Data for (Study ST004301)

(Analysis AN007164)

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-acetylmonomelittoside 1.0675 1.4725 0.8757 1.1106 0.7197 0.7541
10-Hydroxyligustroside 1.0898 0.6870 1.4029 1.2607 0.6220 0.9376
10-Hydroxyoleuropein 1.0800 1.0438 0.8582 0.8710 0.5670 1.5800
1,14-Tetradecanedioic Acid 0.9733 1.1052 0.9156 0.9811 1.0153 1.0094
11-Hydroxyazadirachtin B 0.6285 0.7249 0.6975 0.8503 1.4034 1.6954
11-Hydroxy-sugiol 0.2176 0.7911 4.0647 0.3891 0.3092 0.2284
11-Octadecanoic acid(Vaccenic acid)* 0.9830 1.3647 0.8391 1.0471 0.9740 0.7920
12,13-DHOME; (9Z)-12,13-Dihydroxyoctadec-9-enoic acid 1.0388 1.4033 0.8741 1.1992 0.6353 0.8492
12,13-Epoxy-9-Octadecenoic Acid 1.1326 1.2901 0.9181 0.5772 0.9648 1.1172
1-(2,3-dihydroxypropoxy)-3-(((2-(dimethylamino)ethoxy)(hydroxy)phosphoryl)oxy)propan-2-yl (11Z,14Z)-octadeca-11,14-dienoate 1.1163 1.1545 1.0936 0.5026 1.0978 1.0353
1-(2,3-dihydroxypropoxy)-3-(((2-(dimethylamino)ethoxy)(hydroxy)phosphoryl)oxy)propan-2-yl (8E,11Z,14Z)-octadeca-8,11,14-trienoate 1.1378 1.7822 0.8026 0.6662 0.5552 1.0560
1-(2,3-dihydroxypropoxy)-3-(((2-(dimethylamino)ethoxy)(hydroxy)phosphoryl)oxy)propan-2-yl (E)-hexadec-9-enoate 1.1583 1.7094 1.0528 0.5283 0.6769 0.8742
1-(2,3-dihydroxypropoxy)-3-(((2-(dimethylamino)ethoxy)(hydroxy)phosphoryl)oxy)propan-2-yl heptadecanoate 0.7322 0.8598 0.8417 0.5429 1.8551 1.1682
1-(2,3-dihydroxypropoxy)-3-(((2-(dimethylamino)ethoxy)(hydroxy)phosphoryl)oxy)propan-2-yl palmitate* 0.8481 0.7556 1.2589 0.9896 1.4688 0.6790
1,2,3-Trihydroxy-19-oxo-18,19-seco-urs-11,13(18)-dien-28-oic acid 0.8156 0.2155 4.3025 0.0507 0.5156 0.1001
1,2,6-Tri-O-galloyl-β-D-glucose* 1.0464 NA 1.8852 0.6506 0.5969 0.8209
12-Hydroxydodecanoic acid 1.0390 0.9373 0.9194 0.9179 0.9500 1.2363
12-Hydroxyoctadecanoic acid 0.4400 0.5082 1.3342 0.4465 0.6864 2.5847
12-Oxo-phytodienoic acid 1.0254 1.8913 0.7542 0.6844 0.4291 1.2156
1,3,6-Tri-O-galloyl-β-D-glucose* 1.0464 NA 1.8852 0.6506 0.5969 0.8209
13-Hydroperoxy-9Z,11E-octadecadienoic acid* 1.2470 1.0474 0.9333 0.7315 0.6305 1.4102
13-KODE; (9Z,11E)-13-Oxooctadeca-9,11-dienoic acid* 1.0172 1.8302 0.8162 0.8179 0.6150 0.9035
13-methylmyristic acid 0.8406 0.9149 1.2122 1.1124 0.9433 0.9766
1,3-O-Dicaffeoylquinic Acid (Cynarin) 0.9871 1.3265 0.4005 0.2342 1.2421 1.8096
13(S)-HODE;13(S)-Hydroxyoctadeca-9Z,11E-dienoic acid* 0.5878 1.9296 0.6091 0.3965 1.2653 1.2118
13S-Hydroperoxy-6Z,9Z,11E-octadecatrienoic acid 0.9856 1.8886 0.5151 0.6493 0.7631 1.1984
13(s)-hydroperoxy-(9z,11e,15z)-octadecatrienoic acid 1.0166 0.8688 1.2273 1.0352 1.0190 0.8331
13S-Hydroperoxy-9Z,11E-octadecadienoic acid 0.6485 1.1924 0.7588 1.1133 0.9750 1.3120
13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid 0.4751 2.1613 0.5342 0.3215 1.4804 1.0275
1,4,8-Trihydroxynaphthalene-1-O-[6^-O-(3^^-methoxy-5^^-hydryoxybenzoyl)]glucoside 1.4305 1.1256 1.3408 1.6143 0.1989 0.2899
1,4-Dihydro-1-Methyl-4-oxo-3-pyridinecarboxamide 1.1419 0.8481 1.8812 0.7761 0.8586 0.4940
1,4-Di-O-galloyl-2-O-p-coumaroyl-β-D-glucose 1.1145 1.0878 0.9096 1.3075 1.0429 0.5377
1-(4^-Hydroxy-3^-methoxyphenyl)-2-[4^^-(3-hydroxypropyl)-2^^,6^^-dimethoxyphenyl]-propane-1,3-Diol 0.6964 1.2469 1.3899 1.1977 0.7823 0.6867
1-(4-Methoxyphenyl)-1-propanol 0.8705 0.8403 0.8676 1.0292 1.4156 0.9768
1,5-Anhydro-D-glucitol 1.1136 1.3395 0.6900 0.7612 0.8386 1.2572
1,6-anhydro-β-D-glucose 0.7672 0.8488 2.1185 0.5364 1.0527 0.6764
1,7-Di-O-galloyl-D-sedoheptulose 0.9279 1.6432 1.1435 0.7401 0.8878 0.6575
17-Hydroxylinolenic acid 0.7374 1.5230 0.6360 0.4742 1.3237 1.3056
18-Hydroxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid 0.8973 0.8350 0.9744 1.7955 0.7921 0.7057
19,20-DiHDPA 1.0001 1.0052 0.8412 1.0001 0.9907 1.1627
1-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine 0.7576 0.8944 0.5451 1.0824 1.0407 1.6799
1-Decanol* 0.9345 0.9931 0.8787 1.1392 1.0046 1.0498
1-Eicosanol 0.8197 0.8994 0.5279 0.5042 1.0964 2.1525
1-Hydroxypineolin Diglucoside* 0.9941 0.8793 0.3281 1.2897 0.5157 1.9931
1-Hydroxypinoresinol-1-O-Glucoside 1.0781 0.8432 0.4172 0.8398 1.0099 1.8118
1-Linoleoyl-2-Lysophosphatidic Acid Monobutylamine Ester 1.1028 1.1725 1.0794 0.6540 0.9325 1.0588
1-O-(3,4-Dihydroxy-5-methoxy-benzoyl)-glucoside 0.6404 0.6056 1.3719 1.5476 0.9975 0.8369
1^-O-(3,4-Dihydroxyphenethyl)-O-caffeoyl-glucoside 1.2618 1.2701 0.7176 0.6243 1.2483 0.8779
1-O-Caffeoyl-3-O-galloyl-β-D-glucose 0.5403 1.1653 0.3976 1.3996 1.2407 1.2565
1-O-Caffeoyl-4-O-galloyl-β-D-glucose 1.0533 1.3258 0.6128 1.6015 0.6038 0.8027
1-O-Caffeoyl-6-O-galloyl-β-D-glucose 0.9677 1.1501 0.8287 0.7015 0.9836 1.3683
1-O-Caffeoyl-(6-O-glucosyl)-β-D-glucose 2.3650 0.3094 1.8410 0.2297 0.9426 0.3123
1-O-Caffeoyl Galactonic Acid 0.6489 1.1617 1.1380 1.2156 0.8355 1.0003
1-O-Caffeoyl-β-D-glucose 0.8727 0.3324 0.5260 0.3177 2.0780 1.8732
1-O-Caffeoyl-β-D-xylose 1.0125 0.8024 1.2840 0.7266 1.0845 1.0901
1-Octadecanol 1.0470 0.9971 1.0054 1.0287 1.0470 0.8747
1-O-Feruloyl-3-O-caffeoylglycerol 1.1571 1.2828 0.9865 0.5946 1.0770 0.9020
1-O-Feruloyl-β-D-glucose 1.1460 1.0082 0.7876 0.5328 1.4550 1.0703
1-O-Linoleoyl-3-(2,3,4-Trihydroxybenzophenone) 1.1523 1.5147 1.2352 0.6449 0.6745 0.7784
1-O-Linoleoyl-3-O-galactopyranosyl-L-glycerol 0.8356 0.7845 1.3238 1.3396 0.6306 1.0859
1-O-Linoleoyl-(carbon eicosapentaenoic acid) 0.9444 0.9249 1.0369 0.9844 0.7991 1.3104
1-O-p-Coumaroyl-2-O-galloyl-4,6-(S)-HHDP-β-D-glucose 1.0960 1.1257 NA 0.8265 NA 0.9519
1-O-p-Coumaroylquinic acid NA 0.2051 1.6508 1.3775 0.7418 1.0247
1-O-p-Coumaroyl-β-D-glucose* 0.4965 0.3523 0.3602 0.3905 0.8858 3.5148
1-O-Salicyloyl-β-D-glucose* 1.0990 0.4777 1.2008 0.5449 1.4884 1.1893
1-O-Sinapoyl-β-D-glucose 1.0849 1.5321 0.7733 0.7183 0.8356 1.0558
1-O-Vanilloyl-D-Glucose 0.7072 1.4412 0.6643 0.8974 0.6617 1.6281
1-Oxo-Siaresinolic acid* 1.2007 0.5780 3.4638 0.1502 0.5133 0.0940
1-Palmitoyl-Sn-Glycerol 3-O-Diglucoside 0.6937 0.9664 1.0377 1.6398 0.9403 0.7222
(1^R,3R,5R,8^S)-Dihydrophaseic acid-O-β-D-glucoside 0.8280 0.8396 1.1852 0.9817 1.0539 1.1116
1-(sn-Glycero-3-phospho)-1D-myo-inositol 1.6301 0.9944 0.8225 0.1836 1.4033 0.9660
2,19-Dihydroxy-3-oxours-12-en-28-oic acid 1.7675 0.8160 1.7233 0.1233 1.2046 0.3652
2,19-Dihydroxy-3-oxoursa-1,12-dien-28-oic acid (Fupenzic acid) 1.2149 0.7328 3.2561 0.1485 0.3857 0.2619
2-[(1R,2R)-3-oxo-2-[(Z)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-2-enyl]cyclopentyl]acetic acid 1.2549 1.1928 1.0108 0.6000 0.8099 1.1316
2-(2,3-dihydroxypropoxy)-3-(((2-(dimethylamino)ethoxy)(hydroxy)phosphoryl)oxy)propan-2-yl (E)-hexadec-9-enoate 1.2288 1.1394 0.7447 0.5050 1.0542 1.3280
2-(2,3-dihydroxypropoxy)-3-(((2-(dimethylamino)ethoxy)(hydroxy)phosphoryl)oxy)propan-2-yl (Z)-14-Octadecenoic Acid 0.5405 1.0000 0.3176 1.1303 1.1285 1.8830
2-(2,3-dihydroxypropoxy)-3-(((2-(dimethylamino)ethoxy)(hydroxy)phosphoryl)oxy)propyl (11Z,14Z)-octadeca-11,14-dienoate 0.9622 1.1140 1.1067 0.6809 1.1282 1.0079
2-(2,3-dihydroxypropoxy)-3-(((2-(dimethylamino)ethoxy)(hydroxy)phosphoryl)oxy)propyl (8E,11Z,14Z)-octadeca-8,11,14-trienoate 1.0466 1.7336 0.8901 0.6786 0.5301 1.1210
2-(2,3-dihydroxypropoxy)-3-(((2-(dimethylamino)ethoxy)(hydroxy)phosphoryl)oxy)propyl palmitate* 0.8893 0.7326 0.9863 1.0766 1.6316 0.6837
2,2-Dimethylsuccinic acid 1.1839 1.3298 0.5581 1.2442 1.0022 0.6819
2,3,19,23,24-Pentahydroxyolean-12-en-28-oic acid-28-O-glucoside 0.6650 0.8263 0.8722 0.9070 0.7417 1.9878
2,3,19,23-Tetrahydroxyolean-12-en-28-oic acid 1.4200 0.4146 1.4599 0.1299 2.2119 0.3637
2,3,19,23-Tetrahydroxyurs-12-en-28-oic acid 1.3057 0.5296 2.2235 0.5264 1.2161 0.1987
2,3,19,23-Tetrahydroxyurs-12-ene-28-oic acid (Myrianthic acid) 1.9743 0.6826 1.2471 0.1837 1.6886 0.2237
2,3,19-Trihydroxyurs-12-en-23,28-dioic acid-28-O-glucoside 0.6448 0.6829 1.0273 1.0768 1.2215 1.3468
2,3,19-trihydroxyurs-12-en-28-oic acid (Euscaphic acid)* 1.6157 0.5426 1.7511 0.2400 1.6265 0.2241
2,3,19-Trihydroxyurs-12-en-28-oic acid (Tormentic acid)* 1.7260 0.8796 1.3219 0.1562 1.4899 0.4265
2,3,23-Trihydroxyurs-12-en-28-oic acid* 1.2937 0.5940 1.4867 0.2581 2.0116 0.3560
2,3,23-Trihydroxyurs-12-en-28-oic acid (Asiatic acid) 1.8673 0.8618 1.2250 0.1486 1.4673 0.4300
2-(3,4-Dihydroxyphenethyl)-5-O-Cinnamoyl-gentiobioside 1.5740 1.2867 0.7674 0.5377 1.1294 0.7048
2-(3,4-dihydroxyphenyl)ethanediol 1-O-β-D-glucopyranoside* 0.9493 0.9219 0.6611 0.9180 1.4770 1.0727
2,3,6-Trihydroxyurs-12-en-28-oic acid (Madasiatic acid)* 1.3087 0.5940 1.5120 0.2542 1.9790 0.3522
2,3-Diacetoxy-18-hydroxyoleana-5,12-dien-28-oic acid 1.7411 0.8890 1.3041 0.5412 1.1531 0.3715
2,3-Dihydroxy-12-ursen-28-oic acid* 1.4397 0.9145 1.2637 0.2490 1.7625 0.3707
2,3-Dihydroxy-3-Methylbutanoic Acid 1.2834 0.8070 0.8348 0.6778 1.3522 1.0448
2,3-Dihydroxy-5(6),12(13)-diene-ursolic acid* 1.6418 1.6783 0.8559 0.3751 0.7353 0.7136
2,3-Dihydroxybenzoic Acid* 1.1733 0.9315 2.2925 0.4007 0.9030 0.2991
2,3-Dihydroxyolean-12-en-28-oic acid (2-Hydroxyoleanolic acid)* 1.5237 0.8422 1.0826 0.0953 1.8981 0.5580
2,3-Dihydroxyoleana-11,13(18)-dien-28-oic acid (Camaldulenic acid) 1.4999 1.5685 1.4382 0.3059 0.6009 0.5866
2,3-Dihydroxyurs-12,18-dien-28-oic acid* 1.6691 1.7521 0.7796 0.3618 0.6821 0.7554
2,3-Dihydroxyurs-12-en-28-oic acid (Corosolic acid)* 1.5329 0.8239 1.1198 0.0946 1.8575 0.5713
2,3-Dihydroxyurs-12-en-28-oic acid methyl ester (Corosolic acid methyl ester) 1.3715 1.3588 0.9121 0.1528 1.8309 0.3738
2(3H)-Benzothiazolone 1.0331 1.1777 0.9129 1.0488 0.8444 0.9832
23-Hydroxy-3-oxoolean-12-en-28-oic acid (Hederagonic acid) 0.4328 3.2324 0.3160 0.2500 1.2254 0.5434
2-(3-Hydroxy-4-methoxyphenethyl)-5-O-(2-hydroxycaffeoyl)-gentiobioside 1.2757 0.9741 1.3358 1.0895 0.6194 0.7055
23-Hydroxytoonacilide* 0.7615 1.0923 0.3724 0.7094 1.9537 1.1107
2-(3-β-D-glucopyranosyloxy-4-hydroxyphenyl)ethanol-1-O-β-D-glucopyranoside 1.3306 1.6613 0.5660 0.6698 0.7284 1.0438
24,30-Dihydroxy-12(13)-ene-lupeol* 1.4423 1.3609 0.8968 0.2503 1.5107 0.5390
2^,4^,6^-Trihydroxyacetophenone 0.6538 1.0576 0.6922 1.0406 0.8813 1.6744
2,4-Dihydroxybenzoic acid 0.6816 0.9675 1.7657 0.6534 0.9318 NA
2,4-Dinitrophenol 1.0405 1.5605 1.3164 NA 0.6312 0.4515
2,4-Di-Tert-Butylphenol 1.0652 1.0052 0.8362 1.0249 0.9468 1.1217
2,5-Dihydroxyacetophenone 0.9695 1.2780 0.8217 0.8822 0.8131 1.2355
2,5-Dihydroxybenzaldehyde 0.8933 1.1207 0.4373 1.4390 0.8800 1.2297
2,5-Dihydroxyphenylacetate ethyl triglucoside 0.5666 1.1717 0.2540 2.3765 0.3754 1.2558
2,6-Dimethoxy-4-hydroxyphenol-1-O-ß-D-glucopyranoside* 0.2772 0.4386 1.2748 2.5952 0.7633 0.6509
2,6-Dimethoxybenzaldehyde* 0.9665 1.4386 0.7894 0.8429 0.9625 1.0000
2,6-Dimethoxybenzoic acid 1.0596 1.7392 1.1245 0.4231 1.1788 0.4748
2,6-dimethoxy-hydroquinone-4-O-β-D-glucopyranoside 1.0227 1.1596 1.1790 0.6012 0.9152 1.1224
2,6-Dimethyl-7-octene-2,3,6-triol 1.0168 1.5797 0.8569 0.6539 0.9792 0.9135
2-(7-Dihydroxyl)-benzofuranyl-ferulic acid 0.4704 0.2228 2.3625 1.1448 1.0492 0.7503
2-Acetyl-3-hydroxyphenyl-1-O-glucoside 1.0598 1.9662 0.9498 0.9134 0.3973 0.7134
2^-Acetylacteoside 1.0941 1.1215 1.1131 0.5417 1.4017 0.7278
2-Aminoethanesulfonic acid 1.0381 0.8403 1.7491 1.0918 0.6331 0.6475
2-Benzylsuccinic Acid 1.0680 0.9635 1.1567 0.9905 0.7973 1.0239
2-Carboxy-3-hydroxy-A(1)-norlupan-20(29)-en-28-oic acid (Ceanothic acid) 1.5984 0.7565 1.8884 0.1141 1.2681 0.3744
2-Decanol* 0.9525 0.9884 0.8875 1.1174 0.9981 1.0563
2-Dehydro-3-deoxy-L-arabinonate 1.1150 0.7260 1.6746 0.8812 0.8369 0.7663
2-Deoxyribose-1-phosphate* 0.7824 0.4761 2.9801 0.9623 0.4060 0.3931
2-Deoxyribose-5^-phosphate* 0.7738 0.7579 1.4752 NA 0.7122 1.2809
2-Dodecenedioic acid 0.9313 0.7217 1.4046 0.9257 0.9038 1.1129
(2E)-3-[4-(β-D-glucopyranoside)-phenylacrylic]-acid NA 0.8917 0.6817 0.6149 1.5445 1.2672
(2E,4E)-11-hydroxy-10-(hydroxymethyl)undeca-2,4-dien-1-yl hydrogen sulfate 1.0672 0.7819 1.1938 1.0409 0.9259 0.9903
2-Formyl-3-hydroxy-A(1)-norlup-20(29)-en-28-oic acid (Colubrinic acid) 1.6550 0.4507 2.6088 0.3319 0.5549 0.3987
2-(Formylamino)benzoic acid 1.0441 1.0291 0.5623 0.9734 1.1298 1.2614
2-Glucosyloxy-2-phenylacetic acid amide 0.6327 1.2146 1.3813 1.5389 0.6914 0.5411
2-Hydroxy-2-methyl-3-oxobutanoic acid 0.8441 0.9216 0.9551 1.1338 1.1264 1.0189
2-Hydroxy-3-phenylpropanoic acid 0.6099 0.6958 0.7696 0.5367 2.2475 1.1404
2-Hydroxy-4-methyl-3-undecanoyloxypentanoic acid methyl ester 0.5414 1.1617 0.9436 0.9522 1.3853 1.0158
2-Hydroxy-4-methylpentanoic acid 0.8723 0.8860 0.6528 0.1656 1.7704 1.6529
2-Hydroxy-5-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxybenzoic Acid 1.4370 0.8657 1.4592 0.5616 0.9819 0.6947
2-Hydroxybenzaldehyde (Salicylaldehyde) NA 1.1857 1.0909 0.8462 NA 0.8772
2-Hydroxycinnamic acid* 0.9399 0.5853 1.2989 1.2110 1.1201 0.8448
2-Hydroxyethylphosphonic acid 0.9556 0.8339 1.3840 0.7573 1.4051 0.6641
2-Hydroxyhexadecanoic acid 0.5307 0.4403 0.7966 3.4415 0.4952 0.2957
2-Hydroxyisocaproic acid 1.1626 1.1143 0.9991 0.7570 0.9070 1.0600
2-Hydroxyphenol-1-O-glucosyl(6→1)rhamnoside 0.9084 0.7986 1.5944 0.5682 1.5232 0.6072
2-Hydroxyphenylacetic acid 0.4552 0.6254 3.4464 0.3684 0.7953 0.3094
2-Hydroxyursolic acid* 1.5345 0.8109 1.1614 0.0995 1.8207 0.5730
2-Isopropylmalic Acid 1.2706 0.9146 1.3375 0.4523 1.2077 0.8173
2-Methyl-3-oxoadipic acid* 1.0701 1.2570 0.7991 1.5812 0.5850 0.7076
2-Methyl-3-oxosuccinic acid 1.0232 0.8088 1.1889 1.0997 1.0699 0.8095
2-Methyl-4-pentenoic Acid 0.7981 0.9870 0.8154 1.0505 1.0260 1.3229
2-Methylene-3-(6-hydroxyhexyl)-butanedioic acid 0.7085 0.3644 2.2924 1.5443 0.6539 0.4366
2-Methylglutaric acid 0.7908 1.0250 NA 1.2422 0.9722 0.9698
2-Methylsuccinic acid 0.9884 0.9678 1.0016 0.8541 1.0407 1.1474
2-Nitrophenol 0.9253 1.2388 0.8014 1.1134 0.9635 0.9574
2-O-(3,4-dihydroxyphenylacetyl)-6-O-caffeoylglucoside 1.0186 0.9671 NA 0.6027 0.9020 1.5095
2-O-Caffeoylglucaric Acid 0.8971 0.6707 1.0094 1.1486 1.2165 1.0576
2-O-Feruloylglucaric Acid 2.0165 0.2909 2.1026 0.1383 1.1516 0.3001
2-O-Galloyl-D-glucose 1.5083 1.3990 0.4138 0.4542 0.9226 1.3021
2-O-Galloylmucic acid Dimethyl Ester 1.1920 0.9923 0.7930 0.9597 0.9650 1.0980
2-Oxoheptanedionic acid* 1.0701 1.2570 0.7991 1.5812 0.5850 0.7076
2-O-α-D-Glucopyranosyl-L-ascorbic acid 0.9742 1.0121 0.8226 0.4662 1.1422 1.5827
2-Palmitoyl-Sn-Glycerol 3-O-Diglucoside 0.5148 0.5256 1.7834 0.7314 1.7280 0.7167
2-Phenylethyl beta-primeveroside 0.8869 0.8198 0.9704 1.7049 0.7367 0.8812
2-Phosphoglycolate 0.9859 0.7033 1.0446 0.9614 0.8916 1.4133
2-Picolinic acid 1.2174 1.0305 1.2996 1.0760 0.5764 0.8000
2-Propylglutaric acid 0.9420 0.7652 0.7782 0.6240 1.5053 1.3852
2-Propylmalic Acid 1.2806 0.8343 1.4006 0.4884 1.1650 0.8310
2-Propylsuccinic acid* 0.7735 NA NA 1.2265 NA NA
(2^^R)-2^^-Hydroxyoleuropein 0.4454 0.6265 1.8834 2.4060 0.4140 0.2248
((2R,3R,5R,6R)-6-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl (Z)-3-(3,4-dihydroxyphenyl)acrylate 0.7336 1.5020 0.6663 1.1058 1.0468 0.9455
(2r,3s,4s,5r)-2,5-bis(hydroxymethyl)-2-methoxyoxolane-3,4-diol* 1.6402 1.5146 1.0231 0.4088 0.7107 0.7026
2R-hydroxy-9Z,12Z,15Z-octadecatrienoic acid 0.7767 1.2831 0.6811 0.7920 1.1259 1.3412
(2^^S)-2^^-Methoxyoleuropein 0.7115 0.6109 2.3951 1.2765 0.1636 0.8424
(2S,3R,4S,6S)-2-[4-[(1R,2R)-1,3-Dihydroxy-2-[4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenoxy]propyl]-2,6-dimethoxyphenoxy]-6-(hydroxymethyl)oxane-3,4-diol* 0.4896 1.6672 0.6140 1.1273 0.6035 1.4984
2α,3α,23-Trihydroxyurs-12,20(30)-dien-28-oic acid* 1.2278 0.5578 3.4182 0.1555 0.5436 0.0971
2α,3α-Dihydroxyolean-12-en-28-oic acid 1.3557 1.8151 0.8042 1.2413 0.4594 0.3243
2-β-D-Glucopyranosyloxy-5-hydroxy-phenylacetic acid 0.7767 1.0223 0.8583 1.1968 1.1388 1.0072
3,13,15-Trihydroxyoleanane-12-one 1.1236 2.1776 0.4813 0.5772 0.7430 0.8973
3,19,23-Trihydroxyurs-12-en-28-oic acid (Rutundic acid) 1.5103 0.7795 1.5833 0.1023 1.7927 0.2319
3,19-Dihydroxyurs-12-en-28-oic acid (Pomolic acid)* 1.4173 0.9700 1.3339 0.2441 1.6629 0.3718
3-[(1-Carboxyvinyl)oxy]benzoic acid 0.5461 0.4767 3.4423 0.8258 0.4138 0.2952
3,23-Dihydroxy-30-noroleana-12,20(29)-dien-28-oic acid (30-Norhederagenin) 1.4498 2.0461 0.6381 0.4191 0.8146 0.6323
3,23-Dihydroxylup-20(29)-en-28-oic acid (23-Hydroxybetulinic acid) 2.2398 0.7438 1.0139 0.0862 1.5762 0.3402
3(2^-Chlorophenyl)-7-hydroxy-4-phenylcoumarin 0.9331 1.7357 1.6973 0.3184 0.6081 0.7073
3-(3-Hydroxyphenyl)-3-hydroxypropanoic acid 1.2549 0.9625 1.3380 1.0733 0.6407 0.7306
3,4,2^,4^,6^-Pentahydroxychalcone-4^-O-glucoside 1.0494 1.2579 0.5983 0.9342 0.9197 1.2405
3,4-Digalloylshikimic acid 1.0264 1.2000 0.7427 0.7177 1.3626 0.9506
3,4-Dihydrocoumarin 0.8116 0.9292 0.8003 1.2494 1.0509 1.1586
3,4^-Dihydroxy-3^-methoxybenzenepentanoic acid 0.7624 1.0790 1.2698 0.8847 1.1722 0.8320
3,4-dihydroxy-allylbenzene4-O-p-D-xylopyranosyI-(1-→6)-β-D-glucopyranoside* 0.9419 1.2340 1.2345 1.3291 0.4608 0.7998
3,4-dihydroxyallyl benzene-4-O-[α-L-rhamnosyl-(1→6)]-β-D-glucopyranoside 2.5038 1.2913 0.2379 0.1473 1.2943 0.5254
3,4-dihydroxyallyl benzene-xylose-glucoside 1.0093 1.3120 0.6258 1.0352 0.7646 1.2532
3,4-Dihydroxybenzeneacetic acid* 1.1987 1.0533 1.7631 0.9703 0.5188 0.4958
3,4-Dihydroxybenzoic Acid Ethyl Ester (Protocatechuic acid ethyl ester) 1.1120 1.5633 1.1876 0.4303 1.2192 0.4875
3,4-Dihydroxybenzoic acid (Protocatechuic acid)* 0.6651 0.5806 3.5236 0.6154 0.4174 0.1979
3,4-Dihydroxyphenethyl alcohol-8-O-[β-D-apinosyl(1→3)]-β-D-glucoside 0.9839 1.1676 0.5676 0.7720 1.1239 1.3851
3,4-dihydroxyphenylethanol-β-D-glucopyranoside* 0.6233 0.6341 0.3165 0.6911 1.3519 2.3831
3,4-dihydroxy-β-phenylethoxy-O-α-L-rhamnopyranosyl(1→3)-6-O-caffeoyl(cis)-β-D-glucopyranoside 1.1972 0.8862 0.8968 0.9388 0.9626 1.1184
3,4-dimethoxy-2-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]xanthen-9-one 1.0975 1.3144 1.0045 0.4739 1.0340 1.0756
3,4-Dimethoxycinnamic acid 0.8678 0.6188 1.8183 0.7335 1.6503 0.3114
3-(4-Hydroxyphenyl)-propionic acid* 1.0429 1.4336 0.5518 0.6724 1.0179 1.2813
3,5-Digalloylshikimic acid 0.3807 0.4493 1.2118 2.4370 0.8934 0.6278
3,5-Dihydroxyacetophenone 1.0012 1.0264 0.9780 0.8943 1.2858 0.8142
3,5-dimethoxy-4-((3,4,5-trihydroxy-6-((sulfooxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)benzoic acid 0.3448 0.2482 3.1594 1.9850 0.1176 0.1449
3,6-Di-O-caffeoyl glucose 0.9240 1.2849 0.5091 0.8242 1.1571 1.3006
3,6^-Disinapoylsucrose 1.5087 1.3921 0.1836 0.1369 1.1000 1.6786
3,9-dihydroeucomnalin glucoside* 1.5100 1.3110 0.8584 0.5743 0.8150 0.9312
3,9-Dihydroxy-13(14)-labden-16,15-olide 1.4666 1.1273 0.6976 0.4482 1.1748 1.0854
3^-Adenylic Acid 1.8954 1.2944 0.8042 1.2682 0.4024 0.3354
3-Amino-1-propionic sulfonic acid 1.3358 0.8754 1.1696 0.5011 0.7949 1.3234
3-(Beta-D-Glucopyranosyloxy)-5-Hydroxyhexanoic Acid Methyl Ester 0.8911 0.7869 1.1965 1.1878 0.9648 0.9729
3-Dehydro-L-Threonic Acid* 1.1424 0.9988 0.7921 0.6883 1.2860 1.0924
3-Dehydroshikimic acid 1.4274 1.2930 1.0691 0.6042 0.8584 0.7479
3^-Fucosyllactose 0.8664 1.0395 0.2997 1.6040 0.9447 1.2458
3-Furoic acid 0.3968 1.3109 3.3005 0.3256 0.3431 0.3232
3-Hydroxy-11-oxoolean-12-en-30-oic acid (18α-Glycyrrhetinic acid) 1.3750 0.6590 2.7792 0.4964 0.3753 0.3150
3-Hydroxy-1-(4^-hydroxy-3^-methoxyphenyl)-propan-1-one 0.7659 0.8187 0.8274 1.1260 1.1597 1.3023
3-Hydroxy-3-methylpentane-1,5-dioic acid 1.8251 0.5706 0.5612 0.1910 2.1777 0.6744
3-Hydroxy-4-isopropylbenzylalcohol-3-O-glucoside 0.7815 1.1907 0.6682 1.4504 0.7174 1.1917
3-Hydroxy-4-isopropylbenzylalcohol-3-O-sophoroside 0.8718 1.2763 0.4011 1.0647 0.8008 1.5853
3-hydroxy-5-methoxybenzaldehyde 0.8398 0.9064 1.0339 1.1661 1.0234 1.0304
3-Hydroxy-5-Methylphenol-1-O-Glucoside 1.0177 0.4870 1.8305 0.3376 1.9636 0.3636
3-Hydroxybutyric acid 1.0486 1.2609 0.8202 0.8837 1.1059 0.8808
3-Hydroxycinnamic Acid* 0.9399 0.5853 1.2989 1.2110 1.1201 0.8448
3-Hydroxycycloarta-24-ene-26-oic acid (Isomangiferolic acid)* 1.5001 2.3968 0.3830 0.4036 0.6276 0.6888
3-Hydroxyglutaric acid* 1.5323 0.6631 1.2861 1.0565 0.7060 0.7561
3-Hydroxylup-20(29)-en-28-oic acid (Betulinic acid)* 1.3324 1.2837 0.9394 0.2744 1.6445 0.5255
3-Hydroxymandelate 1.0569 1.0787 1.7589 1.2034 0.5245 0.3776
3-Hydroxyoctadecanoic Acid 0.8815 0.9854 0.9500 0.9424 1.1251 1.1156
3-hydroxyphenylacetic acid 1.0370 1.1139 0.9342 0.5972 1.2703 1.0474
3-Hydroxyphloretin-4^-O-[4^^,6^^-O-(S)-HHDP]-β-D-glucoside 1.0027 1.0580 0.6834 1.6722 0.7565 0.8273
3-Hydroxyurs-12-en-28-oic acid (Ursolic acid)* 1.4742 2.4269 0.3716 0.4245 0.6198 0.6830
3-methoxy-4-[3,4,5-trihydroxy-6-(sulfooxymethyl)oxan-2-yl]oxybenzoic acid* 0.6906 0.6231 2.2731 2.0215 0.1626 0.2292
3-methoxy-4-((3,4,5-trihydroxy-6-((sulfooxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)benzoic acid* 0.6286 0.6225 2.4219 1.9319 0.1734 0.2217
3-Methylbenzaldehyde* 0.9779 0.6329 0.7632 1.0549 1.7901 0.7810
3-Methylbutyl 6-O-(alpha-L-arabinopyranosyl)-beta-D-glucopyranoside 0.5928 1.1148 0.9821 2.3037 0.3884 0.6183
3-Methyluridine 1.2801 1.4586 0.4627 1.0139 0.7521 1.0327
3-O-(3,5-Dimethoxy-4-hydroxybenzoyl)-4-O-caffeoylquinic acid 1.1541 1.3398 1.1854 1.2343 0.4374 0.6490
3-O-(3-Methoxy-4-hydroxybenzoyl)-4-O-caffeoylquinic acid 0.9639 0.8443 0.5652 1.2057 1.0221 1.3989
3^-O-Beta-D-Glucopyranosyl plumbagic acid 1.7733 0.4111 0.9458 0.1852 2.1826 0.5019
3-O-Digalloyl quinic acid 0.7437 0.9236 0.8657 1.0497 1.0393 1.3780
3^-O-Feruloyl Swertiamarin 0.9922 0.6531 0.7987 1.4930 0.9006 1.1623
3-O-Galloyl-D-glucose* 0.8960 1.1559 0.3829 0.7739 1.2567 1.5346
3-O-Methylgallic Acid 0.6898 0.5767 3.2900 0.5525 0.3514 0.5397
3-O-p-Coumaroylquinic acid 2.0299 2.3754 0.6096 0.2693 0.6321 0.0836
3-O-p-Coumaroylshikimic acid 0.8104 1.3052 0.6247 0.7776 1.2971 1.1850
3-O-p-Coumaroylshikimic acid-O-glucoside 1.1693 1.1478 0.3882 1.0271 0.9280 1.3396
3-O-Rhamnosyl(1→2)glucosyl-2,3,6-trihydroxy-23-oxoolean-12-en-28-oic acid-28-O-glucosyl ester 0.7806 0.9452 0.6847 0.9194 1.2406 1.4293
3-Oxo-19-hydroxyurs-12-en-28-oic acid (Pomonic acid) 1.3034 0.8984 3.4427 0.0453 0.2489 0.0613
3-Oxo-9,19-cyclolanost-24-en-26-oic acid (Mangiferonic acid)* 0.9276 1.8343 0.7314 0.2651 1.3902 0.8515
3-Oxolup-20(29)-en-28-oic acid (Betulonic acid)* 1.0532 1.0314 2.0320 0.6330 0.7147 0.5357
3-Oxopentanedioic acid 1.0107 0.8246 0.9513 0.8992 1.1238 1.1904
3-Oxours-12-en-28-oic acid (Ursonic acid)* 0.9512 0.8294 0.9772 1.2448 1.2863 0.7111
3-Phospho-D-glyceric acid 1.1339 0.7055 0.9410 0.5078 1.6875 1.0242
((3R,4R,5R)-3,4-dihydroxy-5-(((2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenethoxy)tetrahydro-2H-pyran-2-yl)methoxy)tetrahydrofuran-3-yl)methyl(E)-3-(4-hydroxyphenyl)acrylate* 1.4989 2.0227 0.8692 0.2291 1.1928 0.1872
3-Ureidopropionic Acid 0.7081 1.7400 2.4651 0.2793 0.5157 0.2918
3β,6β,19α,24-Tetrahydroxyurs-12-en-28-oic acid 1.4601 0.4035 2.6419 0.1563 1.1766 0.1617
4,11,17-Trihydroxy-5,7,9,13,15,19-docosahexaenoic acid 0.6756 1.2493 1.2225 2.0596 0.4117 0.3814
4-(3,4,5-Trihydroxybenzoxy)benzoic acid 0.9606 1.1247 1.5065 0.8811 0.7824 0.7446
4-[3-(4,8-dimethylnona-3,7-dienyl)-3-methyloxiran-2-yl]butan-2-one* 1.3418 1.3620 0.7084 0.6048 0.8895 1.0935
4,5,8-Trihydroxy-α-tetralone 0.9883 1.2155 1.2693 0.8293 0.9575 0.7401
4,5,8-Trihydroxy-α-tetralone-5-O-glucoside 1.3688 1.2760 0.5611 1.0947 1.0911 0.6082
4,6-Dimethoxy-5-methyl-2H-Pyran-2-one 0.7608 0.9071 0.6422 0.8865 1.2422 1.5612
4-[6-O-(4-Hydroxy-3,5-dimethoxybenzoyl)-β-D-glucopyranosyloxy]-ferulic acid 0.8851 1.1769 0.7876 1.0665 0.9036 1.1803
4^,8^^-Bisguaiacylglycerol* 0.6147 0.6203 0.8085 1.3766 1.3375 1.2424
4,8-Dihydroxyquinoline-2-carboxylic acid 1.6820 0.8681 0.9713 0.5349 1.2720 0.6717
4,9-Dihydroxy-17-methoxy-2-oxatricyclo[13.2.2.13,7]icoSa-1(17),3,5,7(20),15,18-hexaen-10-one 0.6733 0.5731 1.6438 0.5439 2.1369 0.4290
4-Allylcatechol 0.8851 1.8499 1.4543 0.7487 0.7860 0.2760
4-Aminosalicylic acid 1.1884 0.9405 1.1846 0.7524 1.0591 0.8751
4-Dihydroxyphenethoxy-8-O-β-D-[6-O-(4-O-β-D-glucopyranosyl)-feruloyl]glucopyranoside 0.8553 1.0562 1.8700 1.6698 0.2074 0.3413
4-Hydroxy-2-oxoglutaric acid 0.6484 0.1836 3.0185 0.1117 1.8571 0.1806
4-Hydroxy-3,5-dimethoxybenzyl alcohol 0.9076 1.0883 0.5553 0.8934 1.0002 1.5551
4^-Hydroxy-3^-methoxyacetophenone (Acetovanillone) 1.1534 1.5037 1.1715 0.7586 0.9231 0.4896
4-Hydroxy-3-methoxymandelate 1.1273 0.9803 1.7428 0.7969 0.8003 0.5525
4-hydroxy-4-(2-hydroxyphenyl)butanoic acid 0.8732 0.8141 0.7400 1.1105 1.1536 1.3086
4-Hydroxyacetophenone 0.7922 1.1535 1.0659 1.4161 0.7413 0.8310
4-Hydroxybenzaldehyde 0.7506 0.8675 1.6648 1.4962 0.5749 0.6461
4-Hydroxybenzoic acid 0.8764 0.9252 1.6217 1.2002 0.7729 0.6037
4-Hydroxybenzoic acid 4-(6-O-sulfo)glucopyranoside 0.3839 0.4322 2.4983 2.3786 0.1319 0.1751
4-Hydroxybenzoyltartaric acid 1.0236 0.4708 1.3550 0.3166 2.3929 0.4411
4-Hydroxycoumarin di-glucoside 0.8681 1.0546 0.8246 1.1689 0.8415 1.2423
4-Hydroxy-L-glutamic acid 0.5990 0.7638 1.3769 1.7176 0.6741 0.8687
4-Hydroxyphenethoxy-8-O-β-D-[6-O-(4-O-β-D-glucopyranosyl)-sinapoyl]glucopyranoside 1.7002 1.2450 0.5783 0.6158 0.9339 0.9268
4-Hydroxyphenyl 6-O-(2-Methyl-3-Hydroxypropionyl)-Beta-D-Galactopyranoside 1.0741 1.1548 0.6785 0.9656 0.9474 1.1796
4-Hydroxyphenyllactic Acid* 0.9697 1.1035 1.1335 1.0187 1.1063 0.6683
4^-Hydroxypropiophenone 0.4382 0.7945 1.7594 1.9158 0.5112 0.5809
4-Hydroxyquinoline NA 1.0406 NA 1.5560 NA 0.4035
4-Methoxyphenylpropionic acid 0.7637 0.9508 0.4317 0.9629 1.4821 1.4088
4-Methylbenzaldehyde* 0.7880 0.8197 1.1569 1.3567 1.2080 0.6707
4-Methylcatechol 1.1648 0.9280 0.4908 0.8383 1.0396 1.5384
4-O-(6^-O-Glucosyl-4^^-hydroxybenzoyl)-4-hydroxybenzyl alcohol 0.9256 0.8528 1.0448 1.1458 0.8900 1.1411
4-O-(6^-O-Glucosylcaffeoyl)-3,4-dihydroxybenzoic acid 1.5008 0.7837 0.6295 0.3956 1.3989 1.2915
4-O-(6^-O-Glucosylcaffeoyl)-3,4-dihydroxybenzyl alcohol 0.8570 0.5713 1.6530 0.4976 1.5357 0.8855
4-O-(6^-O-Glucosylcaffeoyl)-4-hydroxybenzoic acid 1.1464 0.4959 0.3317 0.1511 2.9664 0.9085
4-O-(6^-O-Glucosylcaffeoyl)-4-hydroxybenzyl alcohol 0.7757 0.6469 1.0364 1.7312 0.8747 0.9351
4-O-galactopyranosylxylose 1.0910 1.0856 1.2168 0.6574 0.9803 0.9689
4-O-Glucosyl-3,4-dihydroxybenzyl alcohol 0.6203 0.6572 0.8306 1.3201 1.4290 1.1429
4-O-Glucosyl-4-hydroxybenzoic acid* 1.3792 1.1632 0.8692 0.5535 1.2832 0.7517
4-O-Glucosyl-sinapate 1.1737 NA 0.7120 NA 1.1143 NA
4-p-Cumaroyl-rhamnosyl-(1→6)-D-glucose 1.1239 1.2585 0.3942 0.7158 1.2360 1.2716
4-tert-Octylphenol 0.9728 1.0078 1.0164 1.0515 0.8703 1.0812
(4β,10E)-6α,15-Dihydroxy-8β-(angeloyloxy)-14-oxogermacra-1(10),11(13)-diene-12-oic acid-12,6-lactone 0.6358 0.7136 1.7335 1.4674 0.9982 0.4515
4^-β-D-Fructofuranosylswertiamarin 0.6408 0.6363 0.9509 2.5098 0.6116 0.6505
5-(2-Hydroxyethyl)-2-O-glucosylphenol* 0.4999 0.3641 1.9980 2.5833 0.2799 0.2749
5-{[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-2-(hydroxymethyl)oxane-2,3,4-triol 0.8310 1.3516 0.4030 1.2035 0.6835 1.5273
5,6,7,5^-tetramethoxy-3^,4^-methylenedioxyflavonoid 2.1174 0.3032 2.0533 0.1260 1.0939 0.3063
5,7,5^-Trimethoxy-3^,4^-methylenedioxyflavonoid 1.8927 0.1940 2.8807 0.0406 0.8532 0.1388
5,7-Dihydroxy-1(3H)-isobenzofuranone 0.8241 0.8353 0.8047 1.0841 1.2372 1.2147
5,8,11-Eicosatriynoic Acid 0.1007 0.2869 3.8101 1.0603 0.4126 0.3294
5-Acetamidopentanoic Acid 1.4651 1.3915 0.9211 0.7982 0.7789 0.6452
5^-Glucosyloxyjasmanic acid* 0.3849 0.9623 0.7763 2.9865 0.4769 0.4131
5-Hydroxy-10-O-(p-methoxycinnamoyl)adoxosidic acid 0.9006 0.9861 0.4344 1.1545 NA 1.5245
5-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one 0.9349 0.8552 1.3565 1.7403 0.7935 0.3196
5-Hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptan-3-one 1.1652 0.9352 0.2325 0.3855 1.3238 1.9579
5-Hydroxy-7-(4-hydroxy-3,5-dimethoxyphenyl)-1-(4-hydroxy-3-methoxyphenyl)heptan-3-one 0.6272 0.5129 1.9659 1.7934 0.3439 0.7568
5-Hydroxymethyluracil 1.0833 1.0094 0.9400 1.0284 1.0148 0.9241
5-L-Glutamyl-L-amino acid 1.5580 1.1255 1.1922 0.6117 0.8734 0.6392
5^-Methoxyisolariciresinol-9^-O-glucoside 1.2170 1.1822 0.4184 0.6479 1.1306 1.4038
5^-Methoxyisolariciresinol-9^-O-xyloside 0.6425 1.1580 0.7606 1.0567 1.1144 1.2678
5^-Methoxymatairesinoside* 0.4976 0.5692 1.2734 2.6758 0.4638 0.5202
5-O-Caffeoylshikimic acid 1.4426 0.9817 0.7750 0.3286 NA 1.4720
5-O-Galloyl-D-hamamelose* 1.2076 1.0257 0.7321 0.7401 1.1161 1.1783
5-O-Galloyl-methyl quinine ester 0.6379 0.9409 1.3452 0.7825 1.1480 1.1456
5-O-p-Coumaroylquinic acid NA NA 0.8120 1.4903 NA 0.6978
5-O-p-Coumaroylquinic acid O-glucoside 0.9528 0.6913 0.8812 1.2685 1.1740 1.0323
5-O-p-Coumaroylshikimic acid O-glucoside 1.1614 1.0595 1.1942 0.7933 1.1101 0.6815
5-Oxo-L-Proline 1.0686 1.2044 0.4077 1.1404 0.7618 1.4172
(5Z,10E,14S)-14-hydroxy-2,6,10-trimethylpentadeca-5,10-dien-4-one 1.1281 1.1284 0.8300 0.7833 0.8807 1.2494
[6-[3-(3,4-dimethoxybenzoyl)oxy-2-methylpropanoyl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxy-3-methoxybenzoate 1.5597 1.6923 0.5756 0.3177 1.2963 0.5584
6-C-Glucosyl-2-Hydroxynaringenin 1.0378 1.4939 0.1808 0.5939 1.4992 1.1944
6^-cis-Cinnamoyl-8-epikingisidic acid 2.0758 0.8362 0.4606 0.1333 2.0957 0.3984
6^-Crotonyl sucrose 0.9360 0.7509 0.9819 0.1731 2.2020 0.9561
6-DeoxyCatalpol 1.0614 1.4541 0.5896 0.8133 0.9207 1.1608
6-Galloyl Ascorbic acid 0.8893 0.8489 1.2485 1.9427 0.6942 0.3762
6-Galloylglucosyl Aascorbic acid 0.9918 0.4217 1.9316 0.2187 2.1722 0.2641
6-Geranylnaringenin; Mimulone; Bonannione A 1.5364 0.7529 1.3915 0.4068 1.2230 0.6893
6-Hydroxy-4-methylcoumarin 1.1627 1.1899 0.8618 0.8040 1.2386 0.7430
6-Hydroxyhexanoic acid 0.9983 0.8566 1.5776 0.7131 1.2865 0.5679
6-Hydroxyluteolin 0.9765 0.9535 0.5556 1.0236 1.2823 1.2085
6-Hydroxyluteolin 5-glucoside* 1.0049 1.3629 0.2010 0.4133 1.1224 1.8955
6-Hydroxyphomodiol 0.8891 0.8308 1.5299 1.0249 0.8593 0.8661
6-O-Acetylarbutin 0.8247 1.2118 1.7613 1.3439 0.3404 0.5179
6-O-alpha-L-arabinopyranosyl-D-glucopyranose 0.9464 1.0182 1.5827 0.7329 0.9866 0.7332
6-O-Caffeoylarbutin 0.9134 0.7798 1.7334 0.5681 0.9295 1.0758
6-O-Caffeoyl-D-glucose 1.4048 0.8682 0.6579 0.5504 1.0329 1.4858
6^-O-Feruloyl-D-sucrose 0.9951 1.0624 0.8060 1.3533 0.8576 0.9256
6-O-Feruloyl-β-D-glucose 1.1778 1.1209 0.8956 0.9634 0.6448 1.1974
6-O-Glucosyl-caffeoylbenzoic acid 0.4464 0.4505 0.9880 1.1339 2.2426 0.7386
6-O-p-Coumaroyl-β-D-glucose* 0.6916 0.4850 0.5853 0.9227 1.0195 2.2959
6^-O-Sinapoylsucrose* 1.8614 1.0412 0.4623 0.2226 0.7179 1.6946
(6R,9R)-megastigman-4-en-9-ol-3-one O-β-D-(6^-O-β-D-apiofuranosyl)glucopyranoside 1.3576 1.5431 0.5704 0.8744 0.4724 1.1820
6-(((S)-1-carboxyethyl)amino)-4-hydroxyhexanoicacid 1.3384 0.7708 0.9896 0.8264 1.1538 0.9210
(6S,7E,9R)-6,9-Dihydroxy-4,7-megastigmadin-3-one-9-O-xylosyl(1-6)glucoside 1.0403 1.0461 1.0887 0.8208 0.8470 1.1571
6^-Trans-Cinnamoyl-8-epikingisidic acid 0.9193 0.5504 2.1766 0.6311 0.7226 NA
7,4^-Dihydroxyflavone 1.4260 1.4310 0.5011 0.6285 1.0444 0.9691
7,8-Dihydro-Buddlenol B(erythro) 0.8381 1.2279 0.4923 0.8136 1.6433 0.9849
7,8-Dihydro-Buddlenol B(threo)* 0.7624 1.0295 0.3799 0.6906 1.9952 1.1423
7-Benzyloxy-5-hydroxy-3^,4^-methylenedioxyflavonoid 0.3324 0.9147 0.8763 3.0481 0.4313 0.3972
7-O-Galloyl-D-sedoheptulose 0.6931 0.6059 1.2562 1.2797 0.9421 1.2230
(7S,8R)-glehlinoside H 1.3199 0.9265 0.6212 0.7912 1.2098 1.1314
7S,8S-DiHODE; (9Z,12Z)-(7S,8S)-Dihydroxyoctadeca-9,12-dienoic acid* 1.1887 1.0539 0.9312 0.7047 0.6374 1.4842
8,11,14-Eicosatriynoic Acid 0.5439 1.8758 2.0767 0.6734 0.3551 0.4752
8,11-Heptadecadienoic acid 0.8871 0.8644 1.5126 1.1987 0.8324 0.7047
8,15-Dihydroxy-5,9,11,13-eicosatetraenoic acid 1.1039 0.9479 0.7966 1.1134 1.0163 1.0218
8,8^^-Bisguaiacylglycerol* 0.6589 0.6104 0.9122 1.2982 1.3286 1.1917
8-Epiloganin 0.8024 1.1587 0.8185 1.3315 0.9449 0.9440
8-Hydroxypinoresinol 0.8260 0.7576 0.4211 0.8557 1.0874 2.0522
8-hydroxysyringaresinol 1.0146 0.8187 1.3593 0.3463 2.0166 0.4446
8-Methoxykaempferol-7-O-rhamnoside 1.2528 0.9042 0.9294 0.5653 1.5811 0.7672
9,10,11-Trihydroxy-12-octadecenoic acid 0.4498 0.8281 1.2443 1.3909 0.9357 1.1512
9,10,13-Trihydroxy-11-Octadecenoic Acid 0.4516 0.7918 1.1187 1.4725 0.9276 1.2377
9,10-Dihydroxy-12,13-epoxyoctadecanoic acid 0.8029 1.5348 1.1832 0.6138 1.0313 0.8339
9(10)-EpOME;(9R,10S)-(12Z)-9,10-Epoxyoctadecenoic acid 0.7046 1.4992 0.7701 0.4696 1.3865 1.1700
9,12,13-Trihydroxy-10,15-octadecadienoic acid 0.6707 0.9903 1.2629 1.3501 0.7546 0.9714
9,12-Octadecadienoic acid,ethyl ester* 1.0458 1.0559 1.0099 0.9380 0.9947 0.9556
9,16-Dihydroxypalmitic acid 0.9431 1.2728 0.8790 1.5348 0.7578 0.6125
9-(Arabinosyl)hypoxanthine 0.6282 1.0456 1.1924 1.7897 0.4808 0.8633
9-Hydroperoxy-10E,12,15Z-octadecatrienoic acid 1.0788 1.7954 0.9225 0.6767 0.7373 0.7893
9-Hydroperoxy-9Z,11E-Octadecadienoic Acid 1.1761 1.0847 0.9234 0.7616 0.6517 1.4024
9-Hydroxy-10,12,15-octadecatrienoic acid* 0.9943 1.8238 0.8076 0.8027 0.6332 0.9384
9-Hydroxy-12-oxo-10(E),15(Z)-octadecadienoic acid 0.9880 1.0888 1.0776 0.8744 0.9747 0.9964
9-Hydroxy-12-oxo-15(Z)-octadecenoic acid 0.9333 1.8739 0.5693 0.4882 1.2929 0.8423
9-Hydroxy-13-oxo-10-octadecenoic Acid 0.6324 1.2136 0.9848 0.8882 1.3751 0.9060
9-Hydroxyoctadeca-6,10,12,15-Tetraenoic Acid 0.8505 1.9740 0.9473 1.3293 0.5537 0.3452
9-hydroxysesamin 0.6796 0.8740 1.2234 1.2244 1.1134 0.8852
9-Oxo-10E,12Z-octadecadienoic acid* 0.8846 1.6438 0.8020 0.5924 0.9890 1.0883
9-Oxononanoic acid 0.9631 1.1520 1.0624 0.8002 1.0241 0.9982
9S-Hydroperoxy-10E,12Z-octadecadienoic acid 0.7471 1.3447 0.8880 0.9354 0.8981 1.1866
9S-Hydroxy-10E,12Z-octadecadienoic acid* 0.5867 1.8913 0.6118 0.3980 1.3002 1.2120
Abietic acid 1.0020 1.0012 0.8487 0.7962 1.0317 1.3203
Abscisic acid 1.2746 1.4298 0.6427 1.2109 0.9400 0.5019
Abu-Ala-OH 1.0602 1.3449 1.0111 0.8040 0.9636 0.8161
Acetaminophen 1.0062 0.8265 0.5164 0.8872 1.1577 1.6059
Adenosine 5^-diphosphate 1.1185 0.9827 1.0519 0.8101 0.9232 1.1137
Aeschynanthoside C 0.5935 0.5421 1.2300 1.3069 0.8500 1.4775
alaschanioside C NA NA 0.5941 1.4059 NA NA
Ala-TyrMe-OH 0.5131 0.4558 0.9278 0.5425 1.5257 2.0351
Allitol 1.1226 1.4760 0.3507 0.8932 0.7202 1.4373
Aloesone-7-O-β-D-glucoside 0.3337 0.3897 4.1052 0.3895 0.4812 0.3007
alpha-Hydroxylinoleic acid* 0.5924 1.8775 0.6110 0.4065 1.3138 1.1989
Aminomalonic acid 0.9869 1.0555 1.0066 1.0180 1.1219 0.8112
Androsin 0.9414 1.0550 0.8009 0.8544 0.9635 1.3848
Anthranilate-1-O-Sophoroside 1.4962 1.0164 0.7355 1.2627 0.5588 0.9305
Apigenin-4^-O-rhamnoside 1.0934 0.8666 1.3143 0.7645 1.0429 0.9182
Apiosylrhododendrin 0.7460 0.9375 0.5778 0.4522 1.4040 1.8824
Arbutin 0.2196 0.2571 1.1034 3.1534 0.6016 0.6648
Argininosuccinic acid 0.9894 1.0659 1.4211 0.9359 0.8018 0.7858
Aromadendrin-7-O-glucoside* 1.0740 1.2170 0.4684 1.1424 0.8637 1.2345
Aspergillusene A 1.0418 1.0046 0.9806 1.0019 0.8931 1.0781
Azelaic acid 1.1354 1.5535 0.8211 0.6314 0.9469 0.9116
Benzoylferuloyltartaric acid 0.8386 0.9166 1.0870 0.5265 1.5744 1.0568
Benzoyltartaric acid NA 1.0305 NA 0.9695 NA NA
Benzyl-(2^^-O-glucosyl)glucoside* 1.1518 0.9177 0.7571 0.9039 1.0997 1.1697
Benzyl-(2^^-O-xylosyl)glucoside* 1.1459 1.2079 0.6632 0.9857 1.0015 0.9959
Benzyl alcohol dixylosyl glucoside 1.2802 1.5248 0.0821 0.0575 0.7508 2.3046
Benzyl alcohol rhamnosyl glucosyl glucoside 0.8978 1.3660 0.7061 0.9459 1.1139 0.9703
Benzyl B-Primeveroside* 1.3281 1.1196 0.7068 0.8505 1.0595 0.9354
Benzyl glucoside 2.2096 1.1117 0.5828 0.2516 1.5996 0.2447
Benzyl-β-gentiobioside* 1.1174 1.0307 0.9654 0.7681 0.8067 1.3117
Benzyl β-primeveroside 1.0973 1.2895 0.8019 0.6719 0.9285 1.2109
Betonyoside E 0.4729 1.0639 0.6044 0.7457 0.8218 2.2913
Bletilols B 0.8615 0.9429 0.5897 0.9716 1.4763 1.1578
Buddlenol B 0.8982 0.9536 0.7751 1.0104 1.0955 1.2672
Buddlenol C* 0.9245 1.1372 0.9847 1.1692 1.1457 0.6387
Buddlenol E 0.7182 1.0710 0.5971 1.7041 1.2513 0.6583
Buddlenol F* 0.9508 1.2596 1.0038 0.9505 1.3256 0.5097
Buddlenol F glucoside 1.2690 1.2090 0.5105 0.7135 1.0720 1.2260
Butin-7-O-glucoside* 0.6553 0.8028 1.1246 0.9098 0.9388 1.5688
Butyl Beta-D-Fructopyranoside 0.8556 0.9309 0.6988 1.2053 0.8568 1.4527
Cadambagenic acid 1.7447 0.7387 1.9861 0.1114 1.0932 0.3257
Caffeic acid 0.9723 1.1708 1.1708 1.5921 0.5328 0.5612
Caffeoylbenzoyltartaric acid 1.3067 2.0320 0.3336 0.9545 0.7344 0.6387
Caffeoyl-O-mannitol 0.9927 0.9902 0.8441 0.6934 1.4242 1.0552
Caffeoyl-p-coumaroyltartaric acid 0.0729 0.0641 2.8696 2.8441 0.0718 0.0775
Caffeoyl(p-Hydroxybenzoyl)tartaric acid 1.6192 0.7503 0.9214 0.9183 1.0605 0.7304
Cagayanone A 0.4653 0.4761 2.0020 1.7062 1.0819 0.2686
Campneoside Ⅰ 1.1601 0.9404 1.3565 1.2136 0.5157 0.8137
Campneoside Ⅱ 1.2329 1.0709 1.4842 1.3706 0.3986 0.4429
Cannabifolin C* 1.8930 0.5819 1.2505 0.2701 1.6168 0.3878
Canthoside A 1.3193 0.8304 1.3431 0.0944 2.0168 0.3959
Capensolactone 1 0.6651 0.6775 0.6668 0.8444 1.3528 1.7934
Carthamone* 0.6716 1.0192 1.1397 0.9525 1.1957 1.0212
Cetostearic acid 1.0310 1.0505 1.0177 0.9727 0.9656 0.9625
Chelidonic acid 1.1261 0.6988 2.1985 0.5982 0.9425 0.4358
Chestnutlignansoide 0.4978 2.3163 0.4727 0.4110 1.5295 0.7727
Chlorogenic acid (3-O-Caffeoylquinic acid)* 1.1257 1.7852 1.0964 0.7523 0.4807 0.7598
Chlorogenic acid methyl ester 1.7049 0.4830 1.3836 0.7889 1.0842 0.5554
Chrysophanol-9-anthrone 1.0758 1.0135 1.0028 0.9368 1.0059 0.9652
Cichoriin* 1.3121 1.1884 0.4832 0.6319 1.0095 1.3748
Cimidahurinine* 0.5938 0.6375 0.2851 0.7326 1.3737 2.3773
cinnacassoside C 1.2865 1.4443 0.3130 0.5695 0.8429 1.5438
Cirsilineol (4^,5-Dihydroxy-3^,6,7-trimethoxyflavone) 0.8356 0.8963 1.1471 1.1925 1.0425 0.8861
Cis-10-Pentadecenoic Acid(C15:1) 1.1745 0.9253 1.0004 0.9856 0.9793 0.9348
Cis-4,7,10,13,16,19-Docosahexaenoic Acid 0.8446 1.0172 1.3230 0.9836 1.0102 0.8214
cis-Abienol 0.9391 0.8257 1.2232 0.8285 1.1885 0.9951
Cis-Coutaric acid 0.6102 0.2696 3.3169 0.4398 1.1292 0.2342
Cis-Jasmone 1.3206 0.7876 0.6617 0.8199 1.5395 0.8708
cistanoside C 1.5827 0.8899 0.7270 0.8007 1.1243 0.8755
Cistanoside E 0.4158 0.2902 2.9791 1.5473 0.3295 0.4381
Cistanoside F 1.1825 1.0479 0.8656 1.9754 0.4142 0.5143
Cistansinenside A; Salsaside E 2.0432 0.7250 0.6964 0.4655 1.2742 0.7958
Citraconic acid 0.9174 1.0709 1.1084 0.9549 1.0718 0.8765
Citric Acid 0.6188 0.6161 1.7838 1.3625 0.7476 0.8712
Citric acid-1-O-diglucoside 0.9338 0.9726 0.8870 0.6170 1.2733 1.3162
Citric Acid diglucoside 1.2466 1.0086 0.5524 1.5534 0.5629 1.0760
Citric acid glucoside 0.9408 0.9330 0.9929 0.5878 1.1418 1.4037
Clemastanin A 1.0483 0.9192 0.6068 1.3745 0.8388 1.2125
Confertifoline 0.9633 0.9574 0.9382 1.1728 0.9039 1.0644
Coniferin 1.3889 0.7224 0.7363 0.5902 1.1919 1.3704
Coniferyl alcohol 0.5677 0.6708 0.8541 2.0203 0.7069 1.1802
Cordianol B* 1.3029 0.5903 1.5005 0.2639 1.9858 0.3566
Cordianol D 1.2583 0.5970 2.3201 0.1477 1.4103 0.2666
Cormusglucoside A 0.4074 0.3358 0.8615 3.2566 0.8121 0.3266
Creatine 0.9701 0.7674 1.5756 0.8771 0.8738 0.9360
Cryptamygin B 0.9397 1.0052 0.8527 1.2615 0.6448 1.2962
Cryptochlorogenic acid (4-O-Caffeoylquinic acid)* 1.2166 1.9531 1.1243 0.5752 0.4954 0.6354
Cyclic 3^,5^-Adenylic acid 0.2685 0.3604 3.1511 1.7816 0.0806 0.3579
Cyrtominetin 0.9690 1.6959 1.7086 1.0182 0.2644 0.3439
Dactylorhin E(iso-1) NA NA 0.8371 0.9718 1.2359 0.9552
Dambonitol 0.8972 1.0411 1.4231 1.1456 0.9172 0.5758
Danthron; 1,8-Dihydroxyanthraquinone 0.8146 0.7753 0.8798 1.0448 1.5293 0.9563
Daphnetin 0.8511 1.5632 1.0915 1.7741 0.4429 0.2772
Daphnin* 1.1943 1.2843 0.4842 0.6207 1.0220 1.3945
D-Arabinono-1,4-lactone* 1.5692 0.8765 1.2342 0.9959 0.6705 0.6537
D-Arabitol 1.0485 0.9899 1.6686 0.5628 1.1327 0.5976
Darendoside A* 1.0052 1.0571 0.7240 0.9873 1.0330 1.1935
D-Cellobiose 0.9406 1.3448 0.6356 0.9683 0.8482 1.2625
decaffeoylverbascoside 0.6851 0.8322 0.5498 0.9414 1.0906 1.9008
Decumbic acid 0.6402 0.3964 3.4674 0.4826 0.4908 0.5226
Dehydroabietic acid 0.3513 0.4695 1.4210 0.4232 0.7209 2.6142
Dehydroandrographolide 0.1622 0.4308 3.9927 0.3054 0.7433 0.3656
Dehydrodiconiferylalcohol-9^-O-glucoside 0.8245 0.7046 1.2077 1.1740 0.7666 1.3226
Dehydrololiolide 1.2352 1.3754 0.9822 0.0598 1.9697 0.3777
Demethyl coniferin 1.7429 1.2786 0.7397 0.4085 0.8150 1.0152
Demethyloleuropein 1.0103 0.2886 0.5178 0.0211 3.8440 0.3181
D-Erythrose-4-phosphate 1.2318 1.1197 0.6874 0.9534 0.8344 1.1733
Desmethylagrimonolide-6-O-β-D-glucopyranoside 0.7562 0.7666 1.0401 0.9193 1.1059 1.4120
D-Fructose-1,6-biphosphate 1.4327 0.8078 1.0603 0.7680 0.9460 0.9852
D-Fructose 6-phosphate* 1.5115 1.1835 0.8270 0.7844 0.7378 0.9558
D-Fucose 0.8262 0.9655 1.8957 0.5762 0.9512 0.7853
D-Galactaric acid 1.4719 0.4916 2.8878 0.1751 0.7241 0.2495
D-Galactose* 0.9396 1.2001 0.7588 0.7819 1.1886 1.1309
D-Galacturonic acid* 1.4980 1.5874 0.8633 0.4609 0.6809 0.9095
D-Glucono-1,5-lactone 1.2538 1.0033 1.4887 0.4117 1.1998 0.6426
D-Glucoronic acid* 1.4985 1.5679 0.9208 0.4435 0.6984 0.8709
D-Glucosamine 1-phosphate 1.2743 1.0999 0.7469 0.7681 1.0364 1.0745
D-Glucose 1,6-bisphosphate 1.1255 0.6440 1.3961 0.7923 0.9199 1.1222
D-Glucose-1-phosphate* 0.9687 1.7926 0.5565 1.0573 0.5363 1.0886
D-Glucose 6-phosphate* 1.3415 1.0661 0.7931 0.9729 0.7478 1.0786
D-Glucurono-6,3-lactone 1.2228 1.0190 1.3961 0.6178 1.0289 0.7154
Dichotomoside A 0.9129 0.7614 0.7418 1.2521 0.7996 1.5322
Digalactosylglycerol 0.9271 1.1100 0.7813 0.6537 1.4657 1.0622
Dihydroabscisic Acid 4^-O-glucoside 0.8327 0.6237 2.2943 0.9724 0.5725 0.7044
Dihydrobuddlenol B* 0.7700 1.1141 0.1963 0.6509 2.0834 1.1853
Dihydrobuddlenol B glucoside 0.9985 1.1088 0.3247 0.4379 1.5497 1.5804
Dihydrocaffeoylglucose 1.1138 0.8737 1.0510 1.0470 1.0679 0.8465
Dihydrocatalpol 1.5800 1.5239 1.3066 0.2266 0.6212 0.7417
Dihydrodehydrodiconiferyl alcohol-4,9-di-O-β-D-glucopyranoside 0.5866 1.9388 0.7232 0.6810 1.0009 1.0696
Dihydrodehydrodiconiferyl alcohol-4-O-glucoside* 0.6876 0.4831 0.1903 0.1733 1.7722 2.6935
dihydrodehydrodiconiferyl alcohol-9-O-β-D-glucopyranoside 0.8967 1.8910 0.4474 0.8044 0.9578 1.0027
Dihydrodehydrodiconiferyl alcohol-9-O-β-D-xylopyranoside-4-O-β-D-glucopyranoside 1.3096 1.4398 0.3851 0.2463 1.3619 1.2573
Dihydroferulic acid glucoside 0.8406 0.8887 0.7553 1.0467 0.9528 1.5160
Dihydrokaempferol-7-O-glucoside 0.9079 1.1949 0.9189 0.9733 0.9897 1.0154
Dihydromarein 1.1608 1.0409 0.7043 0.9538 1.0036 1.1366
Dihydromyricetin-3-O-glucoside 0.7769 0.8412 0.6456 0.8323 1.6877 1.2163
Dihydroxyacetone phosphate 1.4089 1.2476 0.8473 0.6253 0.8471 1.0238
Dihydroxybenzoyl xyloside 2.3816 1.8130 0.6920 0.3224 0.5080 0.2831
Dihydroxyoctanoic acid glucoside 0.7775 1.3401 1.1326 0.4650 1.7240 0.5608
Dioxindole 1.0755 0.9074 0.9638 0.9722 0.9561 1.1250
DL-2-hydroxystearic acid 0.6039 0.6233 1.0755 2.7222 0.5737 0.4015
DL-3-Phenyllactic acid* 1.2238 1.2467 0.9781 0.7783 0.8183 0.9548
D-Lactose 0.7068 1.4377 0.2824 0.9192 0.8096 1.8442
DL-Glyceraldehyde-3-phosphate 1.4928 1.3936 0.6690 0.5938 0.7546 1.0962
DL-Glyceric Acid 0.7434 1.3793 1.2807 0.9040 0.9477 0.7449
D-Malic acid* 1.2747 1.0404 0.7242 0.6367 1.3023 1.0218
D-Maltotetraose 0.5089 1.1094 0.2744 1.8773 0.6097 1.6202
D-Mandelic acid 0.8216 0.8629 0.9974 1.1969 1.0600 1.0612
D-Mannitol 1.0799 1.5283 0.3148 0.9426 0.6750 1.4595
D-Mannose* 1.1022 1.1614 0.6702 0.7692 1.1436 1.1535
D-Melezitose 0.6235 1.2775 0.2969 0.9199 0.9763 1.9059
DMelezitose O-rhamnoside 0.8188 0.8394 0.8162 0.7620 1.9909 0.7726
Dodecanoic acid (Lauric acid) 0.8106 0.8535 1.5377 1.0737 0.8049 0.9196
D-Panose 0.5712 0.9134 0.2163 0.9466 1.0150 2.3375
D-Pinitol* 1.6516 1.5535 0.9896 0.3883 0.7388 0.6782
D-Ribose 1.8649 0.5962 1.6306 0.4861 0.9370 0.4851
D-Saccharic acid 1.4829 0.4842 2.9302 0.1563 0.7239 0.2224
D-Sedoheptuiose 7-phosphate 0.7595 1.8994 1.2703 1.0270 0.4172 0.6267
D-Sorbitol 1.1890 1.5321 0.2947 0.8986 0.6715 1.4141
D-Sucrose* 0.6883 1.4936 0.2993 0.9583 0.8205 1.7400
D-Threonic Acid 0.9329 0.9714 1.3138 0.4656 1.6344 0.6820
D-Trehalose* 0.9019 1.4338 0.3844 1.0022 0.7076 1.5700
Dunalianoside A* 0.5794 0.7036 1.0047 0.8068 0.9221 1.9834
Dunalianoside C* 1.0740 1.2170 0.4684 1.1424 0.8637 1.2345
D-Xylonic acid 1.4626 0.9313 0.7563 0.3300 1.7021 0.8177
Ebuloside 0.7445 0.7970 1.6845 1.0658 0.7575 0.9507
(E)-caffeyl alcohol 4-O-β-D-glucopyranoside 0.7799 0.8182 0.8779 1.2106 1.3366 0.9768
Elaidic Acid* 1.1259 1.2064 0.9829 0.8048 0.9968 0.8832
Eleutheroside E 0.2469 1.7041 0.4328 0.8774 0.4311 2.3077
(E)-Linalool-1-oic acid 0.6484 0.6999 1.9270 0.9415 1.0697 0.7135
Embelin 1.0250 0.9966 0.9418 1.0601 1.0250 0.9514
Engeletin 0.7223 1.0635 0.9137 0.8493 0.9967 1.4544
Enterodiol 0.7581 0.7829 0.7630 1.4354 1.1780 1.0826
Epicatechin-3^-O-β-D-glucopyranoside* 0.9666 1.0562 0.7594 1.6201 0.8180 0.7797
Epicatechin-4^-O-β-D-glucopyranoside* 0.8538 0.9715 1.1167 1.3709 0.9527 0.7344
Epicatechin gallate 0.6332 1.0888 1.6260 0.6966 0.7601 1.1953
Epicatechin glucoside 0.6866 0.7063 1.2496 1.2638 1.0484 1.0452
Epipinoresinol 0.6229 0.7162 1.6306 2.2625 0.4419 0.3259
Epitheaflavic acid-3-O-Gallate 2.4399 0.8343 0.7853 0.6666 0.6726 0.6013
Ergotamine 0.5489 1.2678 0.6019 0.8430 0.7060 2.0324
Eriodictyol-7-O-(2^^-O-rhamnosyl)xyloside-4^-O-glucuronide 1.2024 1.1163 1.3723 0.5548 1.3568 0.3974
Eriodictyol-7-O-(6^^-acetyl)glucoside 0.7826 0.4403 1.3836 NA 1.3182 1.0753
Eriodictyol-7-O-(6^^-O-galloyl)glucoside 0.9803 1.2198 0.6832 0.9900 0.9360 1.1908
Eriodictyol-8-C-glucoside* 1.1408 1.3433 0.4811 0.9300 0.8931 1.2117
Eriodictyol-8-C-glucoside-4^-O-glucoside 0.5973 0.6045 0.7038 1.1221 1.7456 1.2268
Erythorbic Acid; Isoascorbic Acid 1.0371 0.9404 1.4345 0.5981 1.5297 0.4602
Erythro-Guaiacylglycerol-β-O-4^-dehydrodisinapyl Ether 0.9073 0.8935 0.7889 1.2082 1.1382 1.0639
Erythro-Guaiacylglycerol-β-threo-syringylglycerol Ether 1.0257 1.0276 0.7106 0.9046 1.1553 1.1763
Erythro-Guaiacylglycerol-β-threo-syringylglycerol Ether glucoside 0.7790 1.7817 0.3728 0.7071 1.2267 1.1328
Esculetin (6,7-Dihydroxycoumarin) 0.9978 1.1571 1.1335 1.5638 0.5897 0.5580
Esculetin-7-O-glucoside* 1.3121 1.1884 0.4832 0.6319 1.0095 1.3748
Ethyl (10Z,13Z)-hexadeca-10,13-dienoate 1.1552 1.0685 0.8702 0.8182 0.8774 1.2105
Ethyl (4E,6E,8E,10E,13Z)-15,16-dihydroxy-5,9-dimethyloctadeca-4,6,8,10,13-pentaenoate 0.9875 1.1763 0.9248 0.9575 0.9149 1.0389
Ethyl linoleate* 1.0280 0.9664 1.0363 1.0191 0.9781 0.9720
Ethylmalonic acid 1.2901 1.0709 0.8517 0.9290 1.1936 0.6647
Eucalyptin (5-Hydroxy-7,4^-dimethoxy-6,8-dimethylflavone) 1.0832 1.6341 0.8307 0.7800 0.6424 1.0295
Eucommiol 1.2356 1.4369 0.7477 0.6109 1.2278 0.7410
Eurostoside 0.6103 0.5518 0.4576 0.8377 0.9836 2.5591
Eustomoside 1.4923 1.2927 0.2135 0.1953 1.4912 1.3149
Excelside B 0.8007 0.8522 0.6235 1.5213 0.8194 1.3829
Farrerol-5,7-di-O-glucoside 0.9936 1.5545 0.5959 0.5691 1.1476 1.1394
Ferulic acid 1.2783 0.9004 1.2531 0.8906 0.9342 0.7433
Ferulic acid-4-O-glucoside 0.9231 0.6629 0.8381 0.4871 1.9395 1.1493
Ferulic acid methyl ester 0.6335 1.0755 1.8675 1.1982 0.8006 0.4246
Feruloylcaffeoyltartaric acid 1.4506 0.9716 0.3931 0.2940 1.1579 1.7327
Feruloylferuloyltartaric acid 0.4898 1.0313 1.2915 0.6901 1.5168 0.9805
Feruloylmalic acid 0.7630 0.1707 0.5493 0.3188 1.6928 2.5054
Feruloylsinapoyltartaric acid 1.8809 0.3666 1.3042 0.0724 2.2366 0.1394
Feruloyltartaric acid (Fertaric acid) 0.4353 0.1976 2.4100 1.2131 1.0245 0.7196
Ficusesquilignan B 0.7134 0.6366 1.2541 1.5834 1.3895 0.4230
Flavin Single Nucleotide(FMN) 1.5445 0.9968 1.4164 0.5559 0.9744 0.5120
Flavoyadorinin B 1.0349 1.0977 0.6737 0.4917 1.4190 1.2831
Forskoditerpene A 0.6959 1.6061 2.2423 0.6860 0.5069 0.2627
Fraxetin-7,8-di-O-glucoside 1.4412 0.9184 0.8588 0.7237 0.9079 1.1500
Fumaric acid 1.0285 1.1961 1.0085 0.7527 1.1755 0.8387
Furanofructosyl-α-D-(3-mustard acyl)glucoside* 1.9409 0.9608 0.3981 0.4225 0.8569 1.4207
Fustin 1.0985 1.0276 NA 0.8612 1.3093 0.7033
Galactinol 0.6896 1.3720 0.2780 1.0319 0.8111 1.8174
Gallic acid-4-O-glucoside 1.4852 1.2807 1.5832 0.3768 0.6783 0.5959
galloyl acetyl glucoside 1.0470 1.0844 1.2027 1.1470 0.8036 0.7152
galloyl malonyl glucoside 1.6030 0.6185 1.4639 0.3146 NA NA
galloyl xylosyl glucoside 1.1832 1.5674 0.2127 0.5474 0.9296 1.5597
Gastrodioside 1.3083 0.8843 1.5529 0.8267 0.6163 0.8115
Gentisic acid 2-O-(6^^-O-Feruloyl)Glucoside* 1.5554 1.3417 0.5345 0.5178 0.9540 1.0966
Gentisic acid 2-O-(6^^-O-p-coumaroyl)Glucoside 1.3357 0.8375 0.9843 0.6192 1.5250 0.6983
gentisic acid 5-O-β-D-(6^-O-galloyl)-gluco-pyranoside 0.8025 1.0807 0.1852 0.2002 1.7587 1.9726
Gingerglycolipid A 1.3430 1.2128 1.3843 0.8220 0.5180 0.7200
Gingerglycolipid B 0.4831 0.5201 1.6058 2.2687 0.5076 0.6148
Gingerglycolipid C 0.6337 0.8007 1.5529 1.5043 0.5486 0.9599
Glochiflavanoside A 1.2118 1.3009 0.3843 0.8562 0.9064 1.3403
Glucaric acid-1-Phosphate 1.1495 0.5355 1.7720 1.5856 0.3864 0.5710
glucoacetosyringone 1.2572 1.1031 0.8255 0.5493 1.3324 0.9324
Gluconic acid 1.5144 0.8081 1.7276 0.3793 1.1628 0.4079
Glucosyl 10,11-dihydroxy-2,6-farneSadienoate 0.7370 0.8595 1.2809 1.4431 0.7929 0.8867
Glucosyl 2,3-Dihydroxy-2-Methylbutanoic Acid 1.7510 1.2784 0.7580 0.5521 0.8716 0.7889
Glucosyl 2,6-dimethyl-8-oxoocta-2,6-dienoic acid 0.7733 1.1143 1.1746 1.5863 0.5766 0.7748
Glucosyl 2-Hydroxy-4-Methylpentanoic Acid 0.7326 0.4863 1.7461 1.4620 1.0874 0.4856
Glucosyl 3,7-dimethyloct-2-ene-1,6,7-triol 1.7563 1.7960 0.3536 0.4816 0.8188 0.7937
Glucosylacetylviscumneoside VII 0.8837 0.7524 0.6698 0.8282 1.4736 1.3923
Glucosyl tachioside 1.3446 1.7952 0.1760 0.1715 1.0408 1.4719
Glucosyringic acid 1.0242 1.0637 0.4947 0.7678 1.1248 1.5249
Glutathione reduced form 1.1609 0.8510 0.6330 0.7292 1.7562 0.8697
Gossypetin-8-O-β-D-glucuronide 1.5537 1.3435 0.5885 0.4712 0.9929 1.0502
Graminone A glucoside 0.7310 1.4833 0.6233 1.0610 1.1014 NA
Grevilloside F 1.2157 0.8210 0.5035 0.6783 1.3256 1.4559
Grevilloside G* 1.4312 1.0374 1.0231 0.5862 0.9515 0.9706
Guaiacylglycerol 8-O-(1^^-O-Glucosyl)Vanillic Acid Ether* 0.4174 0.5303 0.4925 1.2177 1.6817 1.6604
Guaiacylglycerol-β-Guaiacyl Ether glucoside 0.5149 0.5991 0.5462 0.9351 1.3320 2.0728
Guanosine 3^,5^-cyclic monophosphate 0.3521 0.4163 3.0131 1.6236 0.1658 0.4292
Hamiltone A 0.8408 0.4897 0.5134 0.8061 1.4199 1.9302
Hellicoside 1.0032 1.1313 0.8947 1.1452 0.8631 0.9624
hemerocallin 1.0887 1.2411 0.7290 0.7189 1.2359 0.9864
Herbacetin 0.9551 0.9519 0.6193 0.9562 1.3565 1.1609
Hexadecanedioic acid 0.8301 1.2222 0.9111 1.2829 0.7408 1.0129
Homocitrate 1.1662 0.8003 2.9969 0.3747 0.3200 0.3418
Homoeriodictyol feruloyl apiosyl glucoside 0.9262 1.4262 0.9021 0.8805 0.9121 0.9527
Homoeriodictyol salicyl apiosyl glucoside 0.8475 0.8959 0.8715 1.0428 1.2000 1.1423
Homogentisic acid* 0.9783 1.1212 1.4380 1.2354 0.6927 0.5344
Homovanillic acid sulfate 1.0796 0.7504 1.9816 0.6536 0.9376 0.5972
Hydrangeifolin I 0.6729 0.9275 0.5361 1.4772 0.4570 1.9292
Hydroquinone 0.8786 0.9677 1.1004 1.2611 0.6921 1.1001
Hydroxy-Dihydrophaseic Acid glucoside 1.1065 1.2952 0.8541 0.8611 0.8611 1.0221
Hydroxyferulic acid glucoside 0.7274 0.9077 0.8345 1.2405 0.9881 1.3018
Hydroxypentadecenoic acid glucoside 1.3944 1.4765 0.8821 0.5958 0.8758 0.7754
Hydroxypyruvic acid 0.9783 1.1269 1.0090 0.9138 1.0753 0.8966
Hydroxy ricinoleic acid 1.0922 1.7636 0.7197 0.7025 0.8214 0.9005
Hydroxyterephthalic acid O-(6^^-O-Benzoyl)Glucoside 1.1991 1.8303 0.6594 0.4976 1.3731 0.4405
Hydroxytyrosol 1.0316 1.5290 1.1861 0.4648 1.2001 0.5884
Hydroxytyrosol acetate 1.0500 1.8488 1.0346 0.2124 1.1501 0.7040
Hypolaetin* 0.9369 0.8091 0.9504 NA 0.9689 1.3346
Ibotalactone B 1.4351 1.1100 0.0757 0.0855 1.7700 1.5237
icariside D1 0.6597 0.7914 1.4147 1.0485 1.0225 1.0632
Icariside E5* 0.8295 0.9004 0.6197 0.8793 0.8466 1.9246
Indole-3-carboxylic acid* 0.9428 1.1358 1.0292 0.5353 1.3987 0.9582
Indole-3-cyano-2-O-glucoside 0.9181 1.3308 0.7539 0.3903 1.3099 1.2970
Indole-5-carboxylic acid* 0.9428 1.1358 1.0292 0.5353 1.3987 0.9582
Inositol* 1.0031 0.9200 0.8927 0.8723 1.1468 1.1650
isatioxyneolignoside E 0.7785 0.6609 1.0823 0.9050 0.8762 1.6970
Isoascorbic acid 2-O-glucoside 1.0850 0.8363 0.8015 0.3973 1.3465 1.5334
Isoceanothic acid 2.1346 0.9456 1.2443 0.0665 1.2403 0.3688
Isochlorogenic acid A 0.6848 0.9451 1.2007 0.8937 0.8978 1.3778
Isocitric Acid 0.5353 0.6262 1.5962 1.6045 0.7595 0.8783
Isocitric acid-1-O-diglucoside 1.0407 0.8981 0.8170 0.5847 1.3455 1.3141
Isodunnianin 1.1380 0.9312 1.1696 1.0542 1.0308 0.6762
Isoetin (5,7,2^,4^,5^-Pentahydroxyflavone)* 0.7821 0.9648 0.7263 1.1773 1.2706 1.0789
Isohemiphloin 0.9451 0.7533 0.3454 0.9521 1.1059 1.8983
Isolariciresinol 0.5566 0.5965 2.0394 0.6911 1.7248 0.3916
Isolariciresinol-9^-O-glucoside* 0.6737 0.4717 0.2222 0.3235 1.4595 2.8494
Isolariciresinol-9-O-xyloside 0.9237 0.7574 1.2066 1.0044 1.2997 0.8084
Isolariciresinol-9^-O-xyloside 0.5944 0.6135 1.7532 0.3042 2.3205 0.4141
Isomartynoside 0.1332 0.1340 2.9923 2.3645 0.1574 0.2186
Isopimaric acid* 0.8708 0.8344 0.9948 1.2735 1.2393 0.7872
Isorinic acid 0.5643 0.8159 1.4270 1.8390 0.9626 0.3912
Isosakuranetin 7-Alpha-L-Arabinofuranosyl-(1->6)-Glucoside 1.2174 1.5259 0.3731 0.6123 0.7752 1.4961
Isosalicin 0.5066 0.2752 2.8017 1.8827 0.3139 0.2198
Isotachioside* 0.6044 0.6607 0.9020 1.4473 1.1584 1.2272
Isoxanthopterin 1.0353 0.9917 0.8392 1.0431 1.1214 0.9694
Itaconic acid 0.5764 0.6924 1.6023 1.2928 0.8850 0.9512
Jasmonic acid 0.5453 1.5055 0.9829 0.8266 0.9670 1.1727
Jasmonoyl-L-Isoleucine 0.7334 2.8127 0.3076 1.0760 0.2304 0.8399
Jionoside C 2.0429 0.9768 1.2383 0.6629 0.7242 0.3550
Jionoside D 0.5256 0.8858 1.8506 1.8889 0.2711 0.5781
kaempferol-3-feruloyldiglucoside-7-glucoside 2.0435 0.6173 1.8034 0.5393 0.2741 0.7224
kaempferol-3-p-coumaroyldiglucoside-7-glucoside 0.8727 1.0068 1.0619 0.9618 0.8807 1.2160
Kaempferol-7-O-glucoside* 0.6716 1.0192 1.1397 0.9525 1.1957 1.0212
Kaempferol feruloyl glucosyl acetyl glucoside 1.1684 0.7529 2.1430 0.1388 1.4781 0.3188
Kankanoside A 1.1630 2.6942 0.1639 0.6847 0.8140 0.4801
Kankanoside P 1.0190 1.1823 0.7155 1.2382 1.0292 0.8158
Kaurenoic Acid* 0.9001 1.0166 0.9367 0.8557 0.9051 1.3858
Keto-Deoxy-Nonulonic acid 1.0761 1.3973 0.6013 0.6569 1.2277 1.0408
Koaburaside* 0.9089 0.9567 0.6160 0.9767 1.4235 1.1182
L-Alanine 0.9639 1.1784 0.5266 1.5081 0.7367 1.0862
Laminaran 0.9400 1.1250 0.3513 0.8267 1.2263 1.5308
Lariciresinol-4^-O-glucoside* 0.7762 1.1678 0.6200 1.0767 0.8224 1.5369
Laricitrin-3-O-(6^^-acetyl)glucoside 1.9779 1.7773 0.7650 0.4017 0.5029 0.5751
L-Ascorbic acid (Vitamin C) 1.1928 0.7968 1.5888 0.5554 1.2311 0.6350
L-Aspartic Acid 0.9989 1.1058 0.5913 1.5907 0.5834 1.1299
Lavandulifolioside 0.7900 0.8233 0.4305 0.9888 1.2448 1.7227
L-Citramalic acid 0.6061 0.6527 1.6367 1.4051 0.7914 0.9080
Leonuriside A* 0.2508 0.3536 1.1641 3.0084 0.4969 0.7262
L-Fucitol 1.2363 0.9183 0.8300 0.3820 1.8158 0.8176
L-Glucose* 0.8060 1.1731 1.0376 1.0102 1.0117 0.9614
L-Glutamic acid-O-glycoside 1.0782 1.2652 0.5615 1.2298 0.6866 1.1787
L-Glutamine-O-glycoside 0.8592 1.3216 0.5419 1.3706 0.8765 1.0302
Lipedoside A-II 1.4202 0.9426 0.6429 0.3503 1.5066 1.1374
Lirioresinol A 0.5922 0.5872 2.4132 0.3125 1.9441 0.1509
Loroglossin 0.6832 0.5996 0.8762 1.6188 0.6433 1.5789
L-threo-3-Methylaspartate 1.0899 1.1152 0.3295 1.1874 0.7121 1.5659
L-Tryptophan 1.8649 0.7080 0.9917 1.4147 0.3962 0.6245
Lugrandoside 1.3169 0.9975 1.5313 1.3566 0.4018 0.3958
Luzonoside C 0.7495 0.9475 0.3984 1.0816 1.1034 1.7195
Lyoniresinol-3-O-Alpha-L-Rhamnoside 0.4408 0.4996 0.4507 1.0754 1.4579 2.0755
LysoPC(18:3(9Z,12Z,15Z)) 1.3560 1.4198 0.5641 0.5516 1.1771 0.9314
LysoPG 16:0 0.8102 1.1197 0.9145 0.9754 1.0310 1.1492
LysoPI 16:0 0.5199 1.1007 2.4398 1.1400 0.2734 0.5262
Machilusolide D 0.7986 1.2671 0.6948 0.7794 1.1165 1.3437
Magnoloside B 0.9949 0.9420 0.5259 0.8307 1.1404 1.5661
Maleoyl-caffeoylquinic acid 0.8729 0.9329 0.9740 0.8044 1.3381 1.0777
Malic acid-1-O-diglucoside 1.1879 1.2116 0.4723 0.3988 1.0018 1.7276
Malonic acid 1.0409 1.2559 0.8503 0.8524 1.1156 0.8849
Maltitol 0.9043 1.8110 0.3359 0.7125 0.8053 1.4310
Mandelic acid-β-glucoside 2.0221 0.5024 0.8074 0.1752 2.0615 0.4314
Manglieside B* 0.8996 1.2662 1.3242 1.3183 0.4814 0.7101
Manglieside D 0.4186 0.9851 0.5803 0.8061 0.8270 2.3829
Manninotriose 1.0710 1.5984 0.3525 0.6343 1.0814 1.2623
Mansonone G 0.0979 0.0862 5.5151 0.1017 0.1129 0.0861
Maplexin C (2,3-Di-O-Galloyl-1,5-Anhydro-D-Glucitol)* 1.0300 0.8980 0.9258 1.2601 1.1374 0.7488
Maplexin D (2,4-Di-O-Galloyl-1,5-Anhydro-D-Glucitol)* 0.7135 0.7455 1.3038 0.6831 1.2431 1.3108
Marlignan D 1.1568 1.2523 1.4583 0.8036 0.6631 0.6658
Mearnsetin-3-O-glucoside 2.3472 1.1298 0.6039 0.3028 0.9971 0.6193
Mearnsetin-3-O-glucuronide 0.9094 0.9645 1.6944 0.6172 1.0373 0.7771
Medioresinol-4,4^-di-O-glucoside 1.0899 1.0216 0.8006 1.0172 0.9881 1.0825
Medioresinol-4^-O-(6^^^-acetyl)glucoside 0.9305 0.9298 1.1951 0.5057 1.5927 0.8463
Melibiose 0.8279 1.3337 0.3639 1.2204 0.6782 1.5760
Met-Abu-OH 0.8727 0.3324 0.5260 0.3177 2.0780 1.8732
Methanesulfonic acid 0.9525 0.9099 1.7245 0.9371 0.7085 0.7675
Methoxy-erythro-Guaiacyl glycerol β-threo-syringyl glycerol ether 1.2191 1.0504 0.7227 0.7794 1.3057 0.9227
Methyl 2,4-dihydroxyphenylacetate* 0.8245 0.9028 1.0997 1.3301 1.3341 0.5088
Methyl 2-furoate 1.1047 1.0924 0.8737 1.1058 0.7976 1.0257
Methyl 3-(3-hydroxy-4-methoxyphenyl)propanoate* 1.0099 0.6378 0.8531 1.0795 1.1523 1.2673
Methyl 3-O-Methyl Gallate 0.9359 0.9025 0.9322 1.0346 0.9693 1.2256
Methyl 4-hydroxybenzoate* 0.9133 0.8373 0.4466 0.9094 1.1524 1.7410
Methyl abieta 0.6706 1.1358 1.9644 0.4587 0.8478 0.9228
Methylhesperidin 1.1588 0.9613 1.2034 1.0830 0.8167 0.7768
Methylmalonic acid 0.9587 1.0460 1.0406 0.9751 1.1326 0.8469
Mevalonic acid 0.6738 0.9602 2.4711 0.4753 0.8664 0.5531
Minecoside 0.7633 0.6990 1.9562 1.6091 0.5144 0.4579
Moniliferanone D 1.2908 1.2590 0.7854 0.7379 0.9318 0.9951
Monogalloyl-diglucose 0.9776 1.0459 0.6143 1.4436 0.6371 1.2814
Morin-3-O-lyxoside 1.2754 0.9508 1.0143 0.9420 0.5251 1.2923
Morolic acid* 1.4711 1.2322 0.9346 0.2658 1.6047 0.4917
Mucic acid-1,4-lactone-3,5-di-O-gallate 0.7694 0.7553 0.8576 0.5336 1.0672 2.0168
Mucic acid Dimethyl Ester 0.9147 0.9787 1.0952 0.8795 1.2575 0.8744
Muconic acid 0.6421 0.8219 2.4248 0.9488 0.5098 0.6525
mudanpioside E* 0.4174 0.5303 0.4925 1.2177 1.6817 1.6604
Myricetin-3,7,3^-trimethyl ether 0.9443 1.1323 0.7458 1.0558 0.7556 1.3662
Myricetin-3-O-arabinoside 0.6657 1.2537 0.7566 1.1427 1.0797 1.1015
N-(3,4,5-trihydroxycinnamicacid)-alanine 0.1232 0.0642 0.9747 0.0671 4.7200 0.0508
N-Acetyl-D-glucosamine-1-phosphate 1.5347 0.9471 0.6171 0.4598 1.2421 1.1993
N-Acetylisatin 4.3673 0.1483 0.6488 0.5352 0.2737 0.0267
N-Acetyl-L-glutamic acid 1.3266 1.0810 0.8255 1.1759 0.6335 0.9575
N-Acetyl-L-Glutamine 1.0919 0.9361 1.2366 0.8086 0.9955 0.9313
N-Acetyl-L-phenylalanine 1.5577 1.0740 1.0798 0.4126 0.9786 0.8973
N-Acetyl-L-threonine 1.2995 1.1721 1.2896 0.5468 0.8980 0.7940
N-Acetylneuraminic acid 0.8425 1.1561 1.1694 0.9809 0.8327 1.0184
N-acetylvaline 1.3815 1.3933 0.9635 0.7978 0.8074 0.6565
NADP (Nicotinamide adenine dinucleotide phosphate) 0.7507 0.9711 0.8398 1.2772 1.1253 1.0359
N-carboxy-N-(2-oxo-2-phenylethyl)-L-alanine 0.5676 0.6422 2.7158 0.3304 1.4177 0.3263
Neochlorogenic acid (5-O-Caffeoylquinic acid)* 1.1422 1.7027 1.0350 0.8478 0.5452 0.7270
Newbouldioside A 0.7340 1.1785 1.4599 1.2905 0.4613 0.8757
Nicotinate adenine dinucleotide phosphate 0.9546 0.7556 1.1983 0.8751 1.3085 0.9079
Nitensoside A 1.4126 1.1796 0.5895 0.7211 0.9089 1.1883
N-(malonyl)phenylalanine 0.9133 0.6152 1.0016 0.3932 1.4157 1.6609
N-Methylglycine 0.8779 1.1074 0.7059 1.5666 0.5400 1.2023
Norarjunolic acid 1.2035 0.8997 2.7576 0.0808 0.9128 0.1457
Nordihydrocapsiate 1.0141 0.9987 0.9331 1.0492 1.0514 0.9535
Noricariside 1.0094 0.6268 1.6456 0.5994 1.3553 0.7635
Norlinolenic acid 1.5600 1.2541 0.5772 0.6255 0.9465 1.0367
Nortrachelogenin-4^-O-gentiobioside* 1.0232 2.0455 0.4283 0.5804 0.6276 1.2950
Nortrachelogenin-4-O-glucoside 1.0424 1.0953 0.4730 1.1403 0.8178 1.4313
Nuezhengalaside* 0.7788 0.8824 0.7848 1.0913 0.8974 1.5652
Nystose 0.5844 1.2097 0.2017 2.3140 0.3965 1.2937
N-α-Acetyl-L-ornithine 0.1504 0.1415 1.1567 4.2761 0.0984 0.1769
Octanoic acid 0.9183 1.0481 0.9472 0.9958 1.0060 1.0846
Octanoyl arabinosylglucoside 1.1593 0.6908 0.8249 1.2909 1.1023 0.9319
O-Feruloylgalactaric acid 0.8539 0.8376 1.2724 0.9948 0.9567 1.0845
Oleoacteoside 1.8241 0.7783 0.5109 0.2783 1.8828 0.7256
Oleoechinacoside 1.0146 0.7807 0.4628 1.0833 1.0422 1.6165
Oleonuezhenide 0.9308 0.8847 0.7265 1.0172 1.1644 1.2764
Oleoside 11-methyl ester 1.1160 1.6281 0.7007 0.7791 0.9938 0.7823
Oleuropein 1.2291 0.6039 0.9207 1.5276 0.5460 1.1728
Olivil 0.6515 0.7653 1.3144 1.6349 0.7456 0.8883
Olivil-4,4^-Di-O-glucoside 0.6478 1.4618 0.9947 0.5555 0.9358 1.4045
Olivil-4^-O-glucoside 0.7747 0.9867 0.5826 1.1271 0.9998 1.5292
O-p-Coumaroylgalactaric acid 1.5618 0.8048 1.5040 0.2545 1.0690 0.8058
O-Phosphorylethanolamine 1.3845 1.0718 0.6368 0.3699 1.3554 1.1816
Orotic acid (Vitamin B13) 0.8155 0.7202 1.6904 1.1707 0.7894 0.8138
Orotidine 1.0522 0.7944 1.3914 1.1271 0.8532 0.7817
Osmanthuside H[2-(4-Hydroxyphenyl)ethyl-β-D-apiosyl-(1→6)-β-D-glucoside]* 0.9972 1.0149 0.7438 0.9743 0.9914 1.2784
Oxalacetic acid 1.0901 1.2464 1.1260 0.8698 0.7750 0.8928
Oxalic acid 1.3148 1.2565 0.7644 0.7991 0.9292 0.9360
Oxiglutatione 1.6543 0.9369 0.4937 0.6149 1.1738 1.1264
Oxyallobetulin* 1.4734 2.4158 0.3690 0.4101 0.6153 0.7164
Palmitaldehyde 0.8337 0.7771 0.8623 1.0390 1.5087 0.9792
Palmitic acid 1.0098 1.0762 1.0354 0.9542 0.9643 0.9602
p-Coumaraldehyde 0.7849 1.0035 1.0596 1.2221 1.5264 0.4034
p-Coumaric acid-4-O-glucoside 1.0111 0.7738 0.3197 0.4143 1.4281 2.0532
p-Coumaroylcaffeoyltartaric acid 0.9357 1.3602 0.8457 0.9474 0.7044 1.2066
p-Coumaroylmalic acid 1.1222 0.5537 1.4037 0.3104 1.7267 0.8833
p-Coumaryl alcohol 0.3276 0.4645 2.7453 1.5940 0.4517 0.4170
Pedalitin 0.9132 1.1786 0.6356 0.8629 0.9606 1.4491
Peiioside A1 NA 1.8274 0.6242 1.4109 0.5688 0.5688
Pentadecanoic Acid 1.0528 1.1947 0.8773 0.8035 1.1092 0.9625
Persicoside* 1.2754 1.1387 0.6884 0.7810 1.0032 1.1133
Petroselinic acid* 1.1427 1.1669 0.9392 0.8420 1.0286 0.8805
Phe-Abu-OH 1.1849 0.9327 2.2077 0.3047 0.9834 0.3865
Phellatin 0.8960 1.4484 0.6542 0.9532 0.9687 1.0795
Phenyl acetate 0.6634 1.0899 1.2861 1.6446 0.6514 0.6645
phenylacetic acid 1.4240 0.8106 0.7243 1.2369 0.8362 0.9680
Phenylacetyl-L-glutamine 0.7543 0.9311 0.7506 1.7020 0.6774 1.1846
Phenyl-beta-D-glucoside 1.0475 0.3288 3.4674 0.3143 0.5837 0.2583
Phenylpropionic acid-O-β-D-glucopyranoside 1.3995 0.7312 0.4549 0.4287 1.1196 1.8660
Phillyrin 1.1610 0.5596 0.7076 0.6600 1.7913 1.1206
Phloretin-4^-O-[4^,6^-O-(S)-HHDP]-β-D-glucoside 1.0450 1.1120 0.7249 0.9124 0.6718 1.5339
Phloroglucinol-1-O-β-D-glucopyranoside 0.4920 0.7684 0.5946 1.1538 1.5327 1.4587
Phosphoenolpyruvate 1.1473 1.1893 1.4327 1.0492 0.5808 0.6006
Phthalic acid 1.0248 0.8739 0.8470 1.0414 1.1636 1.0492
Phthalic acid,6-ethyl-3-octylbutyl ester 0.9765 1.0084 1.2182 0.8474 1.0435 0.9060
p-Hydroxypheny-β-D-allopyranoside 0.2286 0.2815 1.1830 2.9514 0.6756 0.6799
Phytic acid 0.9824 1.0537 0.9382 1.0416 1.0126 0.9715
Picein (4-Acetylphenyl-glucoside) 0.8224 1.0834 0.7963 1.3884 0.8036 1.1059
Picraquassioside C 0.8422 0.8496 0.6109 0.9588 1.1157 1.6228
Pimaradienone 0.9153 0.9554 1.2984 0.8044 1.0868 0.9396
Pimelic acid* 1.1563 1.3199 0.9648 0.9607 0.8251 0.7733
Pinoresinol-4-O-(6^^-acetyl)glucoside 0.9944 1.5588 0.9367 0.4448 1.0166 1.0488
Pisiferic acid 0.6706 1.1358 1.9644 0.4587 0.8478 0.9228
Plantamajoside 0.6813 1.0414 1.4850 1.7937 0.3894 0.6092
P-Methoyxcinnamate glucoside 0.9722 0.6448 1.0351 0.8786 1.1886 1.2807
Proglobeflowery acid 0.7689 1.0384 0.9251 1.1052 1.0108 1.1516
Protocatechualdehyde 1.3604 0.8030 0.9256 0.7658 1.3896 0.7557
Protocatechuic acid 4-O-(2^^-O-Vanilloyl)Glucoside 1.2012 1.1587 0.5013 0.2500 2.0702 0.8186
Protocatechuic acid 4-O-(6^^-O-Feruloyl)Glucoside* 1.5247 1.3610 0.5515 0.5158 0.9968 1.0502
Protocatechuic acid-4-O-glucoside 1.1704 1.0067 1.4825 0.5431 1.1624 0.6350
Protocatechuic Acid Methyl Ester 1.0283 0.9308 0.7263 0.6450 1.2416 1.4280
Prustomentoside B 2.3419 2.0327 0.5818 0.2188 0.3894 0.4354
Purpureaside C* 1.1501 1.2696 0.6077 1.0047 0.7425 1.2254
Pyrocatechol 0.9010 0.7908 1.0357 1.8332 0.8889 0.5505
Pyrocatechol monoglucoside 1.6825 1.0193 1.2015 0.3324 0.5610 1.2033
Quercetagetin-4^-Methyl Ether 1.1113 0.4984 1.3787 0.6484 1.9277 0.4355
Quercetin-3-(2^^-galloyl)rhamnoside 1.0361 0.7628 1.0116 1.1366 0.7933 1.2597
Quercetin-3-O-glucoside (Isoquercitrin) 0.8347 0.9461 0.5513 0.8259 1.1389 1.7030
Quercetin-3-O-robinobioside 0.7644 1.7429 0.3262 1.0434 0.4678 1.6552
Quercetin-3-O-rutinoside (Rutin) 0.8601 1.5107 0.5886 0.8521 1.0643 1.1242
Quercetin-4^-O-glucoside (Spiraeoside)* 1.3151 1.3520 0.6548 0.1990 1.6179 0.8613
Quercetin-4^-O-glucuronide 0.7143 0.8047 1.0252 0.9861 1.2262 1.2435
Quercetin-7-O-glucoside 1.2309 1.3045 0.6371 0.2456 1.6816 0.9004
Quinacyl syringic acid 1.0537 0.6374 1.2982 1.0400 1.0669 0.9039
Quinic Acid 1.0294 0.6260 1.4777 1.3425 0.7323 0.7921
Quinolinic Acid 0.8513 0.6907 1.4048 0.5637 1.3087 1.1807
Rabdosia acid A* 0.8357 1.7090 0.7939 0.6660 0.9750 1.0204
Raspberryketone glucoside 0.6153 2.4214 0.6493 0.7662 0.6768 0.8710
R-Campneoside II* 1.3089 0.9991 1.4245 1.3678 0.4077 0.4921
Rhamnosyl-gentisic acid-5-O-β-D-glucoside 0.8186 0.8283 0.6538 0.9494 1.1120 1.6378
Rhamnosyl Phellamurin 1.1851 0.8047 0.5342 0.4191 1.6826 1.3742
Riboflavin 5^-Adenosine Diphosphate 1.2553 0.9993 1.3437 0.7735 0.9010 0.7272
Ribulose-5-phosphate 0.8696 1.1947 0.9372 0.7408 0.7060 1.5516
Ricinoleic acid 0.7934 0.8209 0.4882 0.5866 1.1399 2.1710
Robustaside A;[6^-p-Coumarylarbutin] 0.8494 0.8533 1.7996 1.1868 0.4375 0.8734
Roseoside 1.0756 1.3067 0.7202 0.6866 1.0112 1.1998
Rosmarinic acid methyl ester 0.8734 1.0155 1.2170 0.7678 1.4611 0.6652
Rossicaside* 1.2299 1.0450 0.5985 1.0307 0.7429 1.3531
Rubianol-f 1.4405 1.5800 0.7721 0.2925 1.0185 0.8964
Rubione B 2.1219 0.7356 1.0768 0.2070 1.4944 0.3643
Rubusin B 1.0970 0.7868 1.9479 0.6780 0.8617 0.6286
Rumphioside B* 0.4855 1.1154 0.6189 1.3049 1.0014 1.4739
Rutinose 1.3811 0.8270 1.2157 0.8980 0.9881 0.6899
(S)-2-Hydroxy-3-(4-Hydroxyphenyl)Propanoic Acid* 0.9236 0.9566 0.8588 0.8992 1.0427 1.3190
Sagerinic acid 0.7181 0.8935 1.2623 1.6582 0.4794 0.9886
Saikolignanoside A 0.6465 0.6210 0.3935 1.0838 1.7954 1.4599
Salicin 1.7390 1.2958 1.0899 0.3773 0.9027 0.5952
Salicortin 0.7168 1.6246 1.7491 0.9460 0.5126 0.4508
Salicyl Alcohol 0.7263 0.8596 2.7115 0.7936 0.5220 0.3871
Salicylic acid 0.9954 0.7466 2.1223 1.2583 0.5561 0.3214
Salicylic acid-2-O-glucoside 0.5948 0.6109 0.1567 0.5141 1.7850 2.3385
Salidroside 0.5409 0.5941 0.4753 1.0510 0.9214 2.4173
Salirepin 0.9043 0.8184 0.7498 0.9994 1.1501 1.3781
Salirepin 6^-O-Caffeate 1.0130 1.5365 0.5264 0.6842 0.8749 1.3650
Salsaside B* 1.4080 2.0376 0.8785 0.2255 1.2660 0.1844
Salviaplebeiaside 1.2624 0.5758 0.3022 0.2455 2.3005 1.3137
(S)-Campneoside II* 1.2690 1.0653 1.4327 1.3294 0.4106 0.4930
Scandoside methyl ester 1.0898 0.8880 0.6898 1.7643 0.9812 0.5869
Secoisolariciresinol-9^-O-glucoside 0.5309 0.7409 1.5237 1.6105 0.9627 0.6314
Secoisolariciresinol-9^-O-xyloside 0.4669 0.4886 1.0029 0.2191 3.2036 0.6188
Secoisolariciresinol diglucoside 1.3025 1.1713 0.4387 0.6843 1.3490 1.0542
Sedoheptulose 1.5010 0.5316 2.7243 0.2171 0.7321 0.2938
Sesamolinol 4^-O-β-D-Glucosyl (1->6)-O-β-D-Glucoside 0.6688 0.8426 1.0138 1.0315 0.9412 1.5021
Sesamolinol-glucoside 1.0074 0.8040 1.5987 0.6286 1.2697 0.6916
Shikimic acid 0.8466 0.9305 0.8704 1.9570 0.5563 0.8392
Shikimic Acid-3-Phosphate 0.9703 0.9643 1.1393 1.2325 0.6989 0.9947
Sibiricose A3 1.6194 1.3953 0.8461 0.3659 0.8847 0.8886
Sibiricose A6 0.7733 1.6133 NA 0.2950 0.8247 1.4937
Sideretin (5,7,8-Trihydroxy-6-methoxycoumarin) 1.2192 0.8563 0.8121 1.7310 0.7186 0.6628
Simulanol 0.8481 1.1233 1.4583 0.7115 0.9653 0.8936
Sinapic acid 0.4295 0.5656 2.7219 0.9919 0.5098 0.7813
Sinapinaldehyde 0.6355 0.6165 2.3475 0.5289 1.3708 0.5007
Sinapoylglucuronic acid 1.0715 0.4685 2.1516 0.3074 1.7424 0.2586
Sinapoyl-p-coumaroyltartaric acid 0.5726 0.3205 2.7945 0.5973 1.0550 0.6601
Sinapoylsinapoyltartaric acid 0.6461 0.7787 1.0045 1.0886 1.1186 1.3634
Sinapyl alcohol* 1.0727 0.6925 1.6297 0.7422 1.3881 0.4748
(S)-Malic acid-1-O-beta-D-glucopyranoside 1.6341 1.3744 0.8550 0.6118 0.7810 0.7436
sn-glycero-3-phospho-(1^-sn-glycerol) 1.6969 0.9320 0.2405 0.0413 1.9060 1.1832
Sodium ferulate 0.9737 1.2171 1.2656 0.7033 1.0107 0.8297
Solatriose 0.7812 1.0522 0.3803 2.6835 0.6772 0.4256
Sorbitol-6-phosphate 1.3735 1.1500 0.6832 1.0865 0.5325 1.1743
Stachyose 0.6320 1.0972 0.2442 2.4906 0.3108 1.2252
Suberic Acid 0.9369 1.3282 0.9418 0.8887 0.9595 0.9449
Succinic semialdehyde 1.0942 1.3810 0.4815 0.8062 0.8251 1.4121
Sucrose-6-phosphate 0.9880 1.2020 0.4833 0.5939 1.1917 1.5410
Sulfo jasmonate 0.6136 0.7265 1.3776 2.0411 0.5975 0.6437
suspensaside A 1.2333 0.9613 0.9446 0.9649 0.9929 0.9030
Syringafghanoside 0.7129 NA 0.8094 0.9818 1.2652 1.2307
Syringaldehyde; 4-Hydroxy-3,5-Dimethoxybenzaldehyde 0.5941 1.1658 1.0849 1.6166 1.1287 0.4099
Syringaldehyde-4-O-glucoside 1.1548 1.0157 1.0157 0.9348 1.1651 0.7139
Syringalide A 1.3653 0.8420 1.0066 0.5644 1.4155 0.8061
Syringaresinol 0.5850 0.5610 2.3516 0.3316 2.0537 0.1170
Syringaresinol-4,4^-O-bis-β-D-glucoside; Liriodendrin 0.4074 2.1269 0.7095 0.7239 0.9846 1.0477
Syringaresinol-4^-O-(6^^-acetyl)glucoside 1.3425 0.7977 0.7711 0.1421 2.1482 0.7984
Syringaresinol-4^-O-glucoside 0.6964 0.8529 0.7118 1.5352 1.4090 0.7947
Syringaresinol-4^-O-glucoside; Acanthoside B* 1.2700 0.7886 0.6992 1.0571 1.2591 0.9260
syringaresinol-4-O-β-D-glucopyranoside* 1.1138 1.3902 0.6716 1.5516 0.4720 0.8008
syringetin-3-glucuronide 1.0383 1.1005 0.9764 0.9165 1.0835 0.8848
Syringic acid 0.4447 0.9558 2.0312 0.8863 1.0452 0.6369
Syringin 0.8620 1.0063 0.7534 1.0077 1.1644 1.2062
Syringylglycerol β-sinapyl ether 0.6033 0.7390 1.0035 1.0389 1.1021 1.5132
Tachioside* 0.6112 0.6627 0.8653 1.4552 1.2063 1.1992
Tamarixetin-3-O-rutinoside 1.0275 1.0407 1.0903 0.8414 NA NA
Taxifolin-2-O-glucoside 1.0542 1.1049 0.4599 0.9701 0.9025 1.5085
Taxifolin(Dihydroquercetin) 0.8525 2.1400 NA 0.4928 0.8215 0.6932
Tetrahydro-2-(4-Hydroxy-3-Methoxyphenyl)-6-(Alpha,4-Dihydroxyphenethyl)-4H-Pyran-4-Ol 0.8094 0.8365 0.8908 0.5123 2.1813 0.7697
Tianshic acid 0.4467 0.8062 1.1408 1.5013 0.9378 1.1673
Tortoside A* 0.7414 1.7832 0.7069 1.8755 0.3418 0.5511
Trachelogenin 0.6301 0.8162 0.7958 1.5689 0.8192 1.3697
Tracheloside* 0.5310 0.4967 2.0723 1.0332 0.6117 1.2551
Trehalose 6-phosphate 1.2840 0.8633 0.8866 1.3223 0.8822 0.7616
Tridecanedioic acid 0.9568 1.0742 0.9819 0.9600 0.9428 1.0844
Tuberonic acid glucoside* 0.5530 0.7491 1.6756 1.5889 0.7411 0.6923
Tyr-Abu-OH 0.7954 0.9229 0.8991 1.1570 0.8759 1.3497
TyrMe-Gly-OH 0.6307 1.2043 1.3998 0.7806 1.1044 0.8803
Tyrosol; 4-Hydroxyphenylethanol 0.9287 1.3182 0.8927 2.0386 0.3678 0.4540
Undecanedioic acid 0.9476 1.3668 0.9202 0.7849 0.8970 1.0835
Undecylic Acid 0.8937 1.0106 0.8744 1.1301 0.9074 1.1838
Uracil 0.6407 0.7097 1.7937 1.3094 0.7295 0.8170
Uric acid 0.8517 1.0812 0.5909 0.6423 1.3593 1.4745
Uridine 1.0058 0.7556 1.6557 1.7845 0.2529 0.5455
Uridine 5^-diphosphate 1.5170 0.6507 1.1384 0.9164 0.8667 0.9109
Uridine-5^-Diphosphate-D-Xylose 1.4548 1.1351 0.6454 0.6750 1.0492 1.0406
Uridine 5^-diphospho-D-glucose 1.1628 0.7555 0.6912 0.7527 1.0136 1.6242
Uridine-5^-diphosphoglucuronic acid 1.1460 0.9695 0.7591 0.8638 1.2353 1.0263
Uridine 5^-diphospho-N-acetylglucosamine 1.3633 0.7878 0.5494 0.6754 1.4840 1.1401
Uridine 5^-monophosphate 1.2261 0.7226 1.6431 0.9827 0.5434 0.8820
Urolignoside 0.6359 0.8777 1.4477 1.2257 0.4078 1.4052
Usnic acid 2.7417 2.1648 0.3059 0.4029 0.1569 0.2278
Vanillic acid 0.9019 0.7713 1.4551 0.6596 1.6958 0.5163
Vanillic acid-4-O-glucoside 0.9546 1.2686 0.6624 0.7410 1.2381 1.1354
Vanillic acid methyl ester 1.0297 0.8681 0.6194 0.7495 1.3044 1.4290
Vanillin; 4-Hydroxy-3-Methoxybenzaldehyde* 0.5650 1.1437 1.0744 2.3609 0.5069 0.3490
Vanilloloside 1.2576 0.8490 1.2115 0.7511 1.0689 0.8619
Vanilloyl Galloylglucose 1.6983 1.2330 0.4942 0.0850 1.4448 1.0446
Vanillyl alcohol 0.9174 1.2936 1.1346 1.0246 0.9370 0.6928
Verbascose 0.7307 1.0790 0.2051 1.5700 0.7462 1.6690
Verbasoside 0.9539 1.0563 0.6847 0.7019 1.3064 1.2968
Vibsanin J 0.8321 1.3700 0.7337 1.1286 0.7395 1.1961
Vitexilactone 0.7354 1.5265 0.6970 0.7819 1.0073 1.2519
Vladinol D 0.9890 0.7534 1.1353 1.3599 1.2606 0.5019
Vnilloylcaffeoyltartaric acid 1.0460 1.0294 0.3176 0.5029 1.3526 1.7516
Vnilloylmalic acid 1.0761 0.5592 1.3602 1.3096 0.9978 0.6971
Vnilloyltartaric acid 0.9107 0.7416 1.1674 0.9832 1.3956 0.8015
Xanthine 0.6016 1.5729 1.0102 0.5300 1.2133 1.0720
Xanthosine 1.1238 1.2400 1.2109 0.7424 0.7836 0.8992
Xanthurenic Acid 8-O-Glucoside 0.9144 0.9594 0.9187 0.9637 0.9702 1.2737
Xylitol 5-O-(6^^-O-Galloyl)Glucoside 0.6729 1.2466 1.5211 1.3046 0.4584 0.7963
xylosyl Phellamurin 1.2623 0.7091 0.6461 0.3198 2.3263 0.7364
xylosyl phellodendroside 1.1682 0.5678 0.9618 0.3279 2.5050 0.4693
Xylosyl tachioside 0.8489 0.9511 0.9722 0.9026 1.1441 1.1810
(Z)-3,8-Dihydro 6,6·;7,3^a-diligustilide 0.4180 0.4735 1.5549 0.4877 0.8026 2.2632
α-Ketoglutaric acid 1.0295 0.8731 0.9788 1.0411 1.0514 1.0260
α-Linolenic Acid* 1.2151 1.3193 0.7198 0.6958 0.8455 1.2045
β-Hydroxy-(3,4-dihydroxyphenylethanolyl)-glucoside 0.4317 1.2676 1.7297 1.6445 0.3279 0.5986
β-Hydroxyacteoside 1.0870 0.9195 1.8442 1.8061 0.1587 0.1844
β-Hydroxyisovaleric acid 0.8129 0.8699 1.4165 1.2879 0.8505 0.7624
β-Oxoacteoside 0.8182 0.5690 1.5066 2.3135 0.2772 0.5154
β-Pseudouridine 1.0227 0.7801 1.6144 1.6736 0.3257 0.5835
γ-Linolenic Acid 1.3170 1.4105 0.7017 0.6602 0.8511 1.0594
Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

Factors:

F1Sample source:Plant | Species:Black | Type:Gallery
F2Sample source:Plant | Species:Black | Type:Phloem
F3Sample source:Plant | Species:Green | Type:Gallery
F4Sample source:Plant | Species:Green | Type:Phloem
F5Sample source:Plant | Species:White | Type:Gallery
F6Sample source:Plant | Species:White | Type:Phloem
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