 1.6936 1.0736 0.7043 0.8496 0.8634 0.8870
Hex2Cer(d16:1/16:0) 1.1830 0.9897 1.5128 0.8920 0.8564 0.5090
Hex2Cer(d18:1/16:0) 1.3083 1.1404 1.7721 0.8373 0.5610 0.2578
Hex2Cer(d18:1/18:0) 1.2095 1.3502 1.2054 0.5755 1.0009 0.4813
Hex2Cer(d18:1/20:0) 1.2441 1.3804 0.9278 0.6265 0.8945 0.8321
Hex2Cer(d18:1/22:0) 1.0437 1.4047 1.2799 0.8844 0.7034 0.4282
Hex2Cer(d18:1/24:0) 1.4310 1.1682 1.3505 0.8693 0.6968 0.3691
Hex2Cer(d18:1/24:1) 1.2905 1.0533 2.2321 0.7867 0.3785 0.1862
Hex2Cer(d18:2/16:0) 1.1927 1.0787 1.7153 0.7335 0.7521 0.4643
Hex3Cer(d18:1/16:0) 1.5469 1.8066 0.6505 0.4219 0.7433 0.5824
Hexaethylene glycol 1.5337 1.0737 0.8343 0.8709 0.8501 0.8862
HexCer(d16:1/20:0) 1.7740 1.2016 0.4638 0.8802 0.6900 1.0802
HexCer(d16:1/22:0) 1.7885 1.2920 0.1579 1.1275 0.6787 0.9233
HexCer(d16:1/24:0) 1.7971 1.2746 0.1850 0.9370 0.7882 1.0478
HexCer(d16:1/24:1) 1.5544 1.6022 0.3123 0.6666 0.9097 0.7793
HexCer(d18:1/16:0) 1.8431 1.1483 0.4674 0.6548 0.8826 1.1649
HexCer(d18:1/16:1) 1.6189 1.7974 0.3639 0.6941 0.6222 0.6487
HexCer(d18:1/18:0) 1.1300 0.7382 0.8543 0.3651 1.1131 2.3799
HexCer(d18:1/18:1) 1.5698 1.6078 0.3464 0.7075 0.8001 0.8048
HexCer(d18:1/20:0) 1.2450 0.8923 0.6390 0.6287 0.9207 2.1088
HexCer(d18:1/20:1) 1.3743 1.4065 0.3590 0.7394 0.8371 1.2958
HexCer(d18:1/22:0) 1.2148 1.2258 0.4479 0.7221 0.9814 1.5207
HexCer(d18:1/22:1) 1.2768 1.7571 0.2573 0.7504 0.7125 1.0426
HexCer(d18:1/23:0) 1.4970 1.1864 0.3609 0.7246 0.9560 1.4170
HexCer(d18:1/24:0) 1.3710 1.4137 0.5196 0.6524 0.9491 1.0417
HexCer(d18:1/24:1) 1.4224 1.6774 0.3773 0.6959 0.8195 0.7912
HexCer(d18:1/26:0) 1.6998 1.3567 0.6220 0.6478 0.9117 0.6940
HexCer(d18:2/16:0) 1.0582 0.6899 0.8522 0.6068 1.1896 2.0616
HexCer(d18:2/18:0) 1.1438 1.6236 0.6585 0.5539 0.7472 1.1779
HexCer(d18:2/20:0) 0.7357 1.9805 0.7293 0.7241 0.6602 0.7364
HexCer(d18:2/22:0) 1.3035 1.3699 0.6006 0.8155 0.8564 0.9769
HexCer(d18:2/24:0) 1.1036 1.3069 0.6660 0.6979 1.0199 1.1846
HexCer(d18:2/24:1) 1.8409 1.8792 0.3186 0.6600 0.4705 0.5750
(+/-)-High Proline 0.9375 0.5955 0.9311 1.4076 1.4748 0.5826
Hydroquinone 1.0429 1.0284 1.0170 1.0010 0.9834 0.8962
Hydroxyquinoline 1.0945 1.2520 0.8415 0.8227 0.7847 1.2219
Hydroxyurea 1.1664 1.2323 0.8233 1.0223 0.7964 0.8664
Hypotaurocyamine 1.6384 1.5912 1.0252 0.6349 0.5064 0.4069
IAA-L-Ala 0.6067 1.6768 0.5147 0.7161 0.5981 1.8611
Ile-Arg 0.8410 1.2133 0.8906 1.1762 0.8661 0.8444
Ile-Asp 0.5910 0.9999 0.9064 1.1822 1.5066 0.5539
Ile-Gln 0.7290 1.1778 0.8900 1.0953 0.8136 1.2508
Ile-Glu 1.1355 1.1008 0.9212 0.9586 0.8562 1.0349
Ile-Ile 0.9812 0.9600 0.8330 1.2295 0.7634 1.3128
Ile-Ile-Thr 0.8348 0.8772 0.5548 0.7615 1.2969 1.9539
Ile-Leu 0.9764 0.9559 0.8320 1.2335 0.7693 1.3124
Ile-Lys 0.8736 0.9531 0.8754 1.3349 0.8170 1.1476
Ile-Met 0.8420 1.0080 0.7349 0.9736 0.8303 1.8189
Ile-Ser 0.6826 0.9164 1.0025 1.3557 0.7216 1.3814
Ile-Thr 0.9145 0.9956 0.8409 1.3516 0.7833 1.0888
Ile-Trp 0.6939 0.9225 0.9207 1.8711 0.5144 0.9607
Imidazoleacetic acid 4.5841 0.4254 0.3080 0.2289 0.5002 0.8130
Indole-3-acetamide 0.7597 1.3796 1.1304 0.8001 0.7643 1.0491
Indole-3-acetic acid 1.9073 0.9580 1.1395 0.4813 0.6957 1.1138
Indole-3-acetonitrile 0.7607 0.9237 1.3994 1.0263 0.8647 1.0542
Indole-3-Carboxaldehyde 2.2281 1.1112 1.3057 0.4670 0.4044 0.6837
Indole-4-carboxaldehyde 0.8962 0.9818 1.3501 0.9942 0.8545 0.9165
Indole-5-carboxylic acid 0.8170 0.5844 2.2433 1.1107 0.5301 0.8818
Inosine 1.1988 1.0873 1.3156 0.8946 0.7087 0.7838
Inosine 5^-monophosphate 2.0110 1.0511 1.2029 1.0123 0.4356 0.2792
Isopentenyladenine-7-N-glucoside 1.4612 0.9905 1.0332 0.8851 0.9699 0.6629
Kynurenic Acid 0.6011 0.5269 1.6567 1.2980 0.8154 1.3016
Kynurenine 0.9807 1.0278 0.8216 0.9272 0.9334 1.4222
L-Alanine 1.2318 1.1734 0.8950 0.9780 0.8000 0.8718
L-Alanyl-L-Lysine 0.8123 0.9682 0.7743 1.3901 0.9347 1.0610
L-Allothreonine 1.4562 1.4097 0.7256 0.5099 0.9130 0.9549
Lapachol 0.8758 1.0517 0.8064 1.0306 0.9311 1.3589
L-Aspartic Acid 1.0076 1.3506 0.8868 0.7524 0.8957 1.0186
L-Aspartic acid-O-diglucoside 1.5402 0.5258 1.8294 0.4669 1.0719 0.9090
L-Carnitine 3.0632 0.8791 0.9291 0.7650 0.3478 0.2695
L-Citrulline 1.2569 1.3867 0.8879 0.9967 0.5886 0.7309
Leu-Ala 0.6625 0.8965 0.8548 1.6187 0.7093 1.2423
Leu-Ala-Val 0.8825 0.9993 0.5800 0.8896 1.0612 1.7813
Leu-Glu 1.1330 1.0936 0.9303 0.9721 0.8397 1.0430
Leu-Gly-Leu 1.1855 1.0895 0.8836 0.8407 0.9969 1.0242
Leu-Gly-Phe 1.2951 1.2455 0.5970 1.0292 0.9306 0.7803
Leu-Ile 0.9752 0.9570 0.8355 1.2377 0.7594 1.3151
Leu-Leu 1.0425 0.9619 0.8154 1.1209 0.7922 1.3899
Leu-Leu-Glu 0.8310 0.9344 0.6899 0.6645 1.3644 1.7210
Leu-Leu-Gly 0.8529 0.9585 0.7439 0.6807 1.2569 1.7129
Leu-Leu-Leu 1.2590 1.1478 0.5407 0.7113 1.1393 1.2751
Leu-Leu-Phe 1.1617 1.1705 0.5239 1.2845 0.8093 0.9549
Leu-Met 0.8496 1.0180 0.7457 0.9782 0.8276 1.7730
Leu-Phe 0.7919 0.9661 0.8303 1.7433 0.6336 0.9066
Leu-Thr 0.9000 0.9941 0.8175 1.3759 0.7860 1.0972
Leu-Trp 0.7099 0.9222 0.9164 1.8830 0.4988 0.9527
L-Glutamine 1.3838 1.5137 1.0015 0.5926 0.8250 0.4732
L- -Glutamyl-L-glutamic acid 0.7400 0.7990 1.0252 1.1080 1.3512 0.9571
L-Homophenylalanine 2.0034 0.5303 2.0833 0.9446 0.2830 0.4485
L-Isserine 1.3783 1.1686 1.0271 0.9070 0.7467 0.7267
L-Leucine 1.0855 0.9321 0.9801 0.9738 1.0581 1.0113
L-Lysine 0.8755 1.2909 0.9713 1.0891 0.7534 0.8548
L-Methionine 1.0862 1.0821 0.8169 1.0187 0.9648 1.0095
L-Methionine sulfoxide 1.2341 1.6091 0.8575 0.6998 0.7131 0.6550
L-Norleucine 1.0622 0.8885 0.9916 0.9981 1.0898 1.0207
L-Norvaline 0.9540 1.1206 1.0057 1.2129 0.7794 0.8087
L-Ornithine 1.1799 0.9139 0.7186 1.4088 0.4738 1.4724
LPC(0:0/14:0) 0.9016 2.6532 0.5435 0.5289 0.3909 0.2145
LPC(0:0/15:0) 1.6849 1.3021 1.0399 0.9732 0.5480 0.2890
LPC(0:0/16:0) 1.3626 1.2696 0.8948 0.9222 0.7908 0.6375
LPC(0:0/17:0) 1.4171 1.8556 0.6122 0.9115 0.4883 0.2982
LPC(0:0/18:0) 1.2426 1.2940 1.0680 1.4004 0.3719 0.3710
LPC(0:0/18:1) 0.7635 1.3287 1.5565 0.9879 0.7956 0.2297
LPC(0:0/18:2) 1.0343 1.7931 1.1414 0.7413 0.6821 0.1380
LPC(0:0/19:0) 0.5017 1.0582 0.7989 1.4227 0.4369 1.9134
LPC(0:0/20:0) 0.7466 1.3577 1.6290 0.8638 0.5082 0.7247
LPC(0:0/20:1) 0.5039 1.3070 2.1091 1.2039 0.2805 0.2679
LPC(0:0/20:2) 0.5407 1.6201 1.6508 1.0955 0.3243 0.3419
LPC(0:0/20:3) 1.0326 1.5529 1.2824 0.7130 0.5648 0.6328
LPC(0:0/20:4) 0.8216 1.5193 0.9351 0.9412 0.8505 0.6167
LPC(0:0/22:1) 0.4076 0.6782 2.9830 1.1257 0.4174 0.3388
LPC(14:0/0:0) 0.7664 1.9184 0.5301 1.1370 0.7601 0.2817
LPC(15:0/0:0) 1.6515 1.3179 1.0677 0.9615 0.5403 0.2909
LPC(16:0/0:0) 1.2795 2.1365 0.7403 0.6576 0.4028 0.2799
LPC(16:1/0:0) 0.8498 1.1535 0.8386 1.5534 0.9898 0.2354
LPC(17:0/0:0) 1.4915 1.8466 0.5732 0.8891 0.5228 0.2645
LPC(18:0/0:0) 0.9841 1.7577 0.6329 1.3519 0.4446 0.3317
LPC(18:1/0:0) 0.9824 0.7916 1.3186 1.3477 1.0824 0.3213
LPC(18:2/0:0) 1.1294 2.3390 1.2663 0.1330 0.3628 0.2564
LPC(18:3/0:0) 0.3039 2.2571 1.0685 0.0708 0.4317 1.6351
LPC(19:0/0:0) 0.7385 1.5974 0.8449 1.3678 0.3660 0.7356
LPC(20:0/0:0) 0.6539 1.5964 1.1212 0.8063 0.3705 1.3502
LPC(20:1/0:0) 0.8122 1.3571 1.6931 1.0903 0.3786 0.3996
LPC(20:2/0:0) 1.1096 0.9807 1.9434 1.0624 0.3432 0.5375
LPC(20:3/0:0) 1.0326 1.5529 1.2824 0.7130 0.5648 0.6328
LPC(20:4/0:0) 0.8216 1.5193 0.9351 0.9412 0.8505 0.6167
LPC(22:0/0:0) 2.0132 1.1549 0.8326 0.6321 0.5302 1.0313
LPC(22:1/0:0) 0.3812 0.6102 3.1237 1.1356 0.3971 0.3270
LPC(22:2/0:0) 0.6018 0.5295 3.3797 0.8704 0.2956 0.4551
LPC(22:6/0:0) 0.6021 1.2983 0.7040 1.5689 0.8721 0.5782
LPC(24:0/0:0) 0.5688 3.1859 0.3623 0.2456 0.3583 0.3208
LPC(24:1/0:0) 0.3740 0.9371 1.7684 1.0651 0.9335 0.8231
LPC(24:2) 0.4379 0.6084 2.9518 1.2688 0.3773 0.3124
LPC(26:0/0:0) 0.5339 2.8808 0.4259 0.4269 0.5046 0.3548
LPC(26:1) 0.4657 0.9825 2.0610 0.9506 0.8602 0.5299
LPC(O-16:0) 0.7622 0.7828 2.1451 1.1874 0.5644 0.5235
LPC(O-16:0/2:0) 1.0679 1.2425 1.2159 1.1643 0.6050 0.5006
LPC(O-16:1) 1.1554 0.8172 1.7601 1.2607 0.5027 0.4888
LPC(O-16:1/0:0) 1.0407 0.9185 1.6250 1.0068 0.4568 1.0795
LPC(O-18:0) 0.7407 0.7804 2.3387 1.2589 0.3510 0.5020
LPC(O-18:0/0:0) 0.6264 0.6045 2.2114 1.6837 0.3553 0.4634
LPC(O-18:1) 0.4574 0.3782 3.2926 1.3864 0.2533 0.2762
LPC(O-18:1/0:0) 0.5149 0.5801 2.6675 1.3469 0.3051 0.6405
LPC(O-20:0) 0.8538 0.6103 2.9558 1.0495 0.2904 0.2958
LPC(O-20:1) 0.3773 0.3210 4.0807 1.0622 0.1290 0.1283
LPC(O-20:2) 0.3614 0.2603 4.2165 1.0473 0.1490 0.0755
LPC(O-22:0) 0.9527 0.7238 2.6738 1.0574 0.3119 0.2942
LPC(O-22:1) 0.5010 0.3914 3.7210 1.0997 0.2057 0.1544
LPC(O-22:2) 0.3774 0.3006 4.3441 0.8777 0.1494 0.0777
LPC(O-24:0) 1.1611 0.9167 1.9099 1.1786 0.3836 0.4004
LPC(O-24:1) 0.5978 0.5268 3.5140 1.1071 0.1535 0.1244
LPE(0:0/16:0) 0.8746 1.3864 0.8852 0.6970 0.8768 1.2233
LPE(0:0/18:0) 1.1829 1.1556 1.4586 1.1887 0.4646 0.3813
LPE(0:0/18:2) 0.7399 1.6425 1.2402 0.7856 0.6565 0.6064
LPE(0:0/20:1) 0.5716 1.1646 1.4538 1.0400 0.5664 1.1663
LPE(15:0) 0.9640 0.9258 0.7778 0.7774 1.2999 1.3831
LPE(15:0/0:0) 1.0555 0.8902 0.9349 0.9606 1.1041 1.1386
LPE(16:0/0:0) 0.8641 1.4060 0.8977 0.7195 0.8424 1.1973
LPE(16:1/0:0) 0.5506 1.1973 0.6997 1.3042 0.9074 1.2037
LPE(17:0/0:0) 1.0729 1.1007 0.7256 0.6624 0.9930 1.6328
LPE(17:1/0:0) 0.7938 1.6012 0.5358 1.6189 0.3313 0.7304
LPE(18:0/0:0) 0.9634 1.1747 1.1632 1.1662 0.5473 0.9061
LPE(18:1/0:0) 0.6284 1.2225 0.7851 1.1196 0.7078 1.5425
LPE(18:2/0:0) 0.9987 1.8344 1.3361 0.2754 0.7121 0.5334
LPE(18:3/0:0) 0.4554 1.7103 0.9742 0.1981 1.1429 1.3637
LPE(20:0/0:0) 0.7994 0.9491 0.9289 0.8103 0.8053 2.0187
LPE(20:1/0:0) 0.6545 1.1195 1.5449 0.9638 0.5882 1.1225
LPE(22:0/0:0) 1.3754 0.9131 0.9780 0.4165 0.7324 2.0831
LPE(22:1/0:0) 0.4267 0.5888 1.6943 1.1775 1.1565 1.0154
LPE(24:0/0:0) 1.1645 2.1161 0.6848 0.2366 0.4976 1.0514
LPE(P-16:0) 0.6647 0.6082 1.0490 0.7176 1.2078 2.2124
LPE(P-16:1) 0.9756 0.6669 0.5437 0.9588 0.7411 2.7289
LPE(P-17:0) 1.3830 0.9000 0.9606 0.6277 0.8598 1.5971
LPE(P-17:1) 1.1672 1.2986 1.3834 0.3843 0.5565 1.3617
LPE(P-18:0) 0.9265 0.9586 1.5662 1.1320 0.5850 0.8237
LPE(P-18:1) 1.4476 0.6674 0.9493 0.5993 0.9384 1.9099
LPE(P-20:0) 1.0494 0.9736 1.4298 1.1646 0.6346 0.7075
LPE(P-22:0) 1.0438 1.0953 1.2653 1.1688 0.6662 0.6461
L-Phenylalanine 0.9174 0.9421 1.1349 1.2030 0.8640 0.9100
L-Pipecolic acid 1.0565 0.6370 0.6160 0.7970 1.0690 2.3597
L-Proline 1.0270 1.0349 1.2888 0.8663 1.0644 0.6317
L-Sepiapterin 1.9747 1.0845 0.5794 0.8058 1.0677 0.4676
L-Serine 1.6387 1.4588 0.6600 0.5181 0.7750 0.9292
L-Threonine 1.4125 1.3803 0.7267 0.5613 0.8810 1.0274
L-Thyroxine 0.6338 0.3871 1.7603 1.0595 0.8169 1.7689
L-Tryptophanamide 1.2342 1.3186 0.9092 0.8754 0.6870 0.9041
L-Tyrosinamide 1.5357 1.7538 0.4778 1.0276 0.4656 0.3844
L-Tyrosine 1.4409 1.5017 0.3708 1.2651 0.4218 0.8104
L-Tyrosine methyl ester 1.4943 1.4767 0.3573 0.6290 0.9125 1.0852
Lumichrome 0.7045 0.6925 2.2521 0.7214 0.6381 1.2485
L-Valine 0.9669 1.1546 0.9819 1.1912 0.7666 0.8138
Lys-Ile 0.7658 0.8791 0.5754 1.9124 0.7931 0.9368
Lys-Leu 1.0253 0.9263 0.6926 1.1947 0.8394 1.4542
Lys-Met 0.6683 1.0514 0.4414 1.2321 1.1523 1.4373
Lys-Pro 0.8858 0.9686 1.2338 1.0693 0.9493 0.8480
Lys-Ser 0.8588 1.1396 0.4205 1.8369 0.6542 0.8636
Lys-Val 0.5397 1.1734 1.1286 1.2939 0.7825 0.8941
Melaleuca Paper A 4.3603 0.0921 1.1914 0.7306 0.2827 0.0671
Met-Glu 1.6804 0.8695 0.7117 1.0355 0.8376 1.0283
Methoxyindoleacetic Acid 0.5325 0.6014 0.9470 0.8707 1.6401 1.6247
Methylcysteine 0.7739 0.4657 0.8835 1.2609 0.8204 2.2995
Methylguanidine 0.5109 0.7299 1.3046 0.6256 1.2403 1.9144
Methylstearate 1.6379 1.1333 1.0646 0.6968 0.7170 0.8189
Met-Pro 1.0901 1.0034 0.5466 0.7826 1.1442 1.6208
Metrizamide 1.5543 1.1734 0.8576 0.8330 0.6534 0.9952
MG(0:0/16:0/0:0) 0.9402 0.9529 1.0225 1.1276 0.9242 1.0418
MG(0:0/22:6/0:0) 1.1994 1.7136 1.0348 0.7682 0.5758 0.3565
MG-132 2.1875 1.5972 0.2200 0.7685 0.5304 0.5810
MG(14:1) 1.0632 0.8691 1.4796 0.7073 0.5415 1.6889
MG(16:0) 0.9631 1.0305 1.0983 1.0101 0.8920 0.9996
MG(16:0/0:0/0:0) 0.9402 0.9529 1.0225 1.1276 0.9242 1.0418
MG(17:0) 1.0581 1.2178 0.9139 0.8277 0.9807 0.9311
MG(18:0) 0.9483 0.9680 1.0954 1.0811 0.9586 0.9281
MG(18:0/0:0/0:0) 0.7784 1.2277 0.8210 0.9943 0.8320 1.3218
MG(18:1) 0.1386 0.1292 2.2117 0.4901 0.7740 3.2048
MG(18:2) 0.1717 0.2824 2.6235 0.4082 1.1099 1.9492
MG(18:2/0:0/0:0) 0.3747 0.5901 2.0241 0.7224 1.5942 0.6979
MG(20:4/0:0/0:0) 0.8814 1.2714 1.6822 1.1685 0.3345 0.4400
MG(22:6/0:0/0:0) 1.1994 1.7136 1.0348 0.7682 0.5758 0.3565
MGDG(14:0_16:0) 1.3124 0.8226 0.6898 1.0243 1.1166 1.1760
MGDG(16:0_16:0) 0.9244 0.6629 1.2211 1.1272 1.2922 0.7999
MGDG(16:0_18:1) 0.9754 0.6365 1.1780 1.2325 1.1030 0.9654
MGDG(16:0_18:2) 0.7543 1.0330 1.2573 0.8935 1.0829 0.9245
MGDG(18:1_18:2) 0.3896 0.3994 1.1497 1.3361 0.9120 2.2635
MGDG(18:2_18:2) 0.6414 1.3819 1.7048 0.3821 0.6456 1.2566
MGDG(18:2_18:4) 2.2862 0.8564 0.3615 0.0888 1.5155 1.2956
MGDG(18:3_18:3) 2.3647 0.8210 0.3542 0.1065 1.5291 1.2332
Monoisobutyl phthalate 1.0279 0.9576 0.9994 1.0478 0.9445 1.0570
Mycosporine glycine 0.8721 1.0793 1.6286 0.7792 1.0410 0.4473
N1-Acetylspermidine 0.8404 1.1893 0.6688 0.9403 0.7668 1.7093
N-(1-Deoxy-1-fructosyl)phenylalanine 2.6274 1.7420 0.1145 0.3994 0.6124 0.3921
N1,N8-diacetylspermidine 0.7489 0.6821 0.6778 0.7959 1.8018 1.4523
N-(2-hydroxyethyl)stearamide 1.3304 1.4464 0.5072 0.7921 0.7729 1.0859
N4-Acetylcytidine triphosphate 0.9152 1.0045 1.1990 1.0020 0.9291 0.9281
N6-Isopentenyladenosine 1.2649 1.5361 0.8806 0.8901 0.5233 0.7117
N6-methyl-2^-deoxyadenosine 1.3168 0.8591 0.9314 1.0522 0.8155 1.1861
N(6),N(6)-Dimethyl-L-lysine 0.8477 0.8571 1.7109 1.1016 0.6058 0.9341
N6,N6,N6-Trimethyl-L-lysine 0.6828 1.0176 0.6853 0.8960 1.6243 0.9842
N6-Succinyl Adenosine 0.9755 1.2618 1.2073 0.7211 0.9838 0.7161
Na-Acetyl-L-Arginine 0.8535 0.9549 0.8828 0.9969 1.3140 0.9477
Na-Acetyl-L-glutamine 0.6075 1.5202 1.0150 0.8164 0.8322 0.9832
N-Acetyl-5-Hydroxytryptamine 0.9419 1.2353 0.3499 0.7769 1.0386 1.7790
N-Acetylaspartate 1.1016 1.1790 0.6080 0.3654 1.0828 1.9417
N-Acetylcadaverine 0.8772 1.2477 0.8269 1.1483 0.3825 1.5906
N-Acetyl-D-Galactosamine 1.2593 0.8510 0.8847 1.0726 1.0761 0.9077
N-Acetyl-D-Glucosamine 1.1961 0.8452 0.9017 1.0625 1.0795 0.9808
N-acetyl-D-Lactosamine 1.9174 1.4271 1.2836 0.4956 0.5171 0.2560
N-Acetyl-DL-methionine 0.9060 1.6163 0.6960 0.7958 0.8163 0.9327
N-acetyl-D-phenylalanine 0.5921 0.6428 1.4470 1.0038 1.2829 1.1340
N-Acetylhistamine 1.2773 1.1126 0.7682 0.5240 0.8067 1.8134
N-Acetyl-L-Histidine 0.9151 1.0443 0.6858 1.1901 1.0856 1.0039
N-Acetyl-L-Leucine 1.0355 1.4053 0.5257 1.7552 0.3783 0.5511
N-Acetyl-L-phenylalanine 1.6040 1.3826 0.4622 1.4903 0.2975 0.5567
N-Acetylmannosamine 1.2170 0.8752 0.8815 1.0931 1.0351 0.9437
N-Acetylputrescine 1.3462 0.9905 0.9974 1.3002 0.5157 0.8689
N-acetylpyrrolidine 0.3739 0.7588 1.7539 0.8158 1.6628 0.4849
N-Acetylthreonine 0.1555 0.9349 1.5659 1.3872 0.8176 1.0159
N(Alpha)-Acetyl-Epsilon-(2-Propenal)Lysine 1.0714 1.0862 2.6020 0.4737 0.2898 0.5141
N-Alpha-acetyl-L-lysine 0.8372 1.1829 0.8130 1.0296 0.9558 1.1082
Neopterin 1.7062 1.3356 0.7611 0.7499 0.7821 0.5743
N-Ethylglycine 1.0775 1.0164 1.2087 0.9198 0.9518 0.7993
N-Formylglycine 1.0805 1.0195 1.2027 0.9233 0.9464 0.8002
Nicotinamide 0.8629 1.1428 0.7970 0.6153 1.4077 1.1545
Nicotinamide-N-Oxide 0.9295 0.8710 1.2088 0.8823 0.9670 1.2868
Nicotinamide riboside 0.9231 1.0928 0.6323 1.1680 0.6851 1.6085
Nicotinic Acid 0.8649 0.8994 0.8571 0.8061 1.2574 1.4620
Nicotinic Acid Adenine Dinucleotide 0.6645 0.5081 0.5351 0.6966 0.7945 3.7426
N-Methy-4-Hydroxy-Proline 0.1937 0.2399 0.3051 0.7646 3.5269 0.9065
N^-Methyl-2-pyridone-5-carboxamide 0.9156 1.1909 1.3334 0.6841 1.1853 0.5102
N-Methyl-4-aminobutyric acid 0.3598 0.7850 0.4804 1.6179 1.2942 1.4321
N-Methylalanine 1.1056 0.9770 0.8099 1.8623 0.5438 0.4933
N,N-Dimethylarginine 0.8046 1.2083 0.9875 0.7535 1.0462 1.1663
N,N-Dimethylglycine 1.0685 0.9950 1.2648 0.9271 0.9257 0.8035
N-Phenylacetylphenylalanine 2.6781 0.7689 0.4891 1.6227 0.1543 0.4490
N-(Phosphonomethyl)glycine 0.7272 0.7099 0.7194 0.7818 1.7955 1.4008
O-Acetyl-L-homoserine 0.7750 1.5882 0.7214 0.7823 1.1047 0.6943
Oleamide 0.8080 1.3361 1.2431 1.1167 0.4841 0.8448
Oxidopamine 0.9314 1.0465 1.0409 0.9399 0.9664 1.0820
Palmitoyl-EA 1.1080 1.8204 0.2558 1.0636 0.6853 0.6653
Palmitoylethanolamide((PEA) 1.3838 1.5558 0.4239 0.7714 0.6842 1.0906
Palmitoyl N-isopropylamide 0.8882 0.9096 1.1270 1.1808 0.7587 1.2102
P-Aminobenzoate 0.8056 0.5720 0.7819 1.0764 1.3703 1.6616
Pantetheine 0.9265 0.9641 1.0431 1.0378 1.0384 0.9798
PC(14:0_14:0) 0.8706 1.1247 1.0178 1.4837 0.5929 0.7328
PC(14:0_18:2) 0.7953 0.8365 1.0739 0.6601 2.0314 0.4448
PC(15:0_16:0) 0.9905 0.9887 0.6089 1.3227 1.5049 0.2860
PC(16:0_14:0) 1.0573 1.3845 0.9314 0.9848 0.5936 0.9213
PC(16:0_18:0) 0.8290 1.3278 1.0775 1.4582 0.5884 0.3598
PC(16:0_18:3) 1.0625 0.7893 1.8124 0.5843 1.3089 0.4428
PC(16:0_20:5) 0.7273 0.5479 3.2859 0.2221 1.0769 0.2532
PC(16:0_22:0) 1.1979 1.6492 0.5430 0.9382 0.7515 0.6048
PC(16:0_24:0) 1.3031 1.7440 0.4964 0.8351 0.7326 0.5538
PC(17:1_18:1) 1.7074 1.0427 1.2301 0.8427 0.7544 0.4036
PC(18:1_22:0) 1.2491 1.6623 0.6357 1.0414 0.4640 0.6641
PC(18:1_22:6) 0.7066 0.6748 1.7264 0.6096 1.6309 0.6687
PC(20:4_20:4) 0.4336 0.4677 1.2718 0.6195 2.5576 0.5847
PC(O-16:0/0:0) 0.7038 0.8330 1.8183 1.2823 0.5407 0.8166
PC(O-16:0_14:0) 0.7496 1.0666 1.4638 1.0419 0.9799 0.5099
PC(O-16:0_14:1) 0.6704 0.7872 2.2304 1.1343 0.6441 0.4730
PC(O-16:0_16:0) 0.8753 0.9786 1.8666 1.2117 0.4992 0.4470
PC(O-16:0_16:1) 0.9050 1.2780 1.4896 1.0577 0.4445 0.6671
PC(O-16:0_18:2) 1.1660 0.5928 2.0776 0.9478 0.7786 0.5647
PC(O-16:0_20:4) 1.3028 0.7801 1.1216 1.1293 1.0117 0.6838
PC(O-16:0_22:0) 1.2088 1.4680 0.4378 1.1126 0.8251 0.6932
PC(O-16:0/O-1:0) 1.3994 1.3419 0.8648 0.8689 0.7602 0.6263
PC(O-16:0/O-2:0) 0.6264 0.6045 2.2114 1.6837 0.3553 0.4634
PC(O-16:1_18:2) 2.0233 0.8622 1.3622 0.8245 0.4710 0.6588
PC(O-16:1_20:4) 1.5457 0.6799 1.1940 0.5065 0.9135 1.6292
PC(O-18:0_20:4) 0.8731 0.7687 1.6120 1.4754 0.5831 0.6480
PC(O-18:1_20:4) 1.2615 0.7156 1.3040 1.0991 0.9386 0.7699
PC(O-18:1_22:0) 0.6200 0.8352 2.5991 1.3088 0.2883 0.2056
PC(O-18:1_22:6) 0.6787 0.7804 1.2223 0.6731 1.2388 1.6586
PC(O-18:1_24:1) 0.3274 0.5169 3.0458 1.7332 0.1577 0.0855
PC(O-18:2_20:4) 0.6837 0.5719 1.2961 0.7797 1.7122 1.0753
PE(P-14:0_18:1) 0.6729 0.3475 0.6493 1.5795 0.6366 2.7275
PE(P-16:0_16:0) 0.8473 0.7913 1.1836 0.7869 1.1052 1.5130
PE(P-16:0_16:1) 0.5348 0.5824 1.5758 0.7597 1.0707 1.8498
PE(P-16:0_18:1) 1.2191 1.1007 1.3397 0.8744 0.4648 1.1000
PE(P-16:0_18:2) 1.7429 1.1221 0.8850 0.9438 0.5344 0.8402
PE(P-16:0_20:3) 2.1857 1.0311 0.8079 0.9752 0.3501 0.8272
PE(P-16:0_20:4) 2.6902 0.8645 0.6948 0.6848 0.5852 0.8160
PE(P-16:0_22:6) 3.3213 0.8306 0.5492 0.6364 0.4678 0.5914
PE(P-18:0_18:1) 1.5415 1.1071 1.0902 1.0164 0.4383 0.8592
PE(P-18:0_18:2) 1.4972 0.9753 0.7451 1.2434 0.7006 0.8707
PE(P-18:0_20:4) 2.1916 0.9802 0.5976 0.7818 0.7474 0.9085
PE(P-18:0_22:6) 2.2651 0.9216 0.6791 0.9051 0.6078 0.8407
PE(P-18:1_14:0) 1.3922 0.5312 0.4910 0.5126 0.8242 3.1551
PE(P-18:1_18:1) 0.3329 0.3764 0.4333 0.6468 0.4741 5.0772
PE(P-20:0_18:1) 1.6818 1.2319 0.9869 0.7926 0.4373 0.9501
Phe-Ala-Leu 0.1400 0.2447 0.3095 4.4262 0.1652 0.1990
Phe-Ala-Ser 0.9124 0.9948 0.5647 1.0782 1.0924 1.4302
Phe-Arg 1.3470 0.9432 1.0085 0.8230 1.0752 0.8603
Phe-Asn 0.6704 0.9329 0.5667 2.3126 0.5856 0.6342
Phe-Glu 0.5309 0.8034 1.2473 1.7703 0.6486 0.9017
Phe-Gly 0.4340 0.7286 0.8146 2.0317 0.6936 1.2538
Phe-Ile-Gly 0.9557 0.9544 0.6388 0.8329 1.1543 1.6537
Phe-Leu 0.0850 0.0617 1.0577 2.3137 2.0400 0.1489
Phe-Lys 0.3465 0.6286 0.5348 2.7244 0.5742 1.0028
Phe-Met 1.1972 1.4603 0.6384 0.8631 0.7970 0.8912
Phenethylamine 1.2773 1.9833 0.7101 1.0658 0.3142 0.1028
Phe-Phe 0.5390 0.7943 0.3844 3.0274 0.3962 0.4485
Phe-Pro 1.1224 0.9882 0.9818 1.6770 0.4573 0.6462
Phe-Trp 0.9138 0.9294 0.8194 0.9839 1.0363 1.4476
Phe-Tyr 1.1419 1.3826 0.5964 0.9452 0.7751 1.0635
Phe-Val 0.9205 1.2166 0.8173 1.0337 0.7510 1.2414
Phe-Val-Asp 0.7858 0.8505 1.0866 0.9870 1.1872 1.1607
Phytosphingosine 1.3945 2.1503 0.4490 0.3672 0.4095 0.9574
Piperidone 1.0361 1.0993 1.0687 1.0570 0.8360 0.8318
Pregnandiol 0.8438 0.5536 0.5219 0.5273 1.9351 2.0212
Pregnanetriol 0.4970 2.1205 0.5042 0.6589 0.7747 0.9783
Pro-Ala 1.2443 0.8874 1.0881 0.9328 0.8196 1.1903
Pro-Arg 1.3805 1.2823 0.5981 0.5965 0.8636 1.3943
Pro-Glu 1.5572 1.0619 1.7439 0.8068 0.4729 0.3360
Pro-Gly 1.2588 1.2147 0.8617 0.6255 0.9624 1.1203
Pro-His 0.9295 0.9704 0.5824 0.7800 1.2886 1.6113
Pro-Leu 1.3329 1.0143 0.9825 0.8585 0.8447 1.0646
Proline betaine 0.4031 0.3167 1.0011 0.6338 2.0774 1.9683
Proline Hydroxyproline 0.2916 1.4034 0.3229 0.2560 2.1282 1.4418
Protocatechuic Aldehyde 0.9910 0.5604 1.1409 0.9232 1.2388 1.4286
Pro-Val 1.9780 0.9664 1.2236 1.0357 0.5063 0.3094
Pterine 0.7246 0.7475 1.1040 0.9274 1.3548 1.2492
Pyr-Glu 0.5663 1.1409 0.6070 0.8501 1.5881 1.1151
Pyridine 0.9788 0.8905 0.9502 0.9431 1.1907 1.1049
Pyridoxal 1.0719 1.1976 1.1329 0.5053 0.7143 1.5723
Pyridoxine 0.7853 0.9621 0.8436 1.7913 0.8312 0.5321
Pyropheophorbide a 0.2934 0.3627 1.5579 0.6722 1.9300 1.4258
Pyrrolidine 0.9651 1.1716 0.9867 1.2368 0.7294 0.7607
Quinine 1.5880 0.9198 1.3889 1.0371 0.5763 0.5260
Quinoline-2-carboxylic acid 0.9430 0.6716 1.3984 0.6212 1.3591 1.2258
(R)-(-)-2-phenylglycine 1.1034 1.2406 0.9011 1.1140 0.7302 0.7744
Ribosyl adenosine 0.2500 0.7173 0.2847 0.3612 2.8722 1.5737
SE(28:1_18:2) 1.6250 1.0634 0.9569 0.9498 0.6245 0.8495
Ser-Arg 1.0088 1.3584 0.7157 0.8178 1.0402 0.9100
Ser-Leu 0.8337 1.2431 0.8964 1.2606 0.5861 1.0744
Ser-Phe 0.6553 1.1959 0.6678 1.9711 0.5411 0.6205
Ser-Phe-Ala 0.9112 0.9656 0.6135 1.1121 1.0993 1.3585
Ser-Pro 1.3279 1.0965 0.8658 0.9057 0.7838 1.0849
Ser-Ser 1.0913 1.3641 0.5228 0.9551 0.7666 1.2530
Ser-Val 0.6228 0.9108 0.7781 2.2022 0.5149 0.7309
SHexCer(d18:1:/16:0) 1.5352 1.1696 0.4153 0.7194 0.9650 1.3271
SHexCer(d18:1:/16:0(OH)) 1.3898 1.8252 0.2499 0.6570 0.7785 0.8391
SHexCer(d18:1:/24:0) 0.3966 0.2435 1.5568 1.8320 0.2652 2.1964
Shinorine 1.2239 1.3307 0.8099 0.9438 0.7260 0.8583
SM(d18:0/12:0) 0.6711 0.7691 0.9624 2.0777 0.7715 0.5128
SM(d18:0/14:0) 0.8896 1.1222 0.8819 1.3906 0.7676 0.7821
SM(d18:0/16:0) 1.0647 1.4034 0.9222 0.9699 0.6249 0.8655
SM(d18:0/17:0) 1.0716 1.4981 0.8032 1.0119 0.6714 0.6981
SM(d18:0/18:0) 1.2651 1.5494 0.6521 0.8439 0.6646 0.8517
SM(d18:0/20:0) 1.2328 1.5756 0.4120 1.2178 0.5790 0.6959
SM(d18:0/22:0) 1.0745 1.4294 0.5534 1.2187 0.6636 0.8438
SM(d18:1/12:0) 0.4342 0.4542 3.1178 1.3798 0.3145 0.3096
SM(d18:1/14:0) 0.5827 0.7833 2.5662 1.1992 0.3746 0.4366
SM(d18:1/15:0) 0.6498 0.7598 2.2254 1.1934 0.6514 0.4518
SM(d18:1/16:0) 0.8430 1.0874 1.7368 1.1394 0.4167 0.6875
SM(d18:1/16:1) 0.3475 0.4631 3.5514 1.3356 0.1435 0.1419
SM(d18:1/17:0) 0.8308 1.1988 1.5478 1.1328 0.4878 0.6438
SM(d18:1/17:1) 0.4451 0.5415 2.8465 1.5097 0.3049 0.2997
SM(d18:1/18:0) 0.6142 0.9261 1.3459 1.0391 0.7558 1.4350
SM(d18:1/19:0) 1.0303 0.8332 1.6943 1.1326 0.5222 0.8653
SM(d18:1/19:1) 0.0275 0.1764 0.0732 0.0114 1.6152 5.5915
SM(d18:1/20:1) 0.3431 0.5087 3.1402 1.6221 0.1592 0.1306
SM(d18:1/21:1) 0.8511 0.5497 2.3515 1.4889 0.3571 0.4251
SM(d18:1/22:1) 0.2505 0.4706 3.2444 1.7149 0.1156 0.0913
SM(d18:1/23:0) 0.7599 1.1058 1.0968 1.6754 0.5331 0.5791
SM(d18:1/24:0) 0.6665 0.9930 1.3250 1.8280 0.4441 0.4921
SM(d18:1/24:1) 0.3880 0.5763 3.3201 1.2481 0.1849 0.2624
SM(d18:1/25:0) 0.7818 1.3056 0.9287 1.6991 0.4498 0.4822
SM(d18:1/25:1) 0.5909 1.1002 1.8463 1.2658 0.4325 0.5871
SM(d18:1/26:0) 1.0037 1.6469 0.8163 1.2468 0.5007 0.3587
SM(d18:1/26:1) 0.7748 1.4144 1.4481 1.2199 0.3877 0.4412
SM(d18:2/14:0) 0.2802 0.3447 3.3622 1.2691 0.5635 0.1748
SM(d18:2/18:1) 0.3189 0.6765 2.6521 1.4453 0.1912 0.7200
SM(d18:2/22:1) 0.3561 0.5345 2.8797 1.4539 0.2325 0.5698
SM(d18:2/24:1) 0.3979 0.4916 3.1945 1.5145 0.1479 0.2145
SM(d18:2/26:1) 0.5439 0.7671 2.3200 1.6786 0.2348 0.2920
SM(d20:0/24:1) 1.0070 1.6747 0.8474 1.2406 0.4699 0.3164
S-methyl-L-thiocitrulline 0.7175 0.7832 2.0199 1.0514 0.7440 0.6878
Sn-Glycero-3-Phosphocholine 1.0240 1.2530 0.7858 1.0376 0.8839 0.8874
SPH(d16:1) 0.8320 0.8409 1.2600 1.2952 0.8924 0.8483
SPH(d17:0) 1.3567 1.1152 1.2721 0.6508 0.5441 1.2371
SPH(d17:1) 1.6311 1.7308 0.6989 0.6407 0.3026 0.8795
SPH(d18:0) 1.3627 1.1925 1.2076 0.6654 0.4695 1.2566
SPH(d18:1) 1.4975 1.8314 0.7880 0.4623 0.3580 0.9230
SPH(d18:2) 0.8606 1.2458 2.0236 0.5441 0.3219 1.0657
Sphingosine 1.4973 1.5918 0.6109 0.7208 0.3825 1.1727
Sphingosyl-phosphocholine 0.4004 0.4810 2.0864 0.9083 1.5793 0.5220
S-Sulfo-L-Cysteine 0.5941 1.1986 0.6908 0.7278 1.2140 1.6152
ST-638 1.9235 1.5546 0.3000 0.2555 1.3088 0.5086
Testosterone 0.7656 0.8064 1.2728 0.8859 0.9369 1.5560
Tetraethylene glycol 2.4166 1.0804 0.5051 0.7787 0.5322 0.9051
TG(10:0_12:0_14:0) 0.0347 0.0235 0.0534 4.6993 0.5680 0.0505
TG(10:0_12:0_18:1) 0.0528 0.0311 0.0578 4.7964 0.4300 0.0624
TG(10:0_14:0_16:0) 0.0447 0.0428 0.0940 4.5552 0.6147 0.1059
TG(10:0_16:0_12:0) 0.0501 0.0540 0.1091 4.6336 0.5152 0.0832
TG(10:0_16:0_16:1) 0.1932 0.1743 0.3121 3.7120 0.9061 0.2879
TG(10:0_16:0_18:1) 0.4332 0.2461 0.4781 3.1203 0.9055 0.5868
TG(10:0_16:0_18:2) 0.4365 0.3531 0.5817 2.7534 0.9080 0.8168
TG(10:0_16:2_18:2) 0.2924 0.1238 2.4425 0.4556 1.8152 1.2207
TG(10:0_18:1_18:2) 0.3695 0.1701 0.4818 3.0312 0.6287 1.3580
TG(12:0_12:0_18:0) 0.0271 1.6921 0.0459 2.8130 0.4432 0.0453
TG(12:0_14:0_16:0) 0.1574 0.1666 0.1981 3.9852 0.7689 0.2697
TG(12:0_14:0_16:1) 0.5289 0.5578 0.5719 2.3785 1.1259 0.5966
TG(12:0_14:0_18:0) 0.0863 0.1307 0.1011 4.3499 0.6191 0.1980
TG(12:0_14:0_18:1) 0.3897 0.4355 0.4911 3.1231 0.7879 0.4290
TG(12:0_14:0_18:2) 0.5307 0.5424 0.5931 2.5139 1.0044 0.5638
TG(12:0_15:0_16:1) 0.9700 0.8820 0.9448 1.2003 1.0675 0.9164
TG(12:0_16:0_16:0) 0.1511 1.7122 0.1949 2.3884 0.4849 0.2731
TG(12:0_16:0_16:1) 0.8647 0.8722 1.0180 1.2396 1.0981 0.8523
TG(12:0_16:0_18:1) 0.3325 0.2772 0.5343 3.4946 0.5864 0.4557
TG(12:0_16:0_18:2) 0.4963 0.4772 0.5935 2.5743 0.8665 0.8394
TG(12:0_16:1_18:2) 0.4643 0.3954 0.5368 2.2669 0.8781 1.5783
TG(14:0_14:0_16:0) 0.3375 1.7864 0.4196 1.6962 0.6279 0.4955
TG(14:0_14:1_16:1) 0.8488 0.8514 0.9252 1.4222 1.0068 0.8822
TG(14:0_14:1_18:1) 0.2548 0.1934 0.3279 3.7882 0.5171 0.6210
TG(14:0_16:0_16:0) 0.4199 1.1926 0.9664 0.7878 1.0321 1.6402
TG(14:0_16:0_16:1) 0.6860 0.7727 0.8489 2.0600 0.7787 0.6571
TG(14:0_16:0_18:0) 0.4003 1.4301 0.4366 1.0149 1.2981 1.1557
TG(14:0_16:0_18:1) 0.4455 0.3627 1.7016 2.1342 0.6069 0.7268
TG(14:0_16:0_18:2) 0.4950 0.4601 1.2796 1.9720 0.7745 1.0503
TG(14:0_16:1_18:1) 0.3674 0.4091 0.6750 3.0843 0.5915 0.6167
TG(14:0_16:1_18:2) 0.4543 0.5184 0.8627 2.1208 0.9706 1.0123
TG(14:0_18:0_18:2) 0.2262 0.1995 1.3555 2.3962 0.8469 0.9819
TG(14:0_18:0_20:0) 0.4084 0.4216 1.0963 0.7977 1.3335 2.4905
TG(14:0_18:2_18:2) 0.2666 0.4071 0.8552 1.2235 2.0832 1.2064
TG(14:0_18:2_18:3) 0.5294 0.3852 1.0050 1.1560 1.9315 1.0765
TG(14:1_14:1_16:1) 0.7986 0.8869 0.7813 1.5641 0.9616 0.9079
TG(14:1_16:0_16:1) 0.5620 0.5853 0.7861 2.1378 1.0248 0.7523
TG(14:1_16:1_16:1) 0.8139 0.9145 0.9358 1.2207 1.2100 0.8021
TG(14:1_16:1_18:1) 0.3671 0.3340 0.7755 2.4910 0.9653 1.0056
TG(15:0_14:1_16:1) 0.7179 1.0048 0.9318 1.0923 1.3218 0.7818
TG(15:0_16:0_16:0) 0.9053 1.0160 0.9994 0.9497 1.0805 1.0395
TG(15:0_16:0_16:1) 0.8369 1.0402 0.9166 1.1527 1.1009 0.8314
TG(15:0_16:0_18:0) 0.5182 0.8211 0.9823 1.0027 1.7736 0.7638
TG(15:0_16:0_18:1) 0.6312 0.8283 1.3888 1.1889 1.0080 0.9300
TG(15:0_16:0_18:2) 0.5861 0.6962 1.3637 1.2711 1.2126 0.8321
TG(15:0_16:1_16:1) 0.9152 1.0075 0.9282 1.1583 1.0862 0.8005
TG(15:0_16:1_18:1) 0.5690 0.7586 1.3529 1.2225 1.1554 0.9096
TG(15:0_16:1_18:2) 0.6477 0.8467 1.0634 1.4085 1.0467 0.9036
TG(15:0_17:0_19:2) 0.5025 0.5922 1.3486 1.2115 1.3135 1.0921
TG(15:0_18:0_20:0) 0.1626 0.6249 0.2014 0.8848 3.1518 0.7152
TG(15:0_18:1_18:2) 0.3636 0.5445 1.2548 1.2581 1.5390 1.0586
TG(15:0_18:1_24:1) 0.1025 0.0963 2.5134 0.8007 1.9317 0.6794
TG(15:0_18:2_18:2) 0.4220 0.5476 0.9738 0.9684 2.1787 0.8583
TG(15:0_18:2_18:3) 0.5691 0.4463 1.3728 1.0091 1.7632 0.9076
TG(15:0_24:0_18:1) 0.2555 0.1919 2.6067 0.8578 1.5264 0.7106
TG(16:0_14:1_18:2) 0.5983 0.6129 1.0517 1.6851 1.1521 0.8287
TG(16:0_16:0_16:0) 0.4096 0.4338 0.6817 0.5568 1.5441 3.0839
TG(16:0_16:0_16:1) 0.6210 0.6361 1.4998 1.6550 0.6806 0.9154
TG(16:0_16:0_17:0) 0.4544 0.7060 0.5971 0.9046 1.9727 1.4291
TG(16:0_16:0_18:0) 0.6270 0.7105 0.8262 1.1037 1.2483 1.6853
TG(16:0_16:0_18:1) 0.3563 0.2438 1.9582 1.5646 0.9637 1.0833
TG(16:0_16:0_20:4) 1.1450 1.7028 1.0242 1.2388 0.1392 0.3647
TG(16:0_16:0_24:0) 0.4884 0.4110 1.1622 0.8227 1.4454 2.1221
TG(16:0_16:1_16:1) 0.5821 0.6660 1.1520 1.6432 0.7815 1.2344
TG(16:0_16:1_17:1) 0.8706 0.9646 0.8644 1.3692 0.9250 0.9276
TG(16:0_16:1_18:1) 0.3167 0.2505 1.5877 1.5337 1.5255 0.8168
TG(16:0_16:1_18:2) 0.4280 0.4746 1.2559 1.7349 1.0635 1.0743
TG(16:0_16:1_18:3) 0.3089 0.5558 0.9704 2.0700 0.7948 1.3110
TG(16:0_16:1_20:1) 0.3137 0.1836 1.7742 1.3411 1.6389 0.8349
TG(16:0_16:1_20:5) 0.3798 0.2227 0.9987 1.2419 2.1881 1.0500
TG(16:0_16:1_22:5) 0.4597 0.1238 1.8511 0.8316 2.1753 0.6785
TG(16:0_17:0_18:0) 0.2056 0.5648 0.3694 1.4057 2.3180 0.9825
TG(16:0_17:0_18:1) 0.3711 0.3870 1.6556 1.5031 1.1458 1.0190
TG(16:0_17:1_18:1) 0.4528 0.5054 1.1160 2.0953 0.8852 0.8696
TG(16:0_17:1_18:2) 0.2096 0.3002 1.3808 1.5024 1.6893 0.9262
TG(16:0_18:0_18:0) 0.5382 0.6766 0.7118 1.2587 1.3902 1.5479
TG(16:0_18:0_18:1) 0.2705 0.2212 2.3690 1.3376 1.0866 0.8540
TG(16:0_18:0_18:2) 0.5542 0.2548 1.9104 1.0975 1.5097 0.8157
TG(16:0_18:0_20:0) 0.4571 0.4852 0.8660 0.9345 1.4214 2.2704
TG(16:0_18:0_20:1) 0.3220 0.2193 0.6004 3.1081 0.4617 1.2899
TG(16:0_18:0_20:4) 0.4797 0.1480 2.5207 0.5560 1.8214 0.6834
TG(16:0_18:0_22:0) 0.4563 0.5886 0.8837 0.7777 1.8021 1.7267
TG(16:0_18:0_24:0) 0.4600 0.5499 1.0654 0.5248 1.7224 2.0744
TG(16:0_18:1_18:1) 0.2264 0.1448 1.8475 1.5540 1.4641 0.8383
TG(16:0_18:1_18:2) 0.1957 0.1686 1.7526 1.1526 1.9536 0.8564
TG(16:0_18:1_20:1) 0.4525 0.1128 1.8255 1.0268 2.0782 0.5788
TG(16:0_18:1_20:2) 0.1983 0.1412 1.1065 1.1019 2.7462 0.6587
TG(16:0_18:1_20:4) 0.6291 0.7350 1.3154 2.3821 0.1456 0.6135
TG(16:0_18:1_22:0) 0.1224 0.0483 2.4910 0.6821 2.1338 0.6627
TG(16:0_18:1_22:1) 0.1701 0.2361 0.7514 1.0494 2.2675 1.7845
TG(16:0_18:1_22:3) 0.1905 0.0968 1.2851 0.8766 2.6637 0.9951
TG(16:0_18:1_22:6) 0.9472 1.5217 1.1808 1.4078 0.2498 0.3003
TG(16:0_18:2_18:2) 0.2490 0.1765 1.5573 0.9988 2.3133 0.7433
TG(16:0_18:2_18:3) 0.4163 0.3133 1.2283 1.8326 1.1197 1.1949
TG(16:0_18:2_20:4) 0.3893 0.1203 1.7011 0.6588 2.4668 0.8037
TG(16:0_18:2_22:6) 1.4986 1.8684 0.8701 0.9598 0.2056 0.1826
TG(16:0_20:0_18:1) 0.1679 0.0889 2.6052 0.9793 1.6364 0.6549
TG(16:0_20:1_22:0) 0.1325 0.0482 2.6260 0.7791 1.8659 0.7191
TG(16:0_23:0_18:1) 0.2055 0.1086 2.8115 0.8904 1.4614 0.7018
TG(16:0_24:0_18:1) 0.0625 0.0538 1.9971 0.9480 2.3663 0.6107
TG(16:0_25:0_18:1) 0.1736 0.1077 3.3365 0.6740 1.1800 0.8051
TG(16:0_26:0_18:1) 0.0988 0.0933 1.7586 0.8246 2.2028 1.2512
TG(16:1_16:1_17:1) 0.7968 1.0554 0.8896 1.1258 0.9762 1.1146
TG(16:1_16:1_18:1) 0.3330 0.4239 0.8029 2.2139 0.7244 1.6366
TG(16:1_16:1_18:2) 0.3433 0.4730 0.8557 1.2877 1.8100 1.2983
TG(16:1_18:0_20:1) 0.1333 0.1084 1.1538 1.7786 1.9091 0.9184
TG(16:1_18:1_18:1) 0.2862 0.3605 1.1321 2.0106 0.8655 1.4840
TG(16:1_18:1_18:2) 0.2381 0.1699 1.5878 0.9580 2.3593 0.7237
TG(16:1_18:1_18:3) 0.4161 0.3251 1.2321 1.8733 1.0275 1.2414
TG(16:1_18:1_20:3) 0.2278 0.1380 1.6762 1.0848 2.0469 0.9467
TG(16:1_18:1_22:1) 0.1517 0.1047 0.7174 0.7209 3.2468 1.1542
TG(16:1_18:2_18:2) 0.3543 0.3103 1.3427 1.3716 1.5795 1.1607
TG(16:1_18:2_18:3) 0.6729 0.4194 1.2090 0.6867 2.2817 0.7895
TG(17:0_18:0_18:0) 0.7231 0.8340 0.7540 1.0235 1.6646 0.9351
TG(17:0_18:0_18:1) 0.2774 0.3489 1.9682 1.4052 1.2083 0.8459
TG(17:0_18:1_18:1) 0.3075 0.2307 2.1529 1.1170 1.4773 0.8438
TG(17:0_18:1_18:2) 0.3228 0.2169 1.7543 1.1230 1.7559 0.9568
TG(17:1_18:1_18:1) 0.1802 0.1983 1.2990 1.8367 1.5335 0.9692
TG(17:1_18:1_18:2) 0.1685 0.1605 1.5238 1.5279 1.6647 1.0477
TG(17:1_18:1_20:2) 0.2232 0.0742 1.5514 1.1792 1.7777 1.4951
TG(17:1_18:2_18:2) 0.2616 0.2138 1.4608 0.9697 2.2211 0.9702
TG(17:1_18:2_18:3) 0.3226 0.1804 1.4058 0.4760 3.0403 0.5894
TG(18:0_18:0_18:0) 0.4973 0.7089 0.7359 0.9853 1.8780 1.2028
TG(18:0_18:0_18:1) 0.2337 0.2419 3.4803 0.7059 0.8908 0.6693
TG(18:0_18:1_18:1) 0.3122 0.1317 3.1943 0.6714 1.2727 0.6523
TG(18:0_18:1_18:2) 0.2454 0.1503 2.5723 0.7121 1.6952 0.8257
TG(18:0_18:1_20:0) 0.2988 0.0836 4.0460 0.4748 0.9072 0.4838
TG(18:0_18:1_20:1) 0.1693 0.1369 2.3127 1.1894 1.3934 0.9831
TG(18:0_18:1_20:4) 1.0472 1.1095 1.7005 1.4554 0.2104 0.2644
TG(18:0_18:2_20:0) 0.3377 0.0630 2.7326 0.6529 1.8207 0.5770
TG(18:0_18:2_20:4) 1.0900 1.2217 1.3525 1.5301 0.1679 0.4090
TG(18:0_18:3_20:2) 0.5528 0.2697 1.3078 1.3548 1.4224 1.3157
TG(18:0_20:0_22:0) 0.4616 0.6139 0.7380 0.4174 1.4784 2.9224
TG(18:0_20:1_22:0) 0.1159 0.0686 2.4043 0.7511 2.0576 0.7519
TG(18:0_20:1_22:1) 0.0157 0.0272 1.3200 0.5960 2.8130 1.5063
TG(18:0_22:0_18:2) 0.4868 0.0482 2.3219 0.5639 2.1811 0.5794
TG(18:1_18:1_18:1) 0.1730 0.0980 1.8560 0.8774 2.2534 0.8664
TG(18:1_18:1_18:2) 0.2190 0.1001 2.4518 0.7216 1.8740 0.8300
TG(18:1_18:1_20:1) 0.1335 0.0656 1.3974 0.8471 2.7062 0.9549
TG(18:1_18:1_22:1) 0.1142 0.1132 0.7527 0.6924 2.7583 1.9125
TG(18:1_18:2_18:2) 0.2199 0.0916 2.2446 0.6851 2.1164 0.8158
TG(18:1_18:2_18:3) 0.3994 0.1484 1.7577 0.9775 1.7446 1.2413
TG(18:1_18:2_18:4) 0.6397 0.2160 1.9212 0.9771 1.4781 1.0138
TG(18:1_18:2_20:0) 0.1497 0.0581 1.9704 0.7552 2.4227 0.7569
TG(18:1_18:2_20:1) 0.3886 0.0685 1.7269 0.5548 2.7698 0.5798
TG(18:1_18:2_20:2) 0.3326 0.1003 1.1739 0.6300 3.1601 0.6168
TG(18:1_18:2_20:4) 1.2775 0.8148 1.4398 1.5543 0.1873 0.7862
TG(18:1_18:2_22:0) 0.0461 0.0238 1.4310 0.6415 3.1203 0.7965
TG(18:1_18:2_22:6) 1.5418 1.5286 0.8603 1.0270 0.3163 0.5238
TG(18:1_20:1_22:1) 0.0365 0.0318 1.3500 0.7649 3.0012 0.8837
TG(18:1_22:1_18:2) 0.1002 0.0245 1.2568 0.5491 3.5649 0.4436
TG(18:2_18:2_18:3) 0.7515 0.2197 2.0638 0.9177 1.3407 0.9865
TG(18:2_18:2_20:1) 0.2855 0.0857 1.0600 0.5907 3.3111 0.6872
TG(18:2_18:2_20:2) 0.7739 0.3332 1.1875 1.0424 1.7154 1.1516
TG(18:2_18:3_18:3) 0.5188 0.2005 1.0888 1.1609 2.0273 1.1797
TG(18:2_18:3_18:4) 0.3503 0.0622 0.4548 0.4584 3.9700 0.6849
TG(19:1_18:2_18:2) 0.4003 0.2195 1.5740 0.7347 2.2177 1.0237
TG(20:1_18:2_18:0) 0.3879 0.1661 1.7455 0.8041 2.2499 0.7537
TG(22:0_18:1_18:1) 0.0979 0.0257 1.8009 0.7124 2.7269 0.7171
TG(23:0_18:1_18:1) 0.0863 0.0735 3.0363 0.7051 1.6101 0.6786
TG(23:0_18:1_18:2) 0.1128 0.0744 2.5355 0.6709 1.9530 0.8533
TG(24:0_18:1_18:1) 0.0797 0.0356 1.7429 0.8602 2.6464 0.6833
TG(24:0_18:1_18:2) 0.0414 0.0346 1.4258 0.8094 2.9540 0.7719
TG(24:0_18:1_20:1) 0.0457 0.0363 1.5636 0.8034 2.7043 0.9637
TG(8:0_14:0_16:0) 0.0331 0.0305 0.0494 4.8269 0.4344 0.0430
TG(8:0_14:0_18:0) 0.2356 0.2001 0.4240 3.2078 1.2371 0.3415
TG(8:0_14:0_18:1) 0.1451 0.1466 0.2341 4.1200 0.6816 0.1919
TG(8:0_16:0_16:0) 0.0551 1.3676 0.1103 3.0825 0.4593 0.0979
TG(8:0_16:0_18:1) 0.0725 0.0657 0.2346 4.4816 0.4987 0.1328
TG(8:0_16:0_18:2) 0.1673 0.1251 0.7479 3.0421 1.2545 0.3693
TG(8:0_18:1_18:2) 0.2300 0.1707 2.0749 1.4795 1.0734 1.1854
Theobromine 0.1641 0.2691 0.2497 0.4210 3.3438 1.7776
Theophylline 0.4183 0.5660 0.2959 0.6942 2.0597 2.3439
Thiamine 0.6609 0.5198 1.0358 0.9287 1.3189 1.9028
Thioacetic acid-S-methyl ester 1.3487 1.2019 0.9034 1.1351 0.6597 0.6316
Thr-Arg 0.8776 1.4972 0.6904 0.8207 1.0107 0.8704
Thr-Asp 0.8225 0.9881 0.8221 0.8696 1.0378 1.6168
Thr-Glu 0.9103 0.9944 0.8066 1.0538 0.9998 1.2883
Thr-His 1.3753 1.2479 0.7790 0.8451 0.7561 0.9929
Thr-Ile 0.8386 1.0009 0.8551 1.4664 0.7030 1.0866
Thr-Leu 0.8304 1.0012 0.8654 1.4748 0.6995 1.0740
Thr-Phe 0.5981 1.1679 0.9218 1.7159 0.4947 0.8757
Thr-Ser 0.7238 1.0474 0.6643 1.7136 0.6014 1.1469
Thr-Val-Ile 0.5307 1.3360 0.6747 2.0533 0.4450 0.5022
Thr-Val-Leu 0.5307 1.3360 0.6747 2.0533 0.4450 0.5022
Thymidine 1.3439 1.2148 0.7572 0.8680 0.8081 1.0077
Thymine 0.9581 0.7913 1.4355 0.7541 0.9808 1.2864
Trans-4-Hydroxy-L-Proline 0.8112 1.5183 0.4672 0.6002 1.7584 0.4325
Trans-Cinnamaldehyde 0.6098 0.2024 2.6331 1.0486 0.4723 1.5212
Triethylenetetramine 0.9551 0.9545 1.0181 1.0420 1.0510 0.9724
Trigonelline 0.4250 0.7393 1.7874 0.2759 1.5166 1.4924
Trimethylamine N-Oxide 1.1721 1.1275 0.7554 0.7546 1.0830 1.1450
Trp-Ile 1.2868 1.3614 0.8041 0.9221 0.6569 0.8720
Trp-Met 1.2496 1.1371 0.7494 1.0163 0.8116 1.0368
Trp-Ser 1.2511 0.8160 1.4963 0.8002 0.9420 0.8014
Trp-Thr 0.4842 0.7848 1.0435 2.6959 0.2685 0.3682
Trp-Trp 1.2667 0.7823 0.5686 1.1577 0.5183 2.1541
Trp-Val 1.2138 1.4135 0.6767 0.9926 0.5911 1.0141
Tryptamine 0.9283 1.2143 0.5890 0.8452 1.0763 1.3515
tryptophan betaine 0.3792 0.5060 2.0269 1.2412 0.4159 1.7963
Tubercidin 0.3713 0.1391 0.7132 0.1770 1.3838 4.4934
Tyr-Cys 0.7176 0.6743 1.9275 1.0685 0.7852 0.9309
Tyr-Leu 1.0783 1.2064 0.6781 1.0861 0.7761 1.1417
Tyr-Pro 1.2690 1.1135 0.8784 0.9213 0.7486 1.1325
Tyr-Ser 1.1057 0.9769 1.0849 0.9899 0.7752 1.1607
Tyr-Thr 0.9137 0.9468 0.5552 0.6642 1.2356 1.9739
Tyr-Tyr 1.2900 1.5395 0.4322 0.8809 0.8111 0.8568
Uracil 1.7260 0.9151 0.9531 0.7708 0.8086 1.0283
URB937 1.9841 1.7780 0.2390 0.3102 1.0672 0.3667
Urea 0.9258 0.9437 1.1187 1.0133 1.0194 0.9861
Uridine 1.2773 1.1733 1.2635 0.9823 0.6179 0.5939
Urobilinogen 1.3557 1.6911 0.0730 0.8429 0.9851 0.7674
Val-Ala 0.5470 0.9255 0.8392 2.0380 0.6456 0.7737
Val-Arg 0.6365 1.2873 0.6419 1.2086 1.1334 0.8206
Val-Glu 0.9076 0.9310 1.1668 1.1178 0.8163 1.1067
Val-Ile 0.8871 1.0562 0.8663 1.3642 0.6198 1.1960
Val-Leu 0.8849 1.0598 0.8681 1.3725 0.6172 1.1798
Val-Tyr 1.0057 1.3406 0.7453 0.8669 0.8589 1.1026
Val-Val-Val 1.0980 1.0853 0.5751 0.8149 1.0373 1.5258
Xanthosine 1.7157 1.2497 1.2666 0.6385 0.6025 0.4996
Xanthurenic Acid 1.0675 1.0456 0.9298 0.8465 1.0834 1.0455
(Z) -4 ^, 6-dihydroxyfuranone 0.5219 0.6817 1.0492 0.5600 1.7184 1.7214
(Z)-Guggulsterone 1.0847 1.6849 1.0416 0.8547 0.5197 0.4834
Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

Factors:

F1Group type:Colorectal adenoma | Sex:Female
F2Group type:Colorectal adenoma | Sex:Male
F3Group type:Colorectal cancer | Sex:Female
F4Group type:Colorectal cancer | Sex:Male
F5Group type:Heathy control | Sex:Female
F6Group type:Heathy control | Sex:Male
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