Data for (Study ST004301)

(Analysis AN007163)

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
10,11-Dihydroxy-N-(2-hydroxy-2-methylpropyl)-2,6,8-dodecatrienam-Ide 0.9623 0.7928 1.0733 1.0549 1.3422 0.7745
10-Acetoxyligustroside 0.9078 1.2078 0.8659 1.2649 0.7714 0.9822
10-Acetyligustroside 1.0641 1.0920 0.7964 1.0352 0.7948 1.2175
10-Dehydrogeniposide 0.3157 0.2696 1.7487 2.0334 1.0018 0.6308
(10Z,14E,16E)-10,14,16-Octadecatrien-12-Ynoic Acid 0.9326 1.3300 0.8459 0.8482 1.2560 0.7874
11,12-epoxy-13-hydroxy-3-Oxooleanane-28-oic acid gamma-lactone (Liquidambaric Lactone) 1.2938 1.3169 1.9699 0.3572 0.6348 0.4273
11,12-O-Isopropyfidenesolajiangxin F 0.6798 1.0239 1.2258 1.2884 0.7872 0.9949
1,1^-(6-hydroxy-2,3-dihydro-1H-indene-2,5-diyl)bis(ethan-1-one) 0.7871 0.8588 0.7476 0.9696 1.1190 1.5180
1-18:3-LysoPC 1.7758 1.8427 0.8600 0.2249 0.8726 0.4240
11-methoxy viburtinal 0.9555 1.2701 1.5411 0.7866 0.6548 0.7920
11-O-Syringoylbergenin 1.1395 1.3630 0.7556 NA 0.8449 0.8969
11-O-Vanilloylbergenin 0.5592 0.9311 0.6918 1.1851 1.2649 1.3678
11β-Hydroxy-8,15-isopimaradiene-4-one(ISO3) 1.0334 0.9786 0.9383 1.0801 0.9233 1.0463
1-(2,4,5-Trimethoxyphenyl)propan-1-one 1.4210 0.9030 0.9279 0.8661 0.9701 0.9119
1-(2-Amino-4-methylpentanoyl)pyrrolidine-2-carboxylic acid 0.6362 0.5584 1.3728 2.5619 0.3873 0.4835
12S-HHT 0.6817 2.2048 1.9201 0.5483 0.3687 0.2764
13,28-Epoxyolean-11-en-3-one 1.7594 2.1426 0.4616 0.3890 0.9431 0.3043
1-(3,4-dihydroxy-S-methoxypheny)-7-(4-hydroxyphenyl)hept-1-ene-3,5-diol 0.8235 1.0390 NA 0.7412 NA 1.3963
1,3-O-Dicaffeoylglycerol 1.4282 1.3001 0.7925 0.7294 0.7852 0.9646
14,15-Dehydrocrepenynic acid* 0.9601 1.5442 0.7461 1.0953 0.6303 1.0240
14-Amino-15-hydroxy-11-methylpentadecanoic acid 1.0229 0.9217 0.9091 1.1439 0.8952 1.1072
1,4-Benzodioxin-6-propanol 0.9498 0.9481 0.9642 1.0579 0.9209 1.1591
(14-Ethyl-4,6,19-trimethoxy-9,11-dioxa-14-azaheptacyclo[10.7.2.12,5.01,13.03,8.08,12.016,20]docosan-21-yl)acetate 1.1300 0.9535 0.6914 0.8860 1.3745 0.9647
1-(4-hydroxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-4-ene-3-heptanone 1.0610 0.7114 1.0944 1.6324 0.7803 0.7206
14-Nor-β-patchoulane-1(5)-ene-2,4-dione 1.0494 0.5970 2.0759 0.2923 1.4470 0.5384
15(R)-Hydroxylinoleic Acid 0.8648 1.3443 0.8565 0.5638 1.5858 0.7847
16-oxo-21β-hydroxyserrat-14-en-3α-yl acetate 1.1566 0.5507 1.6343 0.5121 1.9291 0.2171
1,7-Bis-(3,4-dihydroxyphenyl)-5-methoxy-3-heptanone 1.3182 1.1332 0.4167 0.6664 1.0869 1.3786
1,7-bis(4-hydroxy-3-methoxyphenyl)hept-1-ene-3-ol 1.0957 0.9585 1.4256 1.1603 0.7884 0.5715
1,7-Dimethylxanthine 1.2920 1.1974 1.0134 1.1796 0.5546 0.7630
1,8-dimethyl-1,3a,8,8a-tetrahydropyrrolo[2,3-b]indole 0.8482 0.7862 0.7012 1.1094 1.1091 1.4460
19-Hydroxy-2-(hydroxymethyl)-A(1)-norursa-2,12-dien-28-oic acid (Coleonolic acid) 2.0963 0.6414 0.9804 0.1737 1.5947 0.5136
19-Hydroxy-3-oxo-24-norolean-12-en-28-oic acid 1.7815 0.6653 1.7048 0.4413 1.1728 0.2343
1-(9Z,12Z-Octadecadienoyl)-Sn-Glycero-3-Phosphocholine 1.1559 1.1278 1.1225 0.6280 0.9988 0.9672
(1-Acetyl-5-methoxyindoline-2-yl)acetonitrile 0.9610 0.9922 0.9260 NA 1.1207 NA
1-Aminocyclopropane-1-carboxylic acid* 1.1444 0.8819 0.9336 1.2960 0.7606 0.9835
1-beta-D-Arabinofuranosyluracil 0.8238 0.7802 1.7640 1.3848 0.5412 0.7060
1-Cis-5-cis-germacrone 1.4033 0.6669 2.2437 0.2240 1.1006 0.3615
1-Methoxy-indole-3-acetamide 1.7538 0.7752 0.9866 1.3249 0.4541 0.7055
1-Methyladenine 1.1701 0.9444 0.8818 0.9902 1.0845 0.9290
1-Methylguanidine 1.1190 0.8716 1.2490 1.3532 0.6343 0.7729
1-Methylhistidine 0.8686 1.0671 1.0981 0.7980 1.2083 0.9598
1-Methylxanthine 0.9863 1.1508 0.8395 1.0653 0.7677 1.1904
1-Monomyristin 1.1098 1.0851 1.0693 1.1469 0.7477 0.8412
1-O-Caffeoylglycerol 1.3148 1.1491 0.4906 0.9946 0.6414 1.4095
1-Oleoyl-Sn-Glycerol 0.8919 0.6493 1.3962 1.6887 0.4155 0.9584
1-((Pentanoyl)phloroglucinyl]-β-D-glucopyranoside 1.0500 1.0339 0.9132 0.9423 0.9112 1.1495
1-phenyl-7-(4-hydroxyphenyl)-4-ene-3-heptanone 1.1191 1.0249 1.0035 1.0915 1.1417 0.6193
(1R,2R)-2-hydroxy-1-methyl-2,3-dihydro-1H-indene-5-carboxylic acid 1.1488 0.9572 1.1058 1.0444 0.8102 0.9336
(1S,3R,3a1S,8R,10S,11aS)-1,5,10-trihydroxy-3,3a1,8,11a-tetramethyl-2,11-dioxohexadecahydrodibenzo[de,g]chromen-4-yl acetate 0.9763 0.6528 1.3896 1.6308 1.0279 0.3227
1-Stearidonoyl-Glycerol 0.6979 2.8806 0.5598 0.7652 0.3684 0.7281
1-α-Linolenoyl-glycerol* 1.5350 1.2595 0.4940 0.9718 0.8782 0.8614
1β-hydroxy-β-cyperone 1.4240 0.2957 3.1604 0.2957 0.6943 0.1299
2,19-Dihydroxy-3-oxo-24-norolean-12-en-28-oic acid* 1.7175 1.2454 1.2870 0.1102 1.2512 0.3888
2,3,19-Trihydroxy-24-oxo-olean-12-en-28-oic acid 1.3159 0.5550 1.8456 0.1691 1.9511 0.1633
2,3,19-Trihydroxyolean-12-en-28-oic acid (Arjunic acid) 1.6154 1.1206 1.4261 0.1149 1.4340 0.2889
2,3,4-Trihydroxybutyl 6-O-(E)-caffeoyl-β-D-glucopyranoside 0.8570 1.3347 0.6950 1.1560 0.8825 1.0748
2,3-cis-4-(3,4-hydroxyphenyl)-2,3-dihydro-2,3-dihydroxyphenalen-1-one 0.6408 0.4316 0.9496 2.7851 0.7435 0.4494
2,3-Dihydro-1,4-naphthoquinone 0.9578 0.9619 0.9611 1.0349 0.9305 1.1538
2,3-Dihydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)propan-1-one 0.8556 2.7221 0.7220 0.5753 0.6395 0.4855
2,3-Dihydroxylup-20(29)-en-28-oic acid 1.9593 0.6868 1.5260 0.1203 1.3746 0.3330
2,3-Dihydroxyurs-12,18-dien-28-oic acid (Goreishic Acid I) 2.2071 0.6926 1.0944 0.2067 1.3156 0.4835
2,3-Dihydroxyurs-12-en-29-oic acid (Maslinic acid) 1.7729 0.5572 1.2604 0.2185 2.0265 0.1645
2,4,2^,4^-tetrahydroxy-3^-prenylchalcone 0.6844 0.7567 1.4745 1.3187 1.1169 0.6488
2-(4-((6,7-dihydroxy-5-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl)phenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol 0.8182 0.6427 1.1526 1.2173 1.2013 0.9679
2,4,6-Trihydroxybenzoic acid 1.0123 1.0672 0.7512 0.5182 1.3825 1.2686
2,4,6-Trihydroxybenzophenone 1.0613 0.9879 0.6165 0.7780 1.0284 1.5279
2,4-Dihydroxy-6-methoxyacetophenone 1.2140 1.0422 0.9883 0.8763 0.7387 1.1405
2^,4^-Dimethylacetophenone 1.0543 1.0027 0.8258 1.0933 1.0373 0.9866
2,4-Hexadienoic acid 0.6365 0.5994 1.3503 1.0975 0.9675 1.3487
24-Hydroxy-3-oxooleana-11,13(18)-dien-28-oic acid 1.3274 0.7334 2.2727 0.1797 1.2725 0.2143
2-(4-Methoxyphenethyl)-5,6:7,8-Diepoxy-5,6,7,8-Tetrahydrochromone 0.9049 0.7945 1.1035 1.1561 NA 1.0410
2,5-Bis(1,3-benzodioxol-5-yl)-3,4-dimethyloxolane-2,3-diol 0.6355 0.5543 2.2488 0.8333 1.4177 0.3105
2,5-Dimethoxybenzoquinone* 0.6314 0.9321 0.6920 0.8830 0.9705 1.8909
2,5-Dimethyl-7-hydroxychromone 0.8942 0.9790 0.9606 0.9471 1.0574 1.1617
2,5-Dimethyl pyrazine 1.1915 1.4084 0.7818 0.5972 0.9003 1.1208
2,6-Diaminooimelic acid 0.8121 1.0111 1.4106 1.1298 0.7601 0.8763
2,6-Dihydroxy-4-isopropylphenyl-1-O-β-D-glucoside 1.1667 1.3233 0.5869 0.8469 1.0192 1.0571
2,6-Dimethoxy-1,4-benzoquinone* 0.9868 0.6225 0.9499 0.9102 1.2025 1.3282
2,6-Dimethoxy-4-(7-methoxy-3-methyl-5-prop-1-enyl-2,3-dihydro-1-benzofuran-2-yl)phenol* 1.0373 2.3698 0.9234 1.2039 0.2374 0.2282
2,6-Dimethoxypydroquinone-1-O-glucoside 0.8337 0.9608 0.7192 0.8054 1.2988 1.3821
2,6-Dimethyl-6-hydroxy-2,7-octadienyl-β-D-glucoside (Betulalbuside A; Betulabuside A) 0.6529 0.9656 0.7122 1.0793 1.1449 1.4451
2-(Acetylamino)-3-phenyl-2-propenoic acid 1.4681 1.4332 0.8798 0.7103 0.8450 0.6637
2-amino-3-(1H-pyrazol-1-yl)propanoic acid 0.8594 0.9883 0.7697 2.2495 0.4168 0.7163
2-Amino-3-methoxybenzoic acid 0.9850 0.9374 1.4202 0.9491 0.8558 0.8523
2-Amino-7-methyltridecan-1-ol* 0.9589 1.0387 0.9907 0.9889 1.0609 0.9619
2-Aminoadenosine 0.7812 1.0658 0.7658 0.8841 1.2386 1.2645
2-aminodocoSane-1,5,7,21-tetraol 1.0661 0.9477 1.0045 0.9997 1.0033 0.9787
2-aminodocoSane-1,6,19,20,21-pentaol 1.0093 0.9981 0.9390 1.0045 1.0508 0.9981
2-Aminododecane-1,3,4-triol 1.0578 0.9416 0.9333 1.0797 0.9265 1.0612
2-Aminododecane-1,4-diol 1.0858 0.9960 0.9545 1.0006 1.0075 0.9557
2-Aminohexadecane-1,16,16-triol 1.0559 0.9368 0.9648 1.0826 0.9490 1.0109
2-Aminohexadecane-1,4-diol* 1.0371 1.0183 0.9688 0.9982 1.0147 0.9629
2-Aminohexadecane-1,5,15-triol 0.9311 1.0343 0.9908 0.9926 1.0036 1.0475
2-Aminohexadecane-1,5,6-triol 1.0819 0.9564 0.9615 1.0926 0.9093 0.9982
2-AminoicoSane-1,5,19-triol 1.0415 1.0364 0.9638 0.9804 1.0022 0.9758
2-AminoicoSane-1,5,7,19-tetraol 0.9157 1.0272 1.0375 1.0573 0.9939 0.9683
2-AminoicoSane-1,6,18,19,20-pentaol 1.0282 0.9312 1.0587 1.0836 0.9367 0.9617
2-Aminoisobutyric acid* 1.1581 1.0700 0.8433 1.1442 0.7371 1.0473
2-Aminooctadecane-1,16,18,18-tetraol 1.0363 0.9448 1.0105 1.1020 0.9293 0.9770
2-Aminooctadecane-1,4-diol 1.0214 1.0249 0.9751 0.9896 1.0110 0.9780
2-Aminooctadecane-1,5,7,17-tetraol 1.0409 0.9139 0.9733 1.1027 0.9614 1.0077
2-Aminophenol 0.7929 1.2356 1.1193 0.9628 0.9525 0.9369
2-Aminopurine 1.7112 1.2723 0.5800 0.8702 0.5075 1.0588
2-Aminotetradecan-1-ol* 0.9388 1.0750 1.0092 0.9849 1.0382 0.9539
2-Aminotetradecane-1,11,13-triol 1.0439 1.0036 0.9395 1.0014 1.0569 0.9547
2-Aminotetradecane-1,4-diol* 0.9973 1.0203 0.9705 0.9977 1.0420 0.9722
2-Aminotetradecane-1,5,11-triol 1.0699 0.9462 0.9221 1.1076 0.9221 1.0321
2-Aminotetradecane-1,5,13-triol 1.0589 0.9724 0.9418 1.0128 1.0414 0.9727
2-Aminotetradecane-1,5,7,11-tetraol 1.1267 0.9302 0.9058 1.0884 0.9551 0.9939
2-benzoyl-4-[(2r)-1-hydroxy-7-methyl-3-methylideneoct-6-en-1-yl]benzene-1,3,5-triol 1.2526 0.9194 1.1284 1.0978 0.9649 0.6369
2^-Deoxyadenosine* 0.9386 0.5427 1.7170 1.1075 1.0651 0.6290
2^-Deoxyadenosine-5^-monophosphate 1.0874 0.8719 1.1337 0.6500 1.2144 1.0426
2^-Deoxycytidine 0.8034 0.9091 0.7630 0.8862 1.4055 1.2328
2^-Deoxyinosine-5^-monophosphate 1.1813 0.8475 1.0461 0.9199 1.2487 0.7565
2-(Dimethylamino)guanosine* 1.0046 0.8452 1.8628 0.9851 0.6103 0.6920
(2E)-3-(1-Hydroxy-2,6,6-trimethyl-4-oxo-2-cyclohexen-1-yl)-2-propenoic acid 1.3081 1.1721 0.8598 0.6578 1.1447 0.8574
(2e)-3-(4-hydroxyphenyl)-n-[2-(4-hydroxyphenyl)ethyl]prop-2-enimidic acid* 1.0393 0.6486 1.3553 0.3253 2.0924 0.5392
2-Feruloyl-sn-glycerol 0.7049 0.5244 3.0133 0.4680 0.7767 0.5127
2-Hydroxymethyl-A(1)-nor-19,24-dihydroxyurs-2,12-dien-28-oic acid (Rosamultic acid)* 2.0691 0.7018 1.7257 0.1639 1.1249 0.2146
2-Methoxy-4-ethenylphenol 0.9355 1.0033 0.7564 1.0331 1.0412 1.2304
2-Methyl-3-hydroxyindan-1-one 0.8067 0.9334 0.9026 0.9713 1.0833 1.3026
2-Methyl-5-acetonyl-7-hydroxychromone glucoside 1.0342 0.9507 0.9821 1.0769 1.0603 0.8959
2^-O-Methyladenosine 0.6622 0.5382 1.5834 1.8525 0.6894 0.6743
(2-Oxo-5-methoxyindoline-1-yl)carbamic acidmethylester 1.3476 1.2661 0.4941 0.6137 0.9827 1.2958
2-Palmitoylglycerol* 0.9258 0.6641 1.6957 0.9375 1.2736 0.5032
2-Pentyl-3-phenyl-2-propenal 1.0876 0.9567 0.9468 1.0917 1.0782 0.8390
2-Phenylaminoadenosine 0.6039 0.7964 1.2531 0.7208 1.7064 0.9194
2-Phenylethy-1-O-β-D-glucoside 1.4173 0.8262 0.9881 1.1056 1.0656 0.5973
(2R)-3-(3^,4^,5^-trimethoxyphenyl)-1,2-propanediol 0.4303 0.7159 0.1406 NA 3.5878 0.1254
(2R)-4^,7-dihydroxy-5-methoxy-8-methylflavanone 1.2429 1.0280 0.6517 0.7886 1.0866 1.2023
(2S)-2-[(1R)-1-carboxyethoxy]propanoic acid 1.0386 1.2256 0.8631 0.7552 1.0952 1.0223
(2s)-2-[(5s)-5-hydroxyhexa-1,3-dien-1-yl]-5-methoxy-4-[(3r)-3-methoxybutanoyl]-2-methylfuran-3-one 0.7352 0.7619 1.9040 1.6768 0.4449 0.4772
(2S)-5,7-dimethoxy-3^,4^-methylenedioxyflavanone 0.9446 1.0036 1.1046 1.0474 1.2323 0.6675
2-tert-Butyl-1,4-benzoquinone 0.8825 1.1592 0.9061 0.8974 1.3069 0.8479
2-α-Linolenoyl-glycerol* 1.6074 1.2367 0.5786 1.1301 0.6792 0.7680
30-Hydroxyfraxinellone 1.0300 1.4929 0.3169 1.0452 0.9905 1.1245
3,12-Dihydroxyoleanan-28,13-olide (Oleanderolide) 1.6392 0.6026 1.8171 0.2241 1.5287 0.1883
3,3^-Bis(3,4-dihydro-4-hydroxy-6,8-dimethoxy-2H-1-benzopyran) 1.4325 1.4428 0.7083 1.0672 0.8558 0.4933
3-(3^-Hydroxybutyl)-2,4,4-trimethylcyclohexa-2,5-dienone glucoside* 1.7795 1.1424 0.3669 0.6817 1.2593 0.7702
3-(3-Hydroxyphenyl)-propionic acid 1.2250 0.9993 0.7098 0.8482 1.0766 1.1412
3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-ol 1.4121 1.1439 0.8355 0.5661 1.1059 0.9365
3,4,5-trihydroxy-5-[4-(prop-2-enoyloxymethyl)phenoxy]oxane-2-carboxylic acid 0.7578 0.6739 0.8041 1.1399 1.7600 0.8643
3,4,5-Trihydroxy-6-[1-(4-methoxyphenyl)pentan-3-yloxy]oxane-2-carboxylic acid* 1.1622 1.2636 0.9519 0.9463 0.7342 0.9417
3,4,5-Trihydroxy-6-[4-(4-methyl-3-oxopentyl)phenoxy]oxane-2-carboxylic acid 1.0610 1.4987 0.5515 0.3888 1.2135 1.2865
3,4,5-trihydroxy-6-(4-octylphenoxy)oxane-2-carboxylic acid 1.2724 0.9089 1.1736 1.0266 1.0266 0.5919
3,4-Dehydro-DL-proline 1.1591 0.8650 1.8877 0.8368 0.7715 0.4799
3,4^-Dihydroxy-3^,5^-dimethoxypropiophenone 1.1182 0.8502 1.4075 0.4038 1.8310 0.3893
3,4-Dihydroxy-L-phenylalanine (L-Dopa) 0.7058 0.6135 0.8379 0.9446 1.5978 1.3005
3,4-dihydroxy phenylethanol 1.2726 1.2308 1.2840 0.5590 0.9293 0.7243
3,4^-Dihydroxypropiophenone glucoside 0.8446 0.8992 0.7676 1.3751 0.9986 1.1150
3,4-Dimethoxybenzoic acid; Veratric acid 0.7624 1.0479 1.3765 1.2422 NA 0.5710
3-(4-hydroxy-2,6-dimethoxyphenyl)-1-(4-methoxyphenyl)propan-1-one 0.9618 0.9846 0.9430 0.6753 1.2494 1.1859
3-(4-hydroxybenzene)-5,7-dihydroxy-6-methoxychroman-4-one malonyl glucoside 0.9844 1.0495 0.6990 0.7318 1.2394 1.2959
3-(4-hydroxyphenyl)-3-oxopropyl beta-D-glucopyranoside 0.8615 0.8568 0.6925 1.3145 0.8865 1.3883
3-(4-methoxyphenyl)propyl methyl 4-O-methyl-alpha-d-glucopyranosiduronate* 1.0229 1.0808 0.5897 0.7448 0.9391 1.6228
3,4-Methylenedioxycinnamaldehyde 0.9981 1.0226 0.9051 1.0193 1.0356 1.0193
3,4-Methylenedioxy cinnamyl alcohol* 0.9036 1.2918 1.0133 1.3566 0.8307 0.6040
3,4-O-Dicaffeoylquinic Acid Methyl Ester* 1.0838 0.9976 0.9604 1.1080 1.0237 0.8266
3,4-Secodammara-4(28),20,24-trien-3,26-dioic acid 1.9543 0.9116 1.0562 0.2086 1.4954 0.3740
3^,5,5^,7-Tetrahydroxyflavanone-7-O-glucoside* 0.9575 1.3416 0.6903 0.8549 0.9160 1.2396
3,5,7,4^-Tetrahydroxy-Coumaronochromone 0.8057 1.1736 1.3051 0.8351 1.0263 0.8540
3,5-Diacetyltambulin 0.9078 1.0976 0.7405 1.2264 0.8862 1.1415
3,5-Dihydro-2H-Furo[3,2-C]Quinolin-4-One* 1.9271 0.8547 0.9276 1.2362 0.4105 0.6439
3,5-Dimethoxy-4-hydroxybenzaldehyde 0.7747 0.5630 3.2814 0.3482 0.6592 0.3736
3,5-Dimethyl-2,3-dihydrobenzofuran 0.8860 0.8861 1.3235 1.0504 1.0629 0.7909
3,5-O-Dicaffeoylquinic Acid Methyl Ester* 1.0838 0.9976 0.9604 1.1080 1.0237 0.8266
3,7,11-trimethyl-2-oxa-6,10,13-triazatricyclo[7.3.1.05,13]tridecane 0.9819 0.9307 0.9529 1.0032 1.1019 1.0293
3,7-Dihydroxychromen-4-one 1.1653 0.7290 0.9409 1.0222 1.0969 1.0458
3-(Allylsulphinyl)-L-alanine 0.9156 0.9718 1.0641 0.8431 1.1362 1.0692
3-amino-2-naphthoic acid* 1.8399 0.8926 1.0197 1.2197 0.3663 0.6617
3-Chloroaniline 0.7469 1.0506 0.2450 0.6024 1.5649 1.7901
3-(Cyclohexen-1-yl)-2-hydroxy-4a,5-dimethyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one* 0.8281 1.5649 0.7640 1.1722 0.6503 1.0206
3-Deaza-2^-deoxyadenosine 0.6765 0.7065 0.5541 0.7735 1.5267 1.7627
3-Dehydrosphinganine 0.2522 0.5230 0.8197 3.9331 0.2352 0.2368
3^-Deoxy-4-O-methylsappanol 0.9977 0.8929 1.3689 1.0170 0.7349 0.9886
3-Ethyl-7-hydroxyphthalide 0.9252 0.9418 0.8787 1.2014 1.0484 1.0046
3-Hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)propan-1-one 1.1008 1.1093 1.3193 0.7645 1.0633 0.6427
3-Hydroxy-1-methoxy-9,10-anthraquinone 1.0578 1.2712 0.7872 0.8643 1.0810 0.9385
3-hydroxy-1-methylpyrrolidin-2-one* 0.7319 0.7883 1.4990 1.5231 0.5856 0.8722
3-Hydroxy-23-oxoolean-12-en-28-oic acid (Gypsogenin) 1.4917 0.6958 1.9379 0.5148 0.9703 0.3896
3-Hydroxy-3,7,11-trimethyldodeca-1,6E,10-trien-9-yl isobutyrate 0.9135 1.2454 0.7702 0.8732 1.2832 0.9145
3-Hydroxy-4H-pyran-4-one 0.9281 0.9316 0.9999 0.9655 1.0707 1.1041
3-Hydroxyanthranilic acid 1.0923 0.7201 0.9873 1.0146 1.1043 1.0813
3-hydroxybenzaldehyde 1.2115 1.0116 1.0487 0.8979 0.9311 0.8991
3-Hydroxy-beta-ionol 3-(6^^-Malonyl)Glucoside 1.4454 0.7999 1.2607 NA 0.7153 0.7787
3-Hydroxy-L-phenylalanine* 0.7342 0.9129 0.8434 1.9379 0.6092 0.9624
3-hydroxylup-12(13),20(29)-diene 1.7513 0.6655 1.6901 0.2557 1.4499 0.1875
3-Hydroxyolean-12-ene-28,29-dioic acid (Serratagenic Acid)* 1.3861 0.8750 1.5801 0.1520 1.7602 0.2465
3-Hydroxyurs-5(6),12,18(19)-trien-28-oic acid (Uncargenin B) 1.7184 0.8450 1.5054 0.0926 1.5731 0.2654
3-Indoleacrylic acid* 2.0170 0.7210 1.0513 1.1699 0.3807 0.6601
3-Indolepropionic acid 1.6119 0.7201 1.0020 1.1572 0.5088 NA
3^-Methoxy-6^^-O-xylosyl puerarin 1.2697 1.0869 0.7643 0.4658 1.4446 0.9687
3-Methylxanthine 1.0378 1.1155 0.9148 1.0244 0.7545 1.1530
3-O-Acetylnarcissidine 1.1668 1.2148 1.6327 0.6802 1.0049 0.3007
3-O-caffeoyl quininyl arabinoside 1.1328 0.8225 0.8614 0.9963 1.0476 1.1394
3-O-Cinnamoyl-4,6-(S)-HHDP-β-D-glucose 1.2428 1.0277 0.7164 0.6488 1.4664 0.8979
3-Oxooleana-11,13(18)-dien-28-oic acid 1.3116 0.5604 1.5571 0.1906 1.9048 0.4755
3-Oxo-α-ionol-β-D-glucoside* 0.8135 1.0528 0.8795 1.2054 1.1421 0.9066
3-Prenyl-4,2^,4^-Trihydroxychalcone 0.7491 0.8532 1.0604 1.6860 1.0168 0.6345
(3r,4r)-3-(2h-1,3-benzodioxol-5-ylmethyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one* 0.5304 0.5082 2.0515 1.6253 1.0007 0.2840
(3R,4R)-p-Menth-1-ene-3,4-diol-3-O-β-D-glucoside* 0.7417 0.6591 0.8161 0.9306 1.1259 1.7265
(3R,4S,6R)-p-Menth-1-ene-3,6-diol-3-O-β-D-glucoside* 1.0356 0.7143 1.5029 0.9371 0.8101 NA
(3S)-1,3-dihydroxy-2,3,3a,4-tetrahydropyrrolo[2,1-b]quinazolin-9(1H)-one 1.1305 1.1241 0.8884 0.8325 1.1471 0.8773
3α,20β,21β-trihydroxy-16-oxo-serrat-14-en-24-oic acid 0.7863 0.5455 2.1282 0.5299 1.6692 0.3408
3ξ-(1ξ-hydroxyethyl)-7-hydroxy-1-isobenzofuranone 1.1804 1.1334 0.7968 0.7185 1.0508 1.1201
4,4^-dihydroxy-2^-methoxychalcone 0.9538 0.8423 0.9880 1.3591 0.8193 1.0375
4,6-Dihydroxyquinoline 0.9002 0.8871 0.8669 0.9751 1.1390 1.2317
4,6-dimethoxy-2-methoxyphenyl-1-O-beta-D-glucopyranoside 0.7657 0.9925 0.6621 0.6976 1.3463 1.5358
4-((6S)-6-(furan-3-yl)-3-(hydroxymethyl)piperidin-2-yl)-2-methylbutan-2-ol 0.7670 0.7940 1.4636 1.7296 0.7392 0.5065
4,8-Dihydroxy Naphthol-1-O-glucoside 0.9829 0.6302 1.2895 1.2055 0.9264 0.9654
4-Aminoindole 1.5592 1.5753 0.3863 0.3721 0.8524 1.2548
4-Ethoxyphenol 1.3577 1.5599 0.8590 0.4783 0.8165 0.9287
4-Guanidinobutyric acid 1.2798 1.0779 0.9333 1.2240 0.7315 0.7535
4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid 0.9067 0.9016 1.1765 0.9193 0.9660 1.1299
4^-Hydroxy-5,6,7,8,3^,5^-Hexamethoxyflavone O-Glucoside 0.9707 1.0444 0.7241 0.9064 1.0173 1.3370
4-Hydroxy-L-Isoleucine 1.1798 0.8899 1.0007 1.2157 0.7341 0.9798
4-Hydroxy-L-phenylglycine 0.9704 1.0548 0.8341 0.7966 1.1145 1.2295
4-Hydroxymandelonitrile 0.9746 0.6009 1.1241 1.8005 0.5963 0.9035
4-hydroxyphenyl acrylaldehyde 0.7157 1.1500 1.0919 1.1436 0.9007 0.9981
4-Hydroxysphinganine; Phytosphingosine 0.2526 0.5075 0.7809 4.0000 0.2228 0.2361
4^-Methoxyacetophenone 0.8994 1.5050 0.9683 0.9830 0.6737 0.9706
4-Methoxybenzaldehyde 1.0797 1.0216 0.6554 1.0134 1.1060 1.1240
4-MethoxycinnaMaldehyde 1.1082 1.2092 1.2347 0.8817 0.7996 0.7666
4-methyl-1,5,2,3-dioxadiazinan-2-amine 0.5120 0.4013 1.4652 1.5136 0.8990 1.2088
4-Methylazetidine-2-Carboxylic acid* 0.7389 0.7694 1.5185 1.5531 0.5784 0.8417
4-Nitrophenol 0.9945 1.0031 0.9829 0.8612 1.1428 1.0155
4-O-Sinapoylquinic acid 0.7949 0.6159 2.3353 1.1132 0.7043 0.4363
4-Pyridoxic acid-O-glucoside 1.0673 0.9111 1.2941 0.8275 1.0411 0.8590
(4R)-4,5-dihydroxy-alpha-tetralone 1.1533 0.8967 0.8242 0.7672 0.8524 1.5062
5,2^-Dihydroxy-7,8-dimethoxyflavone glycoside* 1.1367 1.1498 0.5514 0.6452 1.1694 1.3476
5,6,3^,4^-Tetrahydroxy-3,7-dimethoxyflavone-6-O-glucoside 1.0495 1.0513 0.8372 0.7628 0.9693 1.3299
5,6-Dihydro-5-methyluracil 0.8489 0.8741 0.9029 1.8531 0.7601 0.7609
5,7-dihydroxy-3-(4^-hydroxybenzyl)-chroman-4-one 0.5611 NA 1.0359 1.2047 1.3348 0.8634
5,7-Dihydroxy-4-methylcoumarin 1.1497 0.9554 1.0275 1.1607 0.6909 1.0157
5,7-dihydroxy-6-methyl-3-(2^,4^-dihydroxybenzyl)-chroman-4-one 0.7944 1.3407 1.6288 0.4984 0.8562 0.8815
5,7-Dihydroxychromone glucoside 1.0561 1.0893 0.5996 0.7892 1.0726 1.3932
5,8-Dihydroxy-1,4-naphthoquinone 1.0514 1.1484 0.9504 1.0576 0.9211 0.8712
5-Acetonyl-6-glucosyl-7-hydroxy-2,6-methylchromone 0.8765 0.9369 0.8548 1.1458 1.0655 1.1205
5-Acetylsalicylic acid 0.9503 1.1235 0.9767 1.0923 0.7615 1.0957
5-Aminoimidazole ribonucleotide 1.1844 0.8133 1.3688 0.2478 1.6571 0.7285
5-Aminolevulinic Acid* 0.9944 0.9079 1.3983 1.8586 0.3745 0.4662
5^-Deoxy-5^-(methylthio)adenosine 1.4878 1.1659 0.9189 1.2092 0.5660 0.6523
5^-Deoxyadenosine* 1.1374 0.6150 1.3419 1.4580 0.9887 0.4589
5-ethyl-6-hydroxy-7-((7-hydroxyhexahydro-1H-pyrrolizin-1-yl)methoxy)-6-methyl-7-oxoheptanoic acid 1.2994 1.3896 0.7619 1.0693 0.6182 0.8616
5-Hydroxy-1-tetralone 1.3215 1.2119 0.8927 0.8185 0.8373 0.9180
5-Hydroxy-2-pyrrolidinone 1.2295 0.8225 0.9915 1.1652 0.8292 0.9621
5-hydroxy-6,7-dimethoxy-2-[2-(4^-methoxyphenyl)ethyl]chromone 0.7825 0.7889 1.1314 1.1137 1.0095 1.1740
5-Hydroxy-DL-tryptophan(5-HTP) 0.7847 0.6855 0.7687 0.7379 1.3068 1.7164
5-hydroxyindene-1,3-dione 1.0066 1.0066 0.9358 0.9880 0.9685 1.0944
5-Hydroxymethylfurfural* 1.0967 1.0967 0.9082 0.8623 0.9506 1.0855
5-Hydroxytryptophol 0.9621 1.0338 1.0342 0.9803 0.8606 1.1289
(5-Methoxy-1,3-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetonitrile 0.8852 0.8517 0.9025 1.0583 1.1518 1.1506
5-Methoxy-DL-tryptophan 0.8142 1.0973 0.9744 0.7656 1.1196 1.2289
5-Methoxyfurfural* 1.1279 1.1902 0.8584 0.8996 0.9786 0.9453
5^-Methoxylariciresinol 1.1001 0.9019 0.8930 0.9153 1.1130 1.0766
5-Methoxysalicylic acid 0.9034 0.8955 1.6802 0.7354 1.0925 0.6929
5-Methylcytosine 1.1707 0.8895 1.4210 0.5949 1.0194 0.9044
5-O-β-D-Glucopyranosyl-3-hydrobenzo(b)fu-ran-2-one 0.6750 0.9058 0.6648 0.6494 1.3623 1.7427
(5R,6S,7R)-5-(3,4,5-Trimethoxyphenyl)-7-methyl-8-oxo-5,6,7,8-tetrahydronaphtho[2,3-d]-1,3-dioxole-6-carboxylic acidethylester 0.8858 1.1100 0.6460 1.2692 0.8941 1.1949
6,7-dimethoxy-2-[2-(4^-hydroxy-3^-methoxyphenyl)ethyl]chromone* 0.5470 0.5163 1.9794 1.6807 0.9847 0.2918
6,9-Dihydroxy-7-megastigmen-3-one 0.7979 1.0750 1.5201 0.7893 0.9191 0.8984
6-Aminocaproic acid 1.0881 0.8809 1.7841 1.6212 0.2773 0.3484
6-Chloropurine 1.1244 0.8157 0.7809 1.2813 0.8037 1.1940
6-C-MethylKaempferol-3-glucoside* 0.7789 0.7722 0.8880 1.0091 1.3082 1.2436
6-Deoxyfagomine 1.1676 0.8617 1.7271 1.5930 0.2924 0.3582
6-hydroxy-2-[2-(3-hydroxy-4-methoxyphenyl)ethyl]chromone 1.2390 1.2367 0.7358 0.9454 0.7871 1.0559
6-Hydroxy-3-oxooleana-11,13(18)-dien-28-oic acid 1.8286 0.8405 1.0675 0.3723 1.6764 0.2146
6-Hydroxy-7-Methoxy-2-[2-(3^-Hydroxy-4^-Methoxyphenyl)Ethyl]Chromone 1.2692 1.7071 0.7439 0.6157 0.8198 0.8444
6-Hydroxy-7-methoxycoumarin* 0.9929 0.9411 0.8739 0.7602 1.4668 0.9650
6-hydroxycoumarin 0.8173 0.9283 1.0903 1.0338 1.1431 0.9872
6-Hydroxy-lupane-20(29)-en-3-one-28-oic acid 2.0101 1.2419 0.9795 0.3110 1.0878 0.3696
6-Hydroxypseudooxynicotine O-glucoside 1.0226 1.2455 0.8259 0.8782 1.0965 0.9314
6-Methoxyquercetin-3-O-Xyloside 1.3185 0.4046 2.5868 0.8371 0.6033 0.2498
6-Methylnicotinamide 1.6607 0.9224 0.7170 0.7354 0.8022 1.1624
6-O-methylguanine 0.8233 0.8632 1.6179 1.5815 0.6902 0.4240
(6S)-2-Methyl-6-[(1R,5S)-(4-methene-5-hydroxyl-2-cyclohexen)-2-hepten-4-one 0.5486 0.0700 4.6780 0.0256 0.5890 0.0887
6β-Hydroxy-8α-methoxyeremophila-1(10),7(11)-dien-12,8β-olide* 1.2605 0.9878 0.9057 0.9291 1.0743 0.8426
7-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-6-methoxychromen-2-one 0.0764 0.0503 5.6216 0.0664 0.1493 0.0358
7,8-Dihydrofurocoumarin 0.2231 0.0685 5.2803 0.1065 0.2543 0.0673
7-Ethoxy-4-hydroxy-3,4-dihydroisochromen-1-one 0.8872 0.7596 1.8503 0.7269 1.3588 0.4171
7-Hydroxy-4-chromone 1.4825 1.1571 0.9508 0.4763 1.1399 0.7933
7-Hydroxycoumarin;Umbelliferone 1.3270 1.0388 1.3938 1.3948 0.4668 0.3786
7-Methoxycoumarin 0.9331 0.7704 1.5590 0.9238 0.7169 1.0967
7-Methylguanine 1.0275 0.8502 1.3085 1.1378 0.7407 0.9354
7-oxo-11-Dodecenoic acid 0.5584 0.6762 1.0158 1.4257 1.0243 1.2997
(7^R,8^R)-7^8^-dihydro-7^-(5^-hydroxy-3^-methoxphenyl)-3-methoxy-8^-methyl-1-(E)-propenylbenzof-uran 0.9839 0.8875 1.3653 1.2681 0.6671 0.8281
(7R,8S)-9-acetyl-dehydrodiconiferyl alcohol 0.9274 1.1601 0.9293 0.8103 0.8131 1.3597
8-[3-oxo-2-[(E)-pent-2-enyl]cyclopenten-1-yl]octanoic acid 0.8613 1.1307 1.0478 1.1621 1.0969 0.7011
8-Azaguanine 0.8791 0.7618 1.5822 1.4348 0.6368 0.7053
8-hydroxy-1,4a-dimethyl-7-(prop-1-en-2-yl)-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one 0.4503 0.3100 4.5520 0.1472 0.3778 0.1627
8-hydroxy-2,3,3,9-tetramethyl-2h-furo[3,2-c]chromen-4-one 0.0161 0.0117 5.8558 0.1034 0.0073 0.0058
8-Hydroxy-5,5-dimethylpeltogynan 0.3107 0.4433 3.7777 0.3703 0.5387 0.5592
8-Hydroxycoumarin 1.9061 1.2341 0.8492 0.3941 0.6891 0.9272
8-hydroxyquinoline 1.8274 0.7381 1.0349 1.3108 0.4110 0.6779
8-(P-Hydroxyphenyl)-Menthone 1.9109 0.5784 1.4315 0.1361 1.5569 0.3863
9,12-Octadecadien-6-Ynoic Acid 0.8266 1.5431 0.5895 0.8543 0.9902 1.1963
9,12-Octadecadiynoic Acid* 0.9601 1.5442 0.7461 1.0953 0.6303 1.0240
9-Alpha-Ribofuranosyladenine* 1.7260 1.2579 0.5620 0.9012 0.4941 1.0588
9-Oxo-10,12-Octadecadienoic Acid 0.8944 1.5438 0.7144 0.4591 1.5454 0.8429
9-Oxooctadeca-10,12-Dienoic Acid 0.6140 0.8769 1.2380 1.0706 1.3111 0.8894
9-O-β-D-Glucoside of 3-hydroxy-7,8-didehydro-β-ionol 1.1525 1.0558 0.6143 0.4880 1.4838 1.2056
9β-hydroxyeudesma-4,11(13)-dien-12-al 0.3959 0.2946 4.6229 0.1413 0.2775 0.2678
Abu-Val-OH 0.9194 0.8210 0.9562 1.0768 1.0359 1.1906
Acacetin-7-O-glucuronide 0.4544 0.4335 1.4666 1.6666 1.4504 0.5285
acetophenone 1.1712 0.9390 0.4213 0.6155 0.9495 1.9034
Acetoxypinoresinol 0.5109 1.3047 1.7344 1.2538 0.2874 0.9087
Acitretin 1.1453 0.7032 1.9293 0.4513 1.1397 0.6313
Acteoside; Verbascoside* 1.0952 0.9288 0.6527 0.4492 1.9792 0.8950
Acutissimalignan B* 0.5180 0.5002 2.0859 1.6418 0.9837 0.2705
Adenine 0.6534 0.7446 1.5678 2.3463 0.2906 0.3972
Adenosine* 1.6882 1.3295 0.5467 0.8771 0.5278 1.0307
Adenosine 5^-monophosphate 1.9325 1.2288 0.6535 0.4545 0.8532 0.8774
Afzelechin (3,5,7,4^-Tetrahydroxyflavan) 1.3647 1.2046 0.8021 0.6859 1.0907 0.8520
Aketrilignoside B 0.9982 1.1732 0.7657 0.9831 0.9558 1.1240
Ala-His 1.2857 1.0369 0.8369 0.7997 0.9188 1.1219
Ala-Lys 0.6436 1.5964 1.9392 0.6894 0.4970 0.6344
alanine betaine* 1.0832 1.1140 1.4075 1.4600 0.4011 0.5342
Alanylproline 1.0394 1.1524 0.8427 0.9453 1.1313 0.8889
Ala-Ser 0.9044 1.1645 0.5518 0.6604 1.1441 1.5748
Allopurinol 0.6391 1.1440 1.1264 1.7807 0.4319 0.8778
Alnusonol 0.9504 0.9657 0.7143 0.6208 1.5365 1.2124
alpha-Asarone* 0.8826 0.2573 4.1367 0.0885 0.4823 0.1526
alpha-hexylcinnamaldehyde 1.1163 0.7167 1.6973 0.9150 0.9058 0.6489
Anacardic acid 0.9067 0.4677 2.3690 1.4618 0.3218 0.4730
Anisic acid; 4-Methoxybenzoic acid 0.8690 1.1852 1.2477 0.9183 0.9532 0.8266
Anisic acid-O-feruloyl glucoside 1.1050 1.0295 0.5847 1.0748 0.9712 1.2349
Anthranilic Acid 1.5507 1.0467 1.0646 1.0322 0.5829 0.7230
Antiarol; 3,4,5-Trimethoxyphenol 1.0691 0.9691 1.1227 1.0499 0.7234 1.0659
antioxidant 1.1237 1.1663 0.7945 0.9657 1.1536 0.7962
Apiosylskimmin (Adicardin) 1.1700 0.8079 0.8689 0.8335 1.3849 0.9349
Aquilegiolide 0.8607 1.1492 1.5298 1.0874 0.9795 0.3935
Arg-Gly 1.0226 0.9690 1.4030 1.0246 0.8350 0.7457
Arginine methyl ester* 0.3792 0.4648 1.1863 3.0618 0.4724 0.4356
Asn-Arg 1.0850 1.1096 0.9985 0.9199 0.8216 1.0654
Asn-Asn-Ala 1.2129 0.8478 1.6818 0.3667 1.1304 0.7605
Asp-Glu 0.9635 1.1302 0.9194 1.5002 0.6733 0.8133
Asp-Lys 1.0863 0.8186 1.2354 1.2426 0.7061 0.9111
Asp-Pro-Asn 0.6961 0.5131 1.0636 1.0578 1.3538 1.3156
Avicennin 1.1684 1.0234 0.9287 1.1775 0.7681 0.9340
Avicularin(Quercetin-3-O-α-L-arabinofuranoside) 1.5745 1.3703 0.5764 0.6364 0.4965 1.3458
Azetidine-2-carboxylic acid* 1.1595 0.8808 0.9767 1.2659 0.7558 0.9613
Bakuchicin 1.0147 0.9669 0.8490 0.9451 1.0515 1.1729
Balanophonin D glucoside 1.1236 1.1688 0.7119 0.8077 1.0183 1.1696
balanophon n 1.3441 1.4566 0.7252 0.8416 0.7473 0.8851
Balsaminace G 0.7235 1.0357 1.0495 0.9410 1.0336 1.2167
Barbituric acid;Malonylurea;2,4,6-Pyrimidinetrione 0.4158 0.7528 1.8406 1.3089 0.8225 0.8595
Bartsioside 0.6296 0.9914 1.0402 0.7071 1.1609 1.4708
Beta-asarone* 1.6597 0.5884 0.6457 0.4275 2.1928 0.4859
Betaine 1.2115 0.9920 1.6186 0.8833 0.8213 0.4734
Biotin 1.1981 0.8382 1.5852 0.9797 0.6397 0.7591
Bursehernin* 0.8633 1.1464 0.8215 0.9406 1.3234 0.9048
Butyl beta-D-glucoside 1.1443 1.0941 0.7512 1.1585 1.0273 0.8247
Butyl isobutyl phthalate* 1.0302 0.7990 0.9968 1.0622 1.2818 0.8300
Byzantionoside A* 0.9442 1.1787 0.8472 0.9415 1.0229 1.0654
Byzantionoside B 1.8195 1.1792 0.9979 0.6318 0.7107 0.6609
Caffeic aldehyde 1.5773 1.0014 0.7880 1.2281 0.6983 0.7069
Caffeoylcholine 1.0150 1.2469 0.6727 0.8117 1.0600 1.1937
Caffeyl fraxin 0.8390 0.9916 0.8971 0.9237 0.9983 1.3503
Calceolarioside B* 0.5753 0.5869 1.2297 1.3914 1.5358 0.6808
Carambolaside A 0.6716 0.6801 1.7979 1.6773 0.6849 0.4882
Carvylacetate 0.7364 0.8794 1.2339 1.2892 0.8311 1.0300
Casuarine Analogue* 1.1656 0.7033 1.4480 1.0133 1.0249 0.6449
catechin-3-O-α-L-rhamnopyranoside 1.2556 1.0126 1.0235 0.6973 1.3054 0.7056
cedrusinin 1.6752 1.5208 0.3702 0.4432 0.7126 1.2780
Centaurein 1.0529 1.2598 0.8373 0.8416 0.9649 1.0434
Chloranthatone 1.5957 0.6654 1.2400 0.3074 1.6007 0.5908
Choline Alfoscerate 1.0478 1.6398 1.3185 0.3882 0.7144 0.8913
Chrysin 0.9869 1.1566 0.9560 0.9429 0.9706 0.9869
Chrysin-7-O-glucoside 0.7008 0.9286 1.5581 1.8366 0.3261 0.6499
Chrysoeriol-5,7-di-O-glucoside 0.7137 0.9377 0.8153 0.9855 0.9554 1.5924
Chrysoeriol-6,8-di-C-glucoside-4^-O-glucoside 0.4963 0.4881 1.3423 1.5995 1.0687 1.0052
Chrysosplenoside C-O-glucoside 0.5630 0.6408 1.4041 1.6748 0.5644 1.1529
Cimifugin 1.0095 0.7785 0.9449 1.2640 1.0480 0.9550
Cinnamic acid 0.8846 1.7489 1.3660 0.7224 0.9339 0.3442
Cinnamoylglycine 1.1346 1.2023 1.0138 0.9725 0.8280 0.8488
Cirsimaritin-8-C-glucoside 1.1334 0.9083 0.8010 1.0221 1.0472 1.0881
cis-4-Hydroxy-D-proline* 1.0430 0.9958 0.6647 0.7975 0.7946 1.7044
Citicoline 0.6829 1.0170 0.9992 0.8117 0.9141 1.5751
Citroside A 1.0565 1.2961 0.8325 0.5513 0.9091 1.3546
Ciwujiatone 0.9549 1.0207 0.8511 1.6134 0.7121 0.8477
Clemaphenol A* 0.8555 1.2334 0.3271 0.5793 1.5567 1.4479
Coccilignan A* 1.2763 1.5533 1.2393 0.7065 0.5396 0.6851
Collinusin 0.8496 0.6656 1.0011 1.6306 1.4716 0.3815
Comazaphilone D 0.8265 0.9209 0.9717 0.9758 1.0210 1.2841
Comazaphilone E 1.1578 1.1677 0.9954 0.7868 0.8999 0.9924
Comolactone A 0.9631 0.9576 0.9875 1.0396 0.9334 1.1188
Coniferaldehyde* 1.0596 1.0482 1.1323 1.2182 0.8203 0.7213
Cordycepin (3^-Deoxyadenosine)* 0.9299 0.7138 1.2665 1.1624 1.4145 0.5128
coumarin 1.0135 0.9562 0.9791 1.1290 1.0938 0.8284
Coumarin-3-carboxylic Acid 1.2883 1.0393 1.0323 0.6958 0.5948 1.3494
Creatinine 0.9503 0.9389 1.0126 1.0131 1.0205 1.0646
Crenatoside 1.1710 0.7794 1.1636 0.8636 0.7252 1.2972
Crotonoside; 2-Hydroxyadenosine 0.8719 0.8290 1.5792 1.7024 0.2642 0.7533
Cubebin Dimethyl Ether 0.7856 0.9446 2.5419 0.8341 0.5847 0.3092
Cuneataside E* 2.0030 1.5513 0.6375 0.2619 0.4784 1.0679
cyclo-(Gly-Phe) 1.7568 0.7952 1.0324 1.2941 0.4130 0.7085
Cycloleucine 1.0237 0.9532 1.1222 1.2817 0.6675 0.9517
Cyclo(L-Phe-trans-4-hydroxy-L-Pro) 0.5346 0.7670 0.8533 1.9197 0.6618 1.2635
Cycloolivil 0.4427 1.9832 1.6557 1.0668 0.1864 0.6651
Cytarabine 0.8308 0.7125 1.6259 1.0684 0.7685 0.9940
Cytidine 0.8332 0.5523 1.2283 2.2923 0.4672 0.6267
Cytidine 5^-monophosphate(Cytidylic acid) 1.1139 1.2783 1.0984 0.4517 1.0936 0.9640
Cytosine 0.7748 0.5587 1.6884 1.9627 0.4742 0.5412
D-Allo-Isoleucine* 0.9980 0.9196 1.4106 1.8674 0.3801 0.4244
davidioside B 1.2382 1.1271 0.3180 0.8296 1.1560 1.3310
dehydroconiferyl alcohol 1.0771 0.8017 0.8735 1.0853 1.1779 0.9845
Dehydrodiconiferyl alcohol* 1.0117 1.1058 0.3378 0.6154 1.5998 1.3295
Dehydrodiconiferyl alcohol-4-O-glucoside* 0.7909 0.8282 1.1885 0.8859 1.3229 0.9835
Dehydrodiconiferyl alcohol-gamma^-O-glucoside* 0.8635 0.7630 0.7664 1.2037 1.1320 1.2714
Dehydrodiisoeugenol* 1.1440 3.9407 0.2983 0.3985 0.0992 0.1192
Deoxypodophyllotoxin 1.3336 1.4567 1.1502 0.6633 0.5578 0.8383
Desrhamnosylacteoside 2.0088 1.2705 0.5510 0.1848 1.4029 0.5821
Desrhamnosylisoacteoside* 0.7407 0.7685 1.1632 1.1769 0.7577 1.3930
D-Glucosamine 1.2697 1.3956 0.6816 0.6851 0.9366 1.0313
Dhurrin-6^-O-Glucoside 0.4383 0.5335 0.8910 1.5910 1.1330 1.4133
Diethanolamine 1.3502 1.0908 0.9358 0.9317 0.7369 0.9546
Dihydrocaffeic acid 1.4487 0.9002 0.8619 1.1474 0.8292 0.8127
Dihydrocostunolide 4.2285 0.0306 1.2210 0.0430 0.4320 0.0449
Dihydrodehydrodiconiferyl alcohol 0.9206 1.1207 0.7017 0.3345 2.2735 0.6489
Dihydroferuloylputrescine 1.2454 1.2374 0.7690 0.5034 1.2027 1.0422
Dihydroisopelletierine 0.9247 0.9875 1.1720 0.7647 1.1770 0.9742
Dihydrokaempferol-3-O-glucoside* 2.2192 0.9948 0.7351 0.7384 0.6075 0.7050
Dihydromonotropein methyl ester 1.8377 1.6225 0.2196 0.4355 0.9449 0.9398
Dihydropyrocurzerenone 2.4378 0.7233 1.0428 0.0954 1.1296 0.5711
dihydrosesamin* 0.4943 0.5209 2.0707 1.6475 0.9841 0.2825
Dihydroxy-dimethoxyflavone-7-O-glucoside* 1.1693 1.1926 0.6690 0.8816 0.8967 1.1909
Dimethyllimettin 0.8065 0.6082 0.9474 1.3640 1.1470 1.1269
Dimethyl phthalate 0.9968 1.0791 0.7796 1.0079 1.0528 1.0837
Diosmetin-7-O-galactoside* 0.8876 0.7936 1.0896 1.5580 0.7530 0.9182
Ditartaroyl-hydroxycoumarin 0.8331 NA NA NA 1.1669 NA
Divanillyltetrahydrofuran 0.8599 0.8769 0.9505 0.9505 1.0642 1.2981
DL-2-Aminoadipic acid 0.7929 0.9218 0.9268 2.3381 0.4742 0.5461
DL-Dopa 1.0200 0.8057 2.3598 1.2031 0.2692 0.3421
DL-Methionine 1.1755 0.5885 1.2099 1.6982 0.4697 0.8582
DL-Threonine 1.0900 0.8568 1.2508 1.3905 0.6183 0.7936
Dopamine 0.9169 0.5610 1.2308 1.0637 1.2851 0.9425
D-Ornithine 1.2600 1.0732 1.9949 0.7450 0.4664 0.4605
D-Panthenol 1.0487 1.2586 0.7462 1.1491 0.9171 0.8803
D-Pantothenic Acid* 1.1608 0.6969 1.4348 0.9709 1.0581 0.6785
D-Threose 1.3035 1.1911 0.8506 0.5681 0.6248 1.4618
Elaeocarpucin A* 1.7459 0.4618 2.0347 0.1029 1.3933 0.2614
Elaeocarpucin B 2.7065 0.5144 1.1432 0.1715 1.2746 0.1899
Elaeocarpucin F 1.7583 0.9827 0.9258 0.1554 1.7988 0.3791
Elaidolinolenic acid 1.0480 1.4249 0.9328 0.8416 0.8451 0.9076
Elemicin 2.2648 0.2661 0.2640 0.1273 2.8416 0.2362
Eleutheroside B1* 0.8945 0.9479 0.9938 1.2302 0.9435 0.9902
epieudesmin 0.8878 0.9035 0.8850 0.9628 1.1079 1.2530
Epimedoside A 1.1906 0.8763 1.1663 0.9429 0.8669 0.9570
Eriodictyol-7-O-glucoside* 1.8588 1.0761 1.2794 0.6297 0.5423 0.6136
Ethyl cinnamate 1.3408 0.6891 1.9491 0.2533 1.2697 0.4981
Ethyl maltol NA 1.0378 NA NA NA 0.9622
Ethyl phenylacetate 0.8800 1.1352 1.4069 0.6219 0.8926 1.0634
Ethylsalicylate 1.1156 1.0193 1.0650 1.1925 0.6914 0.9162
Eugenyl formate 0.7644 0.8540 1.0541 0.8393 1.4518 1.0364
Euoniside* 0.8945 0.9479 0.9938 1.2302 0.9435 0.9902
Evofolin B glucoside 1.1769 0.9647 0.5051 2.2409 0.7278 0.3847
Excelsioside 0.8414 0.7372 1.5045 1.4047 0.6614 0.8509
Fargesin* 0.8456 1.2397 0.8188 0.8648 1.2409 0.9901
Feruloyl syringic acid 1.0192 1.0881 0.8298 0.9844 0.9631 1.1153
Fisetin 0.8685 0.6739 1.0523 1.0924 1.2294 1.0835
flavanthrinin 1.3089 1.3068 NA 0.5152 1.3303 0.5389
Foliasalacioside B1* 2.3518 1.6145 0.5398 0.3196 0.3976 0.7767
Forsythoside H* 1.5365 0.8885 0.9303 0.6114 1.3510 0.6822
fragransin A2* 1.1018 3.5029 0.4416 0.5986 0.1675 0.1876
Fragransin B1* 1.3382 1.5263 1.3098 0.6741 0.5013 0.6503
Fragransin B3 1.2552 1.4995 1.4078 0.6437 0.5609 0.6330
Frambinone 1.5583 1.1818 0.4568 0.3273 1.3212 1.1545
Fraxetin (7,8-Dihydroxy-6-methoxycoumarin) 0.7567 1.1151 1.1575 0.9799 0.9706 1.0202
Fraxetin glucuronide 0.6413 NA 1.4293 0.9294 NA NA
Fraxidin-8-O-glucoside* 1.0592 1.2369 0.4904 0.9662 1.0596 1.1876
Fraxiresinol 1.1075 1.0903 0.9605 0.7515 1.2887 0.8014
Galangin-7-O-glucoside 1.1865 0.8679 1.0554 1.2349 0.8438 0.8115
Gallacetophenone 0.8037 0.9503 1.1610 0.8863 1.1731 1.0257
Gallic acid 1.3548 0.7376 NA 0.4599 1.0410 1.4067
Gallocatechin gallate 0.9865 0.6106 1.0066 1.7573 1.0257 0.6134
Galloylisorhamnetin 1.6657 2.2607 0.2503 0.3361 0.6195 0.8676
Gardenin A glucoside 1.0815 1.2371 0.6839 1.1258 0.6232 1.2485
Gardenin C glucoside 0.5357 0.6001 2.1050 1.4203 0.5608 0.7781
Gardnerol A 0.9279 0.6728 1.3880 1.5285 0.9576 0.5253
Gln-Asp-Val 1.0439 1.3988 0.4371 0.6042 1.1427 1.3733
Gln-Cys-Gln 0.9473 1.5478 0.5929 0.6091 0.6917 1.6112
Gln-Gly 1.1411 1.2011 0.8153 0.9587 0.9797 0.9041
Gln-Ser-Tyr 0.7106 0.7854 0.9701 1.1507 1.1663 1.2169
Glu-Arg 1.1636 0.6289 1.1012 1.1147 0.9815 1.0101
Glu-Phe 0.7829 0.3572 1.5759 1.9216 0.4413 0.9211
Glu-Ser 1.7274 0.8786 2.4994 0.4785 0.3047 0.1114
Glycerol 9(E),11(Z),13(E)-octadecatrienoyl ester* 1.5509 1.3104 0.5739 1.0872 0.6750 0.8026
Glycidyl Linoleate 1.4796 0.7777 1.0400 1.0045 0.8275 0.8706
Glycyl-L-leucine 1.0696 0.8108 1.2327 1.4276 0.5779 0.8813
Glycylphenylalanine 0.7789 0.3460 1.6859 2.2380 0.4856 0.4656
Grevilloside C 0.6650 0.9447 0.9465 0.9626 0.8375 1.6437
Grevilloside E 1.0396 0.8444 0.7868 1.1076 1.0029 1.2186
Guaiacol 0.8290 0.7620 0.9497 1.3635 0.7832 1.3125
Guanine 0.8968 0.9156 2.1620 1.0380 0.4571 0.5304
Guanosine 0.8685 0.7282 1.6457 1.8542 0.2886 0.6149
Guanosine 5^-monophosphate 1.7189 1.0100 1.1733 0.5970 0.7665 0.7343
Guettardionoside* 2.1395 1.6130 0.3708 0.3010 0.5177 1.0580
Hedyotol C 0.8073 0.3580 1.5221 0.4792 2.3707 0.4628
Helicide 0.7833 1.1629 1.4200 0.8711 0.7207 1.0419
Hexadecyl ethanolamine 0.6963 0.8228 1.4745 1.1097 1.1810 0.7157
Hexadecylsphingosine 1.0435 1.0328 1.0711 0.9563 0.9627 0.9336
Hispanolone 0.9584 1.2385 1.3066 0.6164 1.2362 0.6439
Hispidulin-8-C-glucoside 0.9077 1.0635 1.0108 1.3130 0.8026 0.9024
Histamine 0.8583 0.9194 1.3552 1.4990 0.5548 0.8133
Histidinol 0.8793 0.8374 1.1776 0.8897 1.1650 1.0509
His-Tyr 0.7577 0.8465 0.8818 1.5031 1.0145 0.9965
Homoproline 0.4092 0.4819 1.3789 2.9412 0.3874 0.4014
Hordenine 0.9406 0.9987 0.9186 0.9470 1.0549 1.1402
Horsfieldin* 0.5642 0.5260 1.9933 1.6333 0.9738 0.3095
Horsfieldin glucose* 1.1084 0.7939 0.8277 0.9201 1.1837 1.1661
Hovenic acid 2.2004 0.6227 0.6820 0.1240 1.8124 0.5585
Hydroxymethyl coumarin glucoside 1.1934 0.8103 0.8993 1.0988 0.9787 1.0195
Hyp-Ser 0.9160 0.3988 1.7655 1.8441 0.3918 0.6838
Hyp-Val 0.9977 1.2063 0.9444 0.7306 1.3463 0.7748
Ile-Asn 0.7532 0.4398 1.5099 1.5936 0.4471 1.2565
Ile-Trp 0.7170 0.9308 1.5995 1.1345 0.4675 1.1507
Imidazole-4-Acetic Acid 1.0281 1.2055 0.6633 1.1025 0.9280 1.0725
Indole 1.3482 0.9747 0.9223 1.2945 0.6420 0.8183
Inosine 0.9423 1.0599 0.9040 1.3495 0.9208 0.8235
Inosine 5^-monophosphate 1.7654 1.2908 0.5805 0.4684 0.9474 0.9474
Integracide H 1.1538 1.0489 0.9644 0.8967 0.9977 0.9385
Isoalantolactone 0.2524 0.0559 5.1619 0.0630 0.4315 0.0352
Isoamericanin A 0.7977 0.8728 1.0966 1.0030 1.0725 1.1574
Isobavachalcone glucoside 1.3249 0.6057 2.5526 0.6055 0.2537 0.6578
Isochlorogenic acid C 0.7277 0.8364 0.9791 1.1558 1.0570 1.2441
Isocrenatoside 0.9497 0.8588 0.9465 0.9969 1.1220 1.1261
Isocytosine 0.7177 0.7849 1.1699 1.8381 0.6871 0.8023
Isofraxetin 1.0500 0.9696 1.4254 1.0681 0.7503 0.7366
Isofraxidin 0.5544 1.3353 0.7365 1.0731 1.1450 1.1556
Isoguanine 1.1900 0.8746 1.0711 1.4435 0.3293 1.0915
Isolariciresinol-9-O-glucoside 0.9639 0.7969 0.7812 0.9177 1.1910 1.3493
Isonicotinic acid 1.2930 0.8912 1.0542 1.1897 0.7616 0.8102
Isopentenyladenine-7-N-glucoside 0.9435 1.2015 0.9108 0.9281 0.8231 1.1930
Isoquinoline 1.4897 0.8968 0.8827 0.8665 0.8847 0.9796
Isorhamnetin-3,7-O-diglucoside 0.8198 0.9081 0.5552 1.0812 0.7900 1.8457
Isorhamnetin-3-O-(2^^-O-xylosyl)glucoside 1.4992 1.3074 1.6814 0.6944 0.4187 0.3988
Isorhamnetin-3-O-arabinoside 1.3072 0.5792 1.4528 0.6323 1.2800 0.7485
Isorhamnetin-3-O-glucuronide-7-O-rhamnoside 1.6665 1.0359 0.3150 0.3162 1.1306 1.5358
Isorhamnetin-3-O-rhamnoside 1.1297 1.0414 0.9986 0.9182 0.7475 1.1646
Isorhamnetin-3-O-rutinoside-4^-O-glucoside* 0.9894 0.8693 0.7701 0.4614 2.2039 0.7060
Isorhamnetin-3-O-rutinoside (Narcissin) 1.0775 1.0998 0.8380 0.8263 0.9243 1.2341
Isorhamnetin-3-O-sophoroside-7-O-rhamnoside* 1.2172 1.0138 0.8796 0.4137 1.2026 1.2731
Isorhamnetin-7-O-glucoside (Brassicin) 1.0446 1.1124 1.2933 1.0212 0.7032 0.8253
Isosakuranetin-7-O-glucoside (Isosakuranin) 1.1087 1.0803 1.3071 0.6884 0.7609 1.0546
Isosalipurposide-6^^-O-p-coumaric acid 0.9497 1.1479 0.6273 1.0869 1.1640 1.0241
Isosclerone;(4S)-4,8-Dihydroxy-3,4-Dihydronaphthalene-1(2H)-One 0.9520 0.7363 0.9286 0.9570 1.2996 1.1265
Isovanillin 0.5520 0.9509 1.5899 1.7185 0.7643 0.4244
Jaceosidin-7-O-Glucoside 0.6035 0.6185 1.1439 1.4776 0.8808 1.2757
Justicidinoside A 0.6666 1.1291 2.5563 0.6220 0.7331 0.2928
Kaempferol-4^-O-glucoside 1.7099 1.1539 1.1366 0.3599 0.9369 0.7028
Kingiside 1.0329 1.2315 0.9101 0.9490 0.9592 0.9172
Ladanetin-6-O-β-D-glucosid* 0.7520 0.9036 0.7850 1.0674 0.9922 1.4999
L-Alanyl-L-Phenylalanine 1.0619 0.7369 1.5608 0.7431 1.0343 0.8630
L-Allo-isoleucine 0.9478 0.8549 2.0016 1.5607 0.2518 0.3832
L-Arginine 0.1308 0.1408 1.0627 4.4572 0.0620 0.1464
Lariciresinol acetate 2.8375 0.5999 0.3972 0.1747 1.8085 0.1823
L-Asparagine 1.4172 1.1297 2.2159 0.6482 0.2698 0.3193
L-Aspartyl-L-Phenylalanine 1.1327 0.6342 0.9855 1.9653 0.4809 0.8015
Lauramine oxide 0.9609 1.0456 1.0072 0.9609 1.0625 0.9629
Lauryldiethanolamine* 1.0273 1.0073 0.9998 0.9973 1.0273 0.9411
L-Carnitine 1.0814 1.4285 1.3701 1.1045 0.3448 0.6706
L-Citrulline 0.8483 0.8782 1.3723 0.9697 0.8722 1.0593
L-Cyclopentylglycine 0.8292 0.8117 1.4610 1.2674 1.0430 0.5876
L-Cystathionine 1.1030 1.1347 NA 0.7399 0.9039 1.1184
L-Cysteinyl-L-glycine 1.0752 0.6903 0.9113 0.8582 1.4030 1.0619
L-Cystine 0.6477 0.9588 0.9957 1.7404 0.8946 0.7628
Lepadin D 1.0389 0.8315 0.9692 1.0924 1.3145 0.7535
Leu-Abu-OH 0.9431 0.8817 1.2500 1.0367 0.6068 1.2817
Leu-Arg 1.3041 0.5748 1.3997 1.1660 0.7320 0.8234
Leu-Asp 0.7009 0.3584 1.6508 2.3670 0.3326 0.5902
Leucosceptoside A 2.3672 0.6245 0.9029 0.7370 0.7437 0.6247
L-Glutamic acid 1.1921 0.8746 0.9940 1.2499 0.6870 1.0024
L-Glutamine 0.6914 1.0812 1.2313 1.7510 0.7894 0.4556
L-Histidine 0.5257 1.4130 1.1464 1.9798 0.2500 0.6850
L-Homocitrulline 1.2224 1.0834 1.1409 1.1548 0.6580 0.7405
L-Homocysteine 0.9442 0.8111 0.9579 1.4959 0.6704 1.1205
L-Homocystine 1.1118 0.5524 0.9314 1.3455 0.4901 1.5688
L-Homomethionine 1.0677 0.9143 0.9999 1.0269 0.9783 1.0130
L-Homoserine 1.5231 0.9363 1.1226 1.2285 0.5227 0.6668
Licarin A 1.1301 4.0147 0.2555 0.3553 0.1221 0.1223
Ligstral 0.8941 0.7793 1.1778 1.2086 0.8727 1.0675
Ligustroflavone(Nuezhenoside) 0.8345 1.0827 1.0000 1.0388 1.1546 0.8893
Linolenyl Alcohol 1.1305 0.7396 1.2842 1.1979 1.3579 0.2899
linoleoyl ethanolamine 0.6806 0.5005 1.9558 1.6754 0.7103 0.4774
Liriodendrin 0.9438 0.9887 0.4584 1.8589 0.4340 1.3163
L-Isoleucyl-L-Aspartate 0.7846 0.6080 1.6599 1.3423 0.6197 0.9855
L-Isoserine 1.4231 1.0891 0.9764 0.9605 0.6237 0.9272
Lithospermoside 0.9244 1.2131 1.8897 0.8723 0.3624 0.7380
L-Leucyl-L-Leucine 1.1511 0.4869 2.2313 0.6906 0.5150 0.9251
L-Leucyl-L-phenylalanine 1.0101 0.4399 2.2543 1.0042 0.5302 0.7612
L-Lysine 0.7055 1.0826 1.2321 1.7380 0.8010 0.4407
L-Lysine-Butanoic Acid 0.7358 0.4018 2.4787 0.4301 1.8777 0.0759
L-Methionine Sulfoxide 0.8165 1.0589 0.9747 1.8059 0.6660 0.6779
L-Norleucine* 0.9718 0.9590 1.1657 2.0434 0.3821 0.4779
L-Phenylalanine 0.6268 0.4513 1.3583 1.5398 0.8340 1.1897
L-Phenylalaninol 0.9528 1.0878 0.9843 0.9554 0.8965 1.1232
L-Pipecolic Acid 0.8279 1.5141 1.4467 0.6291 0.2202 1.3619
L-Proline* 0.7349 0.8037 1.5037 1.4745 0.5895 0.8937
L-Serine 1.2551 1.1567 0.8779 0.9483 0.7692 0.9929
L-Seryl-L-Isoleucine 0.7298 0.3295 2.1742 1.3682 0.4140 0.9843
L-Tyramine 1.2357 0.9438 0.3179 0.5763 0.8887 2.0376
L-Tyrosinamide 0.7395 0.9360 0.5873 0.7110 1.5416 1.4847
L-Tyrosine* 0.8157 0.9450 0.8074 1.8942 0.6988 0.8390
L-Tyrosine methyl ester 1.0016 0.8907 1.0069 1.0525 1.1060 0.9423
Luteolin-3^-O-glucoside 0.5130 0.6471 1.5111 1.5796 0.9006 0.8485
Luteolin-4^-O-glucoside 1.1339 0.8267 1.2695 1.2418 0.7423 0.7858
L-Valine* 1.1097 1.1071 1.3858 1.5212 0.3680 0.5082
L-Valinol 1.1729 1.0747 0.8085 1.1384 0.7708 1.0347
L-Valyl-L-Leucine 0.6685 0.3214 2.6064 1.2778 0.3192 0.8067
L-Valyl-L-Phenylalanine 0.5321 0.2412 2.2953 2.0758 0.2468 0.6088
Lys-Ala 0.5535 0.6895 0.6665 3.0482 0.3984 0.6438
Lys-Asn 1.0213 0.9168 1.3150 1.2032 0.7977 0.7461
Lys-Gly 0.9879 0.8829 1.1346 0.9840 1.1354 0.8752
Lys-Leu 0.9413 0.9795 1.4101 1.3545 0.6863 0.6283
LysoPC 15:0* 0.5908 1.2129 0.8487 1.1466 1.1176 1.0833
LysoPC 15:0(2n isomer)* 0.5908 1.2129 0.8487 1.1466 1.1176 1.0833
LysoPC 15:1 1.0115 0.8574 1.0045 0.9271 1.1411 1.0584
LysoPC 16:0* 0.8820 0.8480 1.1289 0.7155 1.7280 0.6976
LysoPC 16:0(2n isomer)* 0.8880 0.8074 1.2657 0.7129 1.6250 0.7009
LysoPC 16:1* 1.2777 1.3230 0.5769 0.4001 1.1830 1.2394
LysoPC 16:1(2n isomer)* 1.2579 1.8546 0.9841 0.4749 0.7148 0.7138
LysoPC 17:0* 0.8706 0.6179 1.0576 0.5434 2.4505 0.4600
LysoPC 17:0(2n isomer)* 0.8017 0.6838 1.0053 0.5970 2.4412 0.4710
LysoPC 17:1 0.9499 1.0217 0.9426 0.7508 0.8838 1.4513
LysoPC 17:2 1.0341 1.2283 1.0939 0.4791 1.0294 1.1352
LysoPC 18:0 0.7118 0.4978 0.7367 0.3080 3.2877 0.4580
LysoPC 18:1 1.2520 0.7864 1.2253 0.5680 1.4920 0.6764
LysoPC 18:1(2n isomer) 0.8947 0.9890 1.8161 1.0481 0.8495 0.4026
LysoPC 18:2 1.1717 0.7612 0.8984 0.5687 1.4173 1.1827
LysoPC 18:2(2n isomer) 1.1300 1.1417 1.1318 0.6459 0.9618 0.9887
LysoPC 18:3 1.3734 1.2969 0.6720 0.4127 1.2614 0.9836
LysoPC 18:3(2n isomer) 1.7611 1.7922 0.8853 0.2141 0.9228 0.4246
LysoPC 19:1 1.0484 0.9097 1.9178 0.8438 0.6786 0.6016
LysoPC 19:2 0.5886 1.6068 1.6868 0.5855 0.7319 0.8003
LysoPC 19:2(2n isomer) 0.6779 1.4378 1.5273 0.6754 0.9270 0.7545
LysoPC 20:2 0.8284 0.9238 0.6365 0.6621 1.5937 1.3555
LysoPC 20:2(2n isomer) 0.7404 1.5466 0.6029 0.9035 1.0534 1.1531
LysoPE 16:0 0.7580 1.0271 1.1867 1.1566 0.7960 1.0756
LysoPE 16:0(2n isomer) 0.7797 1.1032 0.9976 1.2380 0.7159 1.1655
LysoPE 16:1* 1.2903 1.5541 0.5726 0.4051 0.8834 1.2945
LysoPE 16:1(2n isomer)* 1.2037 1.3446 0.7323 0.4936 1.0433 1.1825
LysoPE 17:1 1.4659 1.0670 0.4618 0.8397 0.7902 1.3753
LysoPE 18:0 0.6001 0.8986 0.6912 0.6974 1.4926 1.6201
LysoPE 18:1* 0.9499 1.3366 0.4511 0.6749 1.2470 1.3405
LysoPE 18:1(2n isomer)* 1.0465 1.2002 1.1928 1.3005 0.5017 0.7583
LysoPE 18:2 0.8203 0.8127 0.5128 0.6683 1.4160 1.7698
LysoPE 18:2(2n isomer) 1.2756 0.6266 0.8542 0.6963 1.1173 1.4299
LysoPE 18:3 1.1575 1.1609 0.3001 0.3573 1.4824 1.5418
LysoPE 18:3(2n isomer) 2.0271 1.4174 0.4410 0.3912 1.0229 0.7004
Lys-Phe 1.3308 1.2598 0.8093 0.9100 0.7413 0.9487
Lys-Thr 1.0062 0.8630 1.0138 1.2198 0.8536 1.0435
Lys-Tyr 1.1750 1.0881 0.8297 1.1254 0.7333 1.0485
L-α-Glutamyl-L-Glutamic Acid 1.1903 0.9822 0.7376 0.9819 0.8877 1.2204
Machilin H 1.5922 1.3126 0.4917 0.7223 1.0639 0.8173
Machilusol A* 0.9448 2.4339 0.9112 1.1749 0.2833 0.2520
Macrophypene B* 1.1905 1.2646 0.6731 1.1653 0.6873 1.0193
Magnolin 0.9597 0.8243 1.3569 0.5809 1.6738 0.6044
Malonyl oleuropein 1.2289 1.3193 0.5525 1.2042 1.0795 0.6157
Malonyltryptophan 0.7972 0.8778 1.0176 1.0661 1.2012 1.0401
Maltopentaose NA 1.0225 0.1997 1.7685 0.8560 1.1533
Maltotriose 0.8976 0.9858 0.9184 1.0494 0.9483 1.2005
Maohuoside A 1.1175 0.9210 0.7400 0.7931 0.8650 1.5634
Massoniresinol; Vladinol A 0.5067 0.5904 0.7890 0.9453 1.5678 1.6007
Matairesinol-4^-O-glucoside (Matairesinoside) 0.8449 0.7763 1.0031 0.5750 1.1387 1.6621
Medioresinol B 0.9421 1.0329 0.5175 0.7862 1.5764 1.1449
Mequinol 1.0244 0.7964 0.8430 0.9348 1.0312 1.3701
Met-Ala-Glu 0.8273 NA 0.8156 1.3211 NA 1.0360
Met-Asn 0.9579 0.8086 1.3370 0.4428 1.6355 0.8182
Met-Asp 0.7632 1.0387 0.8378 1.0892 1.0013 1.2699
Met-His 0.7172 0.6723 1.9154 1.5347 0.6348 0.5255
Methoxyindoleacetic acid 1.0987 0.9830 0.9538 0.7778 0.9412 1.2455
Methyl-3-(3-hydroxyphenyl)Propionate 0.9559 0.9912 1.7529 1.0086 0.7352 0.5563
Methyl 3-aminopropanoate 1.0264 1.0383 0.7767 1.0972 0.7157 1.3458
Methyl (6-O-4-hydroxybenzoyl)-α-D-glucoside 0.6155 0.5393 0.8450 1.1681 1.3907 1.4414
Methyl 8,9-epoxypimaran-18-oate 1.5620 0.6966 1.5620 0.5335 1.1408 0.5050
Methyl dioxindole-3-acetate 1.0391 0.9061 1.0768 1.0935 0.8564 1.0281
Methyldopa 0.9856 1.1853 1.2883 0.4790 0.9215 1.1404
Methyl Hydroxycinnamate 1.0555 1.1279 0.9348 1.3570 0.9481 0.5768
Methylpicraquassioside A 1.1296 1.0004 1.0932 1.0850 0.7356 0.9562
Methyl Syringate 0.8852 0.7356 1.0577 0.9090 1.4261 0.9864
Met-Met 0.9859 0.5835 1.4894 0.9665 0.9291 1.0456
Met-Pro-Gln 1.5922 1.3126 0.4917 0.7223 1.0639 0.8173
Met-Ser 1.0639 0.2717 1.9127 1.9095 0.3849 0.4574
Met-Thr 1.3095 1.0078 0.9179 0.8480 1.1503 0.7666
Monolinolenin* 1.5642 1.3648 0.5904 1.0465 0.6659 0.7681
Monopalmitin* 0.9258 0.6641 1.6957 0.9375 1.2736 0.5032
Mucic acid-dimethyl-2-O-gallate 0.5509 0.8945 0.9853 1.5581 1.0581 0.9532
mudanoside A 1.3006 0.7331 0.8379 1.0739 1.1935 0.8610
Mudanpinoic acid A 1.3772 0.7580 1.6250 0.1806 1.8025 0.2567
Multifidol Glucoside 0.3144 0.5440 3.3851 0.6646 0.4962 0.5958
Myrisfragransin 1.1658 3.9071 0.2914 0.3478 0.1350 0.1528
Myristicanol B* 1.3190 1.5094 1.3459 0.6844 0.5198 0.6215
Myrtucommulone B 1.0340 1.0156 1.0391 1.0965 1.1444 0.6704
N1-Caffeoyl-N10-dihydrocaffeoylspermidine 1.0646 1.2720 0.7756 1.0294 1.0153 0.8432
N1-Dihydrocaffeoyl-N10-coumaroylspermidine 1.2819 1.1742 0.6620 0.3887 1.0615 1.4317
N1,N10-Dihydrocaffeoylspermidine 1.2428 0.9684 0.8349 1.3660 0.8787 0.7092
N1,N8-Bis(sinapoyl)spermidine 1.2984 0.9223 0.2855 0.9324 1.5733 0.9881
N-(2-Hydroxy-4-methoxyphenyl)acetamide 0.7039 0.8686 0.8202 2.0538 0.5892 0.9642
N-[3-(4-Hydroxyphenyl)acryloyl]-L-tyrosine 1.1156 0.9771 0.9568 0.8234 1.1410 0.9860
N-(3-Indolylacetyl)-L-alanine 1.3037 1.3567 0.9585 0.7819 0.8184 0.7807
N-(4-Aminobutyl)benzamide 1.2802 1.5942 0.5154 0.7671 0.7202 1.1229
N6-(2-Hydroxyethyl)adenosine* 1.0046 0.8452 1.8628 0.9851 0.6103 0.6920
N6-(4-hydroxybenzyl)adenine 0.7845 0.5443 1.4322 1.1444 1.3462 0.7484
N6-Acetyl-L-lysine 1.0666 1.1307 1.1823 0.9247 0.9375 0.7581
N6-Isopentenyladenine 0.7237 1.1780 1.1892 1.0178 1.1242 0.7671
N(6),N(6)-Dimethyl-L-lysine 0.1042 0.1133 1.0922 4.4549 0.0774 0.1580
N7-Methylguanosine 1.1419 0.7669 1.3505 0.7279 1.0714 0.9413
N-Acetylcadaverine 0.8767 0.9562 1.0466 0.9578 1.0891 1.0736
N-Acetyl-D-galactosamine 1.1262 0.9901 1.1749 0.9033 1.0018 0.8037
N-Acetyl-D-glucosamine 1.0563 0.9857 1.2907 0.9415 0.9382 0.7876
N-Acetyl-D-mannosamine 0.9581 1.2112 1.1369 0.8489 1.0232 0.8216
N-benzylformamide 0.7214 1.0145 0.8709 1.8738 0.5852 0.9343
N-Benzylmethylene isomethylamine 0.5264 0.4156 1.4614 1.5892 0.8292 1.1781
N-(beta-D-Glucosyl)nicotinate 1.4671 0.7734 1.2506 0.2120 1.7985 0.4984
N-Caffeoylphenylalanine 1.1106 0.9491 0.7739 1.3130 0.9312 0.9222
N-Carbamoylsarcosine 0.9524 0.9349 0.9524 1.0519 0.9349 1.1734
Nectandrin B* 1.0979 3.4522 0.5519 0.5532 0.1520 0.1928
N-Feruloyltyramine 4^-glucoside 0.9123 1.1433 1.3527 0.9279 0.8347 0.8292
N-(gamma-L-glutamyl)tyramine O-glucoside 0.9885 0.9287 0.7971 1.0303 1.0817 1.1738
N-Glucosyl-p-coumaroylputrescine 1.1114 0.9388 0.8936 1.0928 1.2281 0.7353
NG,NG-Dimethyl-L-arginine* 0.8627 0.6544 0.9046 2.0220 0.6158 0.9405
Nicotianamine 0.7976 0.3640 2.1899 1.8579 0.4230 0.3675
Nicotinamide 1.2769 1.2539 1.1655 1.1066 0.6730 0.5243
Nicotinate D-ribonucleoside 0.7138 1.1101 1.0076 1.6164 0.6779 0.8743
Nicotinic acid adenine dinucleotide 1.4916 0.7918 0.9827 0.8852 1.0580 0.7906
Nicotinic Acid Methyl Ester(Methyl Nicotinate) 0.8394 0.7635 1.6361 0.8560 0.9483 0.9568
Nicotinic acid (Vitamin B3) 1.0487 0.9778 1.5014 1.2282 0.6086 0.6353
N-Isobutyl-4,5-epoxy-2E-decaenamide 1.0422 1.0109 0.9305 0.9390 1.0216 1.0558
N-Methyl-L-proline 0.9882 1.0143 1.0848 1.3357 0.6726 0.9044
N-Methylserotonin 1.0415 0.8608 0.8681 1.1466 1.0752 1.0078
N-Methyl-Trans-4-Hydroxy-L-Proline 0.8812 0.8044 1.6084 1.5575 0.6477 0.5008
N-Methyltryptamine 1.0453 0.9332 0.7129 0.8627 1.1273 1.3185
N-Methyl-α-aminoisobutyric acid 1.0883 1.1528 2.8476 0.3567 0.4363 0.1184
N-Monocinnamoylputrescine* 0.8644 0.9929 0.6625 1.0887 0.7659 1.6256
N-Monomethyl-L-arginine* 0.4994 0.4334 1.1592 3.2153 0.2772 0.4155
N,N-cinnamoylbutanediamine* 0.8164 1.0456 0.3990 0.5374 1.7103 1.4914
N^,N^^-Diferuloylspermidine 0.6014 0.6948 1.4209 0.9118 1.2206 1.1506
N,N-Dimethyl-5-methoxytryptamine 0.8299 0.8260 0.4503 0.6709 1.7572 1.4656
N,N^-Dimethylarginine;SDMA* 0.8558 0.7330 0.9903 1.9307 0.5719 0.9182
N,N-Dimethylformamide 1.0032 1.1284 0.8407 1.0405 0.9600 1.0271
N,N-Dimethylglycine* 1.1200 1.0678 0.8227 1.1442 0.7482 1.0971
N-Oleoylethanolamine 0.7181 0.3323 2.4140 1.4336 0.9889 0.1130
Nonic acid 1.3752 1.2583 0.7583 0.6595 0.8571 1.0916
Nopaline 0.8856 1.1483 1.1767 1.0771 0.5915 1.1208
N^-p-Coumaroylagmatine-glucoside 0.8363 1.3868 0.7552 1.2162 0.9700 0.8354
N-p-Coumaroylhydroxyputrescine 0.8783 1.1702 0.9263 0.9287 1.0453 1.0513
N-p-Coumaroyloctopamine 1.0328 1.0539 0.7959 1.0156 0.8593 1.2425
N-(p-Coumaroyl)serotonin Glucoside 0.9056 0.8599 0.9218 0.9988 1.1204 1.1934
N-Phenylacetylglycine 1.0370 0.9415 0.9207 1.0578 0.8370 1.2060
N-Propionyl nornicotine 0.8389 1.0673 1.3211 1.0142 1.0280 0.7306
N-Trans-Cinnamoylputrescine 0.7968 0.8492 0.7172 0.6785 1.3842 1.5742
O-Acetyl-L-carnitine 1.5858 0.6402 2.0363 0.7277 0.5734 0.4366
O-Acetyl-L-homoserine 0.7275 0.9626 1.3649 1.8494 0.5932 0.5024
O-Acetylserine 1.1011 0.9997 0.8833 0.7608 0.9649 1.2901
O-benzyl-L-serine 0.6914 1.1739 1.0637 0.3507 2.0524 0.6678
Octadec-8-enamide 1.1474 0.7503 1.3024 1.1612 1.3731 0.2657
Octadeca-11E,13E,15Z-trienoic acid 0.8365 1.1685 1.1500 1.0224 0.9564 0.8662
Octadeca-2,9,12,15-tetraen-1-ol 1.0278 0.9381 1.0536 1.0504 1.2272 0.7028
Octadecadienamide 0.9845 0.9253 1.0512 1.0455 1.2630 0.7305
Okanin-3^,4^-di-O-glucoside 1.2034 1.3797 0.5463 0.3948 0.6667 1.8090
Okanin-4^-O-glucoside(Marein)* 0.9575 1.3416 0.6903 0.8549 0.9160 1.2396
Oleamide (9-Octadecenamide) 1.1050 0.7129 1.3617 1.1629 1.4271 0.2305
Olean-12-ene-3,16-dione (Maniladione) 2.0374 0.4831 1.1425 0.0371 2.1072 0.1926
Oleoside* 0.7727 0.9467 0.9232 2.1064 0.6800 0.5710
Olivil Monoacetate 1.3616 1.4131 0.8466 0.5770 1.0443 0.7575
O-phosphate-L-tyrosine 0.8480 0.9960 1.2158 1.1644 1.0174 0.7584
O-Phosphocholine 1.3089 0.9956 1.1482 0.4262 1.2153 0.9057
osmanthuside F 1.0833 1.0169 0.7957 0.8631 1.1333 1.1078
Otobaphenol* 1.1549 3.9402 0.2922 0.3958 0.1077 0.1092
Ovafolinin E 0.9424 0.8525 1.3050 0.3000 2.1034 0.4968
Oxaceprol 1.1624 0.8387 1.5689 0.9251 0.8837 0.6211
p-Coumaric acid 1.3293 1.5589 1.0533 0.6253 0.9035 0.5297
p-Coumaroylcadaverine 1.1782 0.8440 1.3898 1.3907 0.8383 0.3591
p-Coumaroylputrescine 1.0056 1.0276 0.8275 0.7893 1.0593 1.2907
p-Coumaroyltyramine* 1.0462 0.6492 1.3155 0.3481 2.1050 0.5360
Pectolinarigenin-7-O-glucoside 0.7802 1.1348 0.8539 0.7979 1.1154 1.3177
Peucedanol 7-O-glucoside 1.6971 1.6485 0.2119 0.1700 1.1948 1.0777
Phe-Ile 0.5311 0.4123 1.2985 2.1276 0.4355 1.1950
Phellodendroside* 1.0600 0.7996 0.9527 1.2196 1.0609 0.9072
Phenylacetaldehyde 0.9769 0.9149 1.0143 1.2333 0.8505 1.0100
Phenylethanolamine 0.7368 0.5033 2.2652 0.3325 1.8900 0.2721
Phenyl salicylate 0.3201 0.0800 5.1462 0.0282 0.3670 0.0585
Phe-Ser 0.8219 0.2804 1.9297 1.9630 0.3258 0.6792
Phe-Thr 1.0826 0.4444 1.9714 1.1749 0.5066 0.8200
Phloroglucinol; 1,3,5-Benzenetriol 1.0184 1.4050 0.8002 0.8905 0.9731 0.9128
Phthalic anhydride 1.0101 1.0542 0.8737 1.2197 0.9857 0.8565
Pinolenic acid 0.8816 1.2567 0.8498 1.1136 1.0829 0.8154
Pipecolic acid 1.0018 1.0442 1.1144 1.2810 0.6800 0.8788
Piperidine 1.1507 0.8558 1.6503 1.6536 0.3038 0.3859
Piperonal 1.2164 0.9738 1.1157 1.0505 0.6055 1.0379
Piperonylic acid 0.9267 0.9986 0.7587 0.6152 1.0998 1.6010
Plantarenaloside 1.0863 1.3286 0.4468 0.5862 1.1242 1.4279
Planteose 0.6854 1.0468 0.8810 1.3348 0.7608 1.2912
p-menth-3-ene-1,2-diol 0.7654 0.7145 2.7432 0.5343 0.6881 0.5545
Pro-ala 1.1380 0.9936 0.6495 0.5041 1.3762 1.3386
Pro-Asn 1.2325 0.9544 1.4419 0.9384 0.7992 0.6335
Pro-Asp 1.0996 0.8280 1.5801 0.9909 0.8271 0.6742
Procurcumenol 0.4860 0.2426 4.3760 0.2108 0.4637 0.2210
Prolylproline 1.0826 0.8267 0.9459 1.3619 0.7628 1.0201
Pro-Pro-Asn 0.3871 0.4915 1.2930 1.2379 1.2565 1.3341
Punicic acid (9Z,11E,13Z-octadecatrienoic acid) 0.6648 1.5764 0.6945 0.6387 1.3545 1.0711
Putrescine 1.1991 1.0130 0.7959 0.9887 1.0675 0.9357
Pyridoxal 0.9357 1.2409 1.0396 1.1437 0.6185 1.0217
Pyridoxine 1.1092 0.6433 1.8992 0.5231 0.9996 0.8256
Pyridoxine-5^-O-(6^^-feruloyl)glucoside 0.7580 0.6305 0.8093 1.0735 1.6326 1.0961
Pyridoxine-5^-O-diglucoside 0.8740 1.0259 1.0412 1.2984 0.6128 1.1477
Pyridoxine-5^-O-glucoside 0.8834 0.8875 1.3294 0.6636 1.0140 1.2222
Pyroglutamic acid 0.8628 1.3882 1.2441 0.7503 0.3087 1.4460
Quercetin-3-O-glucoside-7-O-rhamnoside* 0.9268 1.2300 0.8189 0.7787 0.9878 1.2579
Quercetin-3-O-neohesperidoside* 0.4688 0.1987 1.0755 1.2743 1.9123 1.0704
Quinidine 1.0100 0.9210 1.0827 0.6396 1.0148 1.3318
(R)-3-ethyl-7-hydroxy-6-methoxyphthalide 0.5463 0.8251 0.9461 1.0823 1.3264 1.2739
(R)-Citronellol 0.7913 1.0096 1.0001 0.8837 1.2659 1.0494
Rel-(5R,6S,7R)-5,6,7,8-Tetrahydro-5,6,7-trihydroxy-2-[2-(4-methoxyphenyl)ethyl]-4H-1-benzopyran-4-one 0.9181 0.9122 0.8129 0.8864 1.1012 1.3693
Reseoside* 0.8043 1.1619 0.9233 1.0929 1.0498 0.9679
Rhodiolgin 0.7779 0.9984 1.0782 0.8805 1.3590 0.9060
Rhodionidin 0.3456 0.3887 1.8158 1.0537 1.4760 0.9202
Riboflavin (Vitamin B2) 1.6686 1.0645 0.9637 0.6635 1.1014 0.5383
Riboprine 0.3004 0.6272 1.7775 2.4759 0.3248 0.4942
Ribosyladenosine 0.7218 0.6241 2.5671 0.2321 1.3751 0.4797
(R)-Mandelamide 0.8323 0.7829 0.9530 1.4968 0.7582 1.1770
Robinetin 0.8834 1.4536 0.7730 0.7375 1.1795 0.9731
Rosmarinic acid 0.8810 0.9826 1.0987 0.7552 1.0983 1.1843
(S)-2,3-dihydroxypropyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate 1.6322 1.6923 0.7665 0.5220 0.6164 0.7705
S-(2-Carboxypropyl)cysteine 0.5829 0.6054 1.3969 1.7180 0.7649 0.9319
(S)-2-Phenyloxirane 1.2550 0.9789 0.4170 0.6461 0.9930 1.7099
S-(5^-Adenosy)-L-homocysteine 1.2306 1.1185 0.9347 0.8100 0.8199 1.0863
S-(5^-Adenosyl)-L-methionine 0.9984 0.7929 0.6891 1.4214 1.2871 0.8111
S-Adenosylmethionine 1.0284 0.7785 0.5867 1.5226 1.2489 0.8351
saffloquinoside A 0.9960 1.2816 0.9522 0.5104 1.1921 1.0677
saikolignanoside D* 0.8521 0.8428 0.7806 1.1528 1.1869 1.1848
Sakuraresinol 1.1000 0.8133 0.8417 1.2329 1.2231 0.7890
sanshodiol 0.9210 0.9860 1.2742 1.2723 0.8658 0.6807
Scopoletin (7-Hydroxy-6-methoxycoumarin)* 1.1764 1.1307 0.8612 1.1177 0.7506 0.9633
Scopoletin-7-O-glucoside (Scopolin) 1.2544 0.9119 0.9644 1.3446 0.9548 0.5699
Scopoletin-7-O-xylosyl(1→6)glucoside 0.9918 0.9691 0.9022 0.8944 1.1320 1.1104
Scrophuside 0.7626 0.9302 1.1519 1.4466 0.8812 0.8276
Secoisolariciresinol 0.8844 1.1670 0.7424 0.9941 0.8839 1.3282
secologanoside* 0.5598 0.4775 0.7227 2.8003 0.9231 0.5166
Secoxyloganin 1.0804 0.9099 0.9237 0.9316 0.8705 1.2838
Senkyunolide A 1.3534 1.3883 1.1577 0.6932 0.6989 0.7085
Senkyunolide H 1.4608 1.3671 0.5696 0.5711 0.9562 1.0753
Senkyunolide I 1.5177 1.2798 0.5221 0.6890 0.9881 1.0032
Senkyunolide K 2.3733 0.1715 0.2019 0.0196 3.0998 0.1338
Senkyunolide M 0.8419 1.1287 0.9276 1.2050 1.1271 0.7698
Ser-Abu-OH 0.9049 0.7945 1.1035 1.1561 NA 1.0410
Ser-HoPhe-OH 0.8204 0.8235 1.5194 0.6878 1.2194 0.9296
Ser-Leu-Leu 0.4183 0.3809 2.4625 1.4483 0.5165 0.7734
Ser-Lys 0.8745 0.8094 1.1511 1.2354 1.0254 0.9042
Ser-Val-Leu 0.5597 0.7961 1.3688 1.4417 NA 0.8337
Sinapoylagmatine 0.9944 1.0487 0.8809 1.1220 0.7935 1.1605
Sinapyl fraxin 0.8881 1.2964 0.8681 0.8931 0.8431 1.2112
Skimmin (7-Hydroxycoumarin-7-O-glucoside) 1.3667 0.9106 1.4094 1.5149 0.4356 0.3628
S-(Methyl)glutathione 1.5117 0.9488 0.5924 0.6924 1.0742 1.1805
S-Methyl-L-cysteine 0.7029 0.9174 0.7725 1.9770 0.6655 0.9647
Spermine 0.9595 0.8306 1.0620 0.8796 1.3738 0.8946
(S)-Peucedanol 0.9652 0.9130 1.0939 1.0183 0.7024 1.3072
Stearidonic acid 0.9801 1.0612 0.8845 1.0646 1.1764 0.8332
Stellarin 0.7059 0.9284 0.8846 0.8611 1.2663 1.3538
Strictamine 0.9215 0.7792 1.2523 1.3251 0.8504 0.8715
Suberylglycine 0.7597 1.0305 1.0319 1.2301 1.2308 0.7170
Succinic anhydride 0.9224 0.9659 1.2594 0.8608 0.9963 0.9952
Succinyladenosine 0.9506 0.4945 1.8297 1.1735 1.1448 0.4071
Sugiol 0.6636 1.8060 2.3352 0.7038 0.2894 0.2019
Suspenolic acid 0.8823 0.9283 1.5070 1.3728 0.6134 0.6962
Symplocosin* 0.8635 0.7630 0.7664 1.2037 1.1320 1.2714
Syringetin-3-O-(6^^-Acetyl)glucoside 0.7808 1.4320 0.8120 0.8762 1.1393 0.9596
Tanegoside 1.0397 1.0989 0.8220 1.0330 0.8229 1.1834
Taxiresinol 1.1190 0.8201 1.2641 1.3659 0.3448 1.0861
Tectochrysin 0.8701 0.7815 2.8220 0.5416 0.3869 0.5980
Tetradecasphinganine* 1.0157 1.0434 1.0313 1.0213 0.9513 0.9370
Tetradecyldiethanolamine 1.0413 1.0099 1.0274 1.0050 0.9766 0.9397
Thiamine (Vitamin B1) 0.9666 0.9649 1.1672 1.2908 1.0183 0.5922
Thr-Ala-Gln 0.6162 0.7845 0.9877 1.0065 1.4471 1.1581
Thr-Asn-Asp 1.6161 1.7422 0.4238 0.6817 0.7782 0.7581
Thr-Asn-Tyr 1.0695 0.6276 1.9035 0.8950 0.9353 0.5691
Thr-Thr 1.1420 0.8387 1.0027 1.0266 0.9969 0.9930
Thr-Tyr 0.8476 0.9284 2.1619 0.4427 1.1547 0.4646
trachelosiaside 0.7960 0.9094 0.5908 0.8645 1.1318 1.7074
Tranexamic Acid 1.0325 0.8220 0.8411 0.4381 0.7913 2.0749
trans-1,2-dihydrodehydroguaiaretic acid 1.7812 2.6226 0.4956 0.4070 0.1926 0.5011
trans-Aconitic acid 0.8665 0.9694 0.9217 1.0548 1.1980 0.9895
Tricin-5-O-Glucoside 0.9955 1.1586 0.3616 0.9085 1.2743 1.3015
Triethylamine 0.9925 1.0110 1.1663 0.8291 0.8929 1.1082
Triethyl citrate 1.0793 0.9643 0.8747 1.0706 0.9108 1.1003
Trigonelline 0.8803 0.9077 0.6697 0.5823 1.0544 1.9055
Trimethyllysine 0.7945 0.9168 1.3636 1.3730 0.7348 0.8174
Tryptamine 1.1878 0.7325 0.9850 1.6470 0.6701 0.7776
Tutin diacetate 1.2999 1.2462 0.8516 0.5919 1.0874 0.9230
Tyr-Ala 0.6444 1.4516 1.2743 1.5141 0.4870 0.6286
Tyrosylleucine 0.7468 0.3240 2.2419 1.3491 0.4435 0.8948
Umbelliferone 7-O-Rutinoside 1.2139 0.7475 1.1142 1.4364 0.4880 NA
Urinatetralin 0.8355 0.8283 0.9464 1.1666 0.9971 1.2261
Val-Trp 0.6499 0.4675 1.5968 2.1477 0.4588 0.6794
Val-Tyr 0.5882 2.2163 1.0544 0.9878 0.5294 0.6239
Val-Val 1.2439 1.0499 0.8248 1.0804 0.8892 0.9119
Vanillin acetate 0.6913 1.0338 1.2659 1.0369 1.0984 0.8737
Vidarabine 1.6899 1.3019 0.5889 0.8682 0.5241 1.0270
Virgatic acid 1.9195 1.4955 0.9902 0.3891 0.7678 0.4379
Vitexdoin C 0.8736 1.0170 1.0425 0.9239 1.1682 0.9748
Vitexin-2^^-O-galactoside 0.7256 1.2688 1.5209 1.2753 0.5043 0.7051
Wogonin-7-O-Glucuronide (Wogonoside) 0.4281 0.4203 1.5867 1.5537 1.3928 0.6184
Xanthurenate-8-O-beta-D-glucoside 0.9490 0.9316 1.0829 0.9098 0.9561 1.1705
Xylocarpin I 0.9229 0.8858 0.9040 0.8231 1.3706 1.0936
Yuanhuanin* 0.8031 0.8750 0.7797 1.0579 1.2523 1.2321
α-Conidendrin 1.0798 0.6987 1.0222 1.2139 1.2004 0.7851
α-D-glucosyl-(1→1^)-3^-amino-3^-deoxy-β-D-glucoside 0.8467 0.9718 1.1140 1.1228 1.2779 0.6669
Α-hydroxyquinoline 1.7417 0.7637 0.9528 1.3987 0.4789 0.6641
β-Nicotinamide mononucleotide 1.7940 1.9193 0.6635 0.5535 0.4036 0.6661
γ-Aminobutyric acid 0.4916 0.5070 0.5816 2.2575 0.2883 1.8739
γ-Glutamyl-L-valine 0.9852 1.4585 1.6965 0.7869 0.4779 0.5950
γ-glutamylmethionine 0.4021 0.5368 1.0704 0.8634 1.6764 1.4509
γ-Glutamyltyrosine 0.6316 1.2328 0.7924 1.2570 0.8851 1.2012
γ-L-Glutamyl-L-[S-(4-hydroxyphenylbenzyl)]cysteine glycine NA NA NA NA 1.0000 NA
δ-Guanidinovaleric acid 0.8954 0.4272 2.8349 0.1553 1.4725 0.2147
δ-Tocotrienol 1.4486 0.6408 1.3891 0.6280 1.6254 0.2683
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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