Metabolite_name RefMet_name A1 B1 G1 L1 S1 T1 Factors - Species:Apple | Variety:Gala Species:Basil | Variety:Sweet Species:Garlic | Variety:Softneck Species:Lettuce | Variety:Iceberg Species:Strawberry | Variety:Honeoye Species:Tomato | Variety:Globe type 10-Hydroxy-2-decenoic acid 5045 466579 5718 797303 4683 6285 12(13)-Epoxy-9Z-octadecenoic acid 12(13)-EpOME 3017715 1933820 5551143 18300176 1866676 19535578 1_2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine 311023 667779 13313 3812290 1568490 232199 1_2-hydroxyfluorene-d9 iSTD 47546 40998 22524 18594 33893 1_3-Cyclohexanedicarboxylic acid 19755 51608 15381 501092 18726 586070 1_4-D-Xylobiose Xylobiose 5577704 37055 317707 709733 2110398 19204 14-O-Acetyldaunomycinone 41 2673733 41 4675 41 41 16-Hydroxyhexadecanoic acid Juniperic acid 370646 1342210 190179 3174834 114391 693351 1_Apigenin-d5 iSTD 39150564 24620538 39049616 27748554 29524190 33729292 1_(beta)-Epigallocatechin Gallate-d3/d4 iSTD 3186749 2905585 2079940 2569029 2200772 2254204 1_Betulinic acid-d3 iSTD 4295771 2747654 2843653 1703095 1580291 4286554 1_CUDA iSTD 71321296 45662116 105638496 68089656 57577464 74887856 1_Daidzein-d4 iSTD 25674690 12255069 24647924 22238726 15726442 17763734 1_Genistein-d4 iSTD 34465540 22682664 33492290 27219686 25959362 29032828 1_Hippuric acid-d5 iSTD 438536224 502476320 246396032 497840864 299128512 393887776 1-O-[(2alpha_3beta_5xi_6beta_9xi_18xi)-2_3_6_23-Tetrahydroxy-28-oxoolean-12-en-28-yl]-beta-D-glucopyranose 9969 8027534 9969 9969 201539 9969 1-O-[(2alpha_3beta_5xi_9xi_18xi)-2_3_23-Trihydroxy-28-oxoolean-12-en-28-yl]-beta-D-glucopyranose 18106 940658 18106 18106 528383 18106 1-Oleoyl-sn-glycero-3-phosphocholine LPC 18:1/0:0 550383 6273060 15838603 4934481 4105095 1511585 1-Palmitoyl-2-linoleoyl-sn-glycero-3-phosphocholine PC 16:0/18:2 4686972 647668 6459178 3321563 1171871 2241619 1-Pentadecanoyl-sn-glycero-3-phosphocholine LPC 15:0/0:0 34433 105626 460082 2079537 44442 262967 1_Quercetin-d3 iSTD 103193064 74680000 103294832 88056744 81598264 92399472 (1R_3R_4S_5R)-1_3_4-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid 9736437 5939 455879 1601488 111 1598983 1_Reserpine-d9 iSTD 92792 37576 83567 33315 77685 64597 (1S_4aR_6aS_6bR_9R_10R_11R_12aR_14bS)-1_10_11-trihydroxy-9-(hydroxymethyl)-2_2_6a_6b_9_12a-hexamethyl-1_3_4_5_6_6a_7_8_8a_10_11_12_13_14b-tetradecahydropicene-4a-carboxylic acid 65226 4093873 290 290 143343 290 1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholine LPC 18:0/0:0 939344 4231932 1451803 4103726 377880 2806256 1_trans-Cinnamic Acid-d5 iSTD 157854 42771 184565 149315 334258 155779 1_trans-Resveratrol-d4 iSTD 4018092 2544940 3702627 3360549 2701214 3089124 2_2-Dimethylglutaric acid 2,2-Dimethylglutaric acid 62093 266956 1926 1660318 82047 708711 2-(2-Hydroxyethoxy)phenol 86867 18730160 603 2012192 63919 658763 2-(3_5-dihydroxy-4-methoxyphenyl)-5_7-dihydroxy-3-[(2S_3R_4R_5R_6S)-3_4_5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one 569633 250021 680 3581 232407 342455 2^_4^_6^-Trihydroxydihydrochalcone 456 456 456 2216622 456 456 2_4-Dichlorobenzoic acid 2,4-Dichlorobenzoic acid 187 276398 187 1644689 195384 5198 2_4-Di-tert-butylphenol 2,4-Ditert-butylphenol 3872 2935651 3872 67242 3872 3872 2^_5^-Dihydroxy-4-methoxychalcone 7711 2254704 6577 257 5991 4383 2_5-Dihydroxybenzaldehyde Gentisate aldehyde 1441301 15831109 7301 574020 957107 825669 2-cis-4-trans-Abscisic acid 575173 38729 116473 54104 268421 120351 2-Furanpropanoic acid_ 3-carboxy-4-methyl-5-propyl- 40601 3059150 99 850962 987005 1942765 (.+/-.)-2-Hydroxyisocaproic acid 2-Hydroxyisocaproic acid 151160 4801717 171775 3631952 1092543 38909 2-Hydroxymyristic acid 2-Hydroxymyristic acid 5497362 34 2638 7097 3144 34 2-Hydroxypalmitic acid 2-Hydroxypalmitic acid 11445055 71759 114318 56813 117544 181796 2-Isopropylmalic acid 2-Isopropylmalic acid 444357 6613436 3469604 1135886 2189234 18828696 2-Linoleoyl-1-palmitoyl-sn-glycero-3-phosphoethanolamine PE 16:0/18:2 10050832 427071 13756539 3564701 4116148 3955419 (2-oxo-2_3-dihydro-1H-indol-3-yl)acetic acid 2-Oxindole-3-acetate 6138 128 128 128 11806 780247 2-Propylglutaric acid 2-Propylglutaric acid 170594 592916 230912 323112 331415 1976521 (2R_3R_4R_6aR_6bS_8aR_14bR)-2_3_12-trihydroxy-4_6a_6b_11_11_14b-hexamethyl-8a-[(2S_3R_4S_5S_6R)-3_4_5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1_2_3_4a_5_6_7_8_9_10_12_12a_14_14a-tetradecahydropicene-4-carboxylic acid 89 22711996 89 89 89 89 (2R_3R_4S_5S_6R)-2-octoxy-6-[[(2S_3R_4S_5R)-3_4_5-trihydroxyoxan-2-yl]oxymethyl]oxane-3_4_5-triol 1320729 70 70 70 70 70 [(2S_3R_4S_5S_6R)-6-[[(2R_3R_4R_5R_6S)-3-[(2S_3R_4R)-3_4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4_5-dihydroxy-6-methyloxan-2-yl]oxymethyl]-3_4_5-trihydroxyoxan-2-yl]oxy-2-(3_4-dihydroxyphenyl)-5_7-dihydroxychromen-4-one 4336 434 434 434 434 13735460 (2S_3S_4S_5R_6R)-6-(3-benzoyloxy-2-hydroxypropoxy)-3_4_5-trihydroxyoxane-2-carboxylic acid 772206 870878 320 320 4803529 536929 3-[(2S_3R_4S_5S_6R)-4_5-dihydroxy-6-(hydroxymethyl)-3-[(2S_3R_4S_5R)-3_4_5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5_7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one 25609 4612636 772 772 92553 772 3^_4^_5_7-Tetrahydroxy-3-methoxyflavone 84 84 84 84 84 84 3_4-Dimethoxy-2^-hydroxy-5^-methylchalcone 289 988044 289 289 289 289 3_5_7_3^_4^-Pentahydroxyflavanone 33222 130 5491 130 335203 130 3_5-Dihydroxybenzoic acid 3,5-Dihydroxybenzoic acid 182596 2047948 151615 475784 976365 206631 3^_5^-Dimethoxy-3_5_7_4^-tetrahydroxyflavone 17491 210 210 210 210 3822 3_7-Dihydroxy-3^_4^-dimethoxyflavone 118345 26649100 30250 606154 220265 21794 3.alpha.-Mannobiose 2444098 135357 588199 390501 1416069 199758 3-Cyclopentene-1-octanoic acid_ 2-(3-hydroxy-1-penten-1-yl)-5-oxo- 18505 881145 48592 2266033 273262 599687 3-Hydroxy-3^_4^-dimethoxyflavone 95 1323019 95 3453 95 95 3-Hydroxybenzaldehyde 3-Hydroxybenzaldehyde 174420 926022 121757 203507 1249164 253243 3-O-Feruloylquinic acid 3-O-Feruloylquinic acid 936644 18 28725 68641 202089 737178 3-phenyl-2-[(2S_3R_4S_5S_6R)-3_4_5-trihydroxy-6-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxyprop-2-enoic acid 119641 230533 956 12036 322186 3122577 4^_5_7-Trihydroxy 3_6_8-trimethoxyflavone 155067 19629200 25862 562948 121538 10912 4_5-Dicaffeoylquinic acid 1917037 96 96 137411 96 1630862 4^_5-Dihydroxy-7-methoxyflavanone 249 17070 249 249 249 249 4-Deoxyphloridzin 6308 6687 10100 753462 5047 1920 4-[(E)-3-[1-carboxy-2-(3_4-dihydroxyphenyl)ethoxy]-3-oxoprop-1-enyl]-2-(3_4-dihydroxyphenyl)-7-hydroxy-2_3-dihydro-1-benzofuran-3-carboxylic acid 16075 59939460 110 74743 110 110 4-Hydroxy-3-methoxyphenethyl alcohol 116 116 116 116 116 562833 4-Isopropylbenzoic acid 4-Isopropylbenzoic acid 92 34250616 8247556 324896 29730 48669 4-Pyridoxic acid 4-Pyridoxic acid 3125 1978481 113738 6669 93 4872 5_3^-Dihydroxy-6_7_4^-trimethoxyflavone 131 3835261 131 131 131 5887 5_7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S_3R_4S_5R)-3_4_5-trihydroxyoxan-2-yl]oxychromen-4-one 484078 20868 3250 156 207372 156 6_4^-Dimethoxy-7-hydroxyisoflavone 336 20921 336 336 336 336 6-[5_7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy-3_4_5-trihydroxyoxane-2-carboxylic acid 4013 104662 7503 8968 19023204 168 6-Hydroxy-2_6_10_10-tetramethyl-1-oxaspiro[4.5]dec-8-yl 6-O-[(2R_3R_4R)-3_4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside 3451432 20657 20657 20657 20657 20657 6-O-Pentopyranosyl-1-O-[(2_6_6-trimethyl-1-cyclohexen-1-yl)carbonyl]-beta-D-glucopyranose 129 1293 129 125021 82306 129 7-Keto-8-aminopelargonic acid 8-Amino-7-oxononanoic acid 225591 3070919 20534 1072088 453698 1146514 8-Hydroxyquinoline-2-carbaldehyde 135102 864830 263029 1655710 49131 181754 9_10-Dihydroxy-12Z-octadecenoic acid 9,10-DiHOME 78583 36026 320167 11718027 166871 5454540 9_12_15-Octadecatrienoic acid_ 3-(hexopyranosyloxy)-2-hydroxypropyl ester_ (9Z_12Z_15Z)- 161626 126853912 2353675 14398370 144844 881226 9-Hydroperoxy-10E_12Z_15Z-octadecatrienoic acid 176638 6571978 482256 9832918 2345562 4892816 9-Oxo-10E_12Z_15Z-octadecatrienoic acid 9-oxo-OTrE 110874 2516066 205102 12331235 1408130 1192970 9-Oxo-11-(3-pentyl-2-oxiranyl)-10E-undecenoic acid 36984 5802378 1284258 16337580 530878 1869958 9S-Hydroperoxy-10E_12Z-octadecadienoic acid 9S-HpODE 2961784 4117456 2053873 12771485 1917647 15781260 9S-Hydroxy-10E_12Z_15Z-octadecatrienoic acid 9S-HOTrE 564494 14798907 1215322 34827536 2323483 5730001 (+)-Abscisic acid Abscisic acid 55198 325 3219 41073 3209299 539383 Abscisic acid Abscisic acid 510054 101268 71238 301167 14263004 2280373 Acetosyringone Acetosyringone 2357 41527 19857 140970 228 686457 Ala-Phe Ala-Phe 857 37025 8565 219845 857 128966 Alternariol 240 240 58862 82162 240 85051 Aminomethylphosphonic acid 3942 276 276 276 276 276 Apigenin Apigenin 259 917034 259 55121 23881 259 Apigenin 7-glucoside 345 128625 345 70676 939446 345 Asn-Ile Asn-Ile 480 49584 480 797507 3273 49969 Asp-Leu Asp-Leu 1626 157322 1626 321981 1626 152690 Atranorin 1264642 2148480 90375 370455 1521417 3035736 Avicularin 54991284 3358 41522 5320 99 6155 Baicalin Baicalin 84158 1174359 161 115907 161 161 beta-D-Glucopyranoside_ 2-phenylethyl 6-O-beta-D-xylopyranosyl- 6188788 154 45801 154 3385831 403775 .beta.-Gentiobiose beta-Gentiobiose 30665754 260088 420330 2972657 8383226 78765 .beta.-Resorcylic acid 176908 2945032 150077 407500 670158 418792 Caffeic acid Caffeic acid 116378 172758464 1259 18301332 300515 5521870 Caftaric acid 8961 16008367 29874 3678305 13185 266 Callistephin 3580 3580 3580 3580 3529022 3580 Calycosin 4657 1676617 2255 3500 225 225 (+)-Catechin Catechin 262 3769 262 262 1820646 262 Caulophyllogenin 35118768 98553288 3222 22873 6139816 173 Cer-AP t34:1 Cer 34:1;O3 37964 5081 533 2934086 19907 533 Cer-AP t40:1 Cer 40:1;O3 34840 44775 393 257061 393 4312 Cer-AP t42:1 Cer 42:1;O3 34119 52417 3773 281484 4381 34612 Cer-AP t42:2 Cer 42:2;O3 107 107 107 141860 107 107 Cercosporamide 16717 6386 2912 5329 291 3945 Chicoric acid 353413 331013509 787273 68946282 759631 320347 Chlorogenic acid Chlorogenic acid 31586088 10903 461 5037512 62849 18414448 Chromone-3-carboxylic acid Chromone-3-carboxylic acid 95751 114 114 114 7570272 67452 cis-Aconitic acid cis-Aconitic acid 472628 1384502 4494456 470800 8440721 3415262 Citric acid Citric acid 19261080 22163448 108237272 9488814 249358336 137909200 Coniferyl aldehyde Coniferyl aldehyde 7995 1421468 71562 144564 4659 185698 Corilagin Corilagin 7768 7768 7768 7768 470686 7768 Corosolic acid 24481666 34603124 1094 11301 492005 1094 Cyanidin-3-glucoside 351637 1586310 42700 350749 19550846 92 Cyanidin-3-O-rhamnoside 367112 132 132 1316 741357 132 Cyanidin cation 26788 341 341 3412 171571 4208 Cynarin 42859980 282885 5914 9844842 117988 22154944 Daphnetin 345885 938099 79 1534390 7693 17779 Delphinidin 3-galactoside cation 129404 47838 338 115675 14889 338 Delphinidin-3-O-(2^^-O-beta-xylopyranosyl-beta-glucopyranoside) 60376 1802306 10491 234 234 234 Delphinidin-3-O-beta-glucopyranoside 67991 49664 1066605 7402 212550 217 DGDG 34:2 DGDG 34:2 2212713 484943 335562 3319366 64217 5054390 DGDG 34:3 DGDG 34:3 1280363 5593471 1118968 3236406 146703 2409134 Dicumarol Dicumarol 2463 8231590 3763 50 50 4419 Digalacturonic acid Digalacturonic acid 19948 28459 315192 8696 1259548 1295325 Dihydromyricetin Dihydromyricetin 31525 27930 94 94 34498 18263 Dinor-12-oxophytodienoic acid 180 29279 4570 458851 180 5587 DL-3_4-Dihydroxyphenyl glycol 3,4-Dihydroxyphenylglycol 36895 1917059 34415 28368 35667 23660 DL-3-Phenyllactic acid Phenyllactic acid 15218 1064204 252234 19302 44620 392968 DL-Arginine Arginine 14247 23325 158343 29525 11361 48421 DL-Isocitric acid lactone 462954 1108894 4063922 468932 9223696 3415262 D-Mannose 6-phosphate Mannose 6-phosphate 558898 224866 143194 491076 805700 1117511 Dodecanedioic acid Dodecanedioic acid 78679 279588 6707 231124 76643 809406 D-Saccharic acid 1_4-lactone 72030 474003 948245 118215 2199914 538847 D-Tartaric acid 56467 158854 47677 110316 75106 45691 D-(+)-Trehalose Trehalose 2639243 28378 298064 270833 899258 77424 Ellagic acid Ellagic acid 14349 280 5877 280 4198039 280 Engeletin 5047 23325 5279 505 13403371 22646 Epiafzelechin (2R_3R)(-) 89 89 3229 89 5033000 89 Epicatechin Epicatechin 53870404 72239 694 41542 6254216 21745 (-)-Epigallocatechin Epigallocatechin 1428 1428 1428 1428 14434 31158 Epigallocatechin gallate Epigallocatechin 3-O-gallate 19725 35405 139 123686 180144 292330 Eriodictyol-7-O-glucoside 186857 712674 37644 19761 3391916 31523 Ethyl gallate 90016 566241 151110 66979 196037 49116 Ethyl p-coumarate 69 69 24995 69 39245 21052 Ethyl trans-caffeate 146 146 5693 146 174836 4678 FAHFA 18:1 FAHFA 18:1;O 73655 339720 148612 18086148 147520 945506 Ferulic acid trans-Ferulic acid 84897 1098047 597254 257297 187339 1072309 Fisetin 24715 1169484 144 282539 347272 3428 Flavanomarein 199 199 31126 199 51082 232529 Fumarprotocetraric acid Fumarprotocetraric acid 743 10298354 743 345526 743 743 Galactinol Galactinol 1232950 65363 300961 219701 701705 116565 .gamma.-Glu-Cys gamma-Glutamylcysteine 6001 1460786 2090363 253725 45138 65904 .gamma.-Glutamyl-(S)-allyl-L-cysteine 5094480 3243826 1533950955 3239268 52592827 3275984 GlcADG 34:2 DGGA 34:2 146070 105 7441 124148 4184 984133 GlcADG 36:4 DGGA 36:4 108481 71 8743 52249 17951 1219733 Gln-Leu Gln-Leu 963 112594 963 812349 963 67752 Gln-Phe Gln-Phe 686 20754 686 337743 686 50164 Glu-Leu Glu-Leu 583 308563 338176 1088567 5826 630938 Glu-Phe Glu-Phe 80 30123 3856378 218838 80 203598 Glycyl-L-norleucine 344 367106 344 538263 6424 121708 Gly-Phe Gly-Phe 1539 43255 16116 337443 1539 155296 Gossypetin 3-methylether 5429 69 69 69 69 69 Gossypin Gossypin 104 104 104 2765 104 104 Guaiaverin 26058939 9832 36770 1837 110623 5920 HexCer-AP t34:1 HexCer 34:1;O3 1215107 2522424 46879 17254169 631514 148469 HexCer-AP t38:1 HexCer 38:1;O3 60405 44421 237 237 237 3961 HexCer-NS d34:2 HexCer 34:2;O2 992287 48191 525915 397 452566 552659 (-)-Homoeriodictyol 1738 91 1759 91 21124 3589 Hydroferulic acid Dihydroferulic acid 220 220 63308 49478 220 513153 Ideain 767 7674 82986 767 3197964 767 Ile-Gly-Ile Ile-Gly-Ile 158 1578 6904 480465 158 102351 Ile-Leu Ile-Leu 215 8089 140756 584206 31630 723262 Ile-Phe Ile-Phe 1854 171377 27965 322538 21320 542241 Isochlorogenic acid b 88520240 16039 185 22075488 126602 45103380 Isoquercitin 28448302 1912898 98967 528036 7517390 88199 Isorhamnetin Isorhamnetin 21701 90 85895 90 48618 898 Isorhamnetin-3-glucoside 198323 42894 252232 3239 3023280 77770 Isorhamnetin-3-O-rutinoside Isorhamnetin-3-O-rutinoside 74 74 74 74 881861 1090 Jasmonic acid Jasmonic acid 106 2527170 84982 1177792 2392 53547 Jasmonyl isoleucine 246 1468156 246 434430 6616 4981 Kaempferol-3-O-glucoside Kaempferol-3-O-glucoside 8127 90 90 90 531322 90 Kaempferol-7-O-neohesperidoside Kaempferol-7-O-neohesperidoside 1233 12327 1233 1233 583601 1233 Ketoprofen .beta.-D-glucuronide 7717 719 719 719 719 719 L-(-)-3-Phenyllactic acid L-3-Phenyllactic acid 9406 44218 691999 131492 21680 60610 L-Alanyl-L-norleucine 1309 243946 1309 555134 1309 363768 Leu-Gly-Leu Leu-Gly-Leu 1154 15642 11539 365563 1154 97280 Leu-Ile Leu-Ile 1766 226673 79963 107020 28532 894146 Leu-Pro Leu-Pro 1844 18437 50396 236584 1844 24462 L-Glutamic acid Glutamic acid 49432 187579 95595 59661 119426 1647843 Linoleic acid Linoleic acid 247198 1207247 1548998 6345263 10660 1326620 Lithospermic acid 4219 3832467 4219 4219 4219 4219 LPA 16:0 LPA 16:0 371970 4645840 779954 26169686 3025991 5608828 LPC 12:0 LPC 12:0 86 86 86 86 467931 86 LPC 14:0 LPC 14:0 93904 17561 334462 442144 1140922 163502 LPC 16:0 LPC 16:0 6233225 26808518 34691300 66274572 8513804 32414390 LPC 16:1 LPC 16:1 6371 455428 1228292 683722 268190 171057 LPC 18:2 LPC 18:2 6914336 25091344 71689472 73401864 8452519 30580634 LPC 18:3 LPC 18:3 558204 22691424 3388558 37642032 3610832 4838558 LPC 20:2 LPC 20:2 57327 186412 221964 1365607 18797 74759 LPE 15:0 LPE 15:0 3427 88190 564488 1489849 343 177222 LPE 16:0 LPE 16:0 1889121 22295636 41859468 59685524 1541060 25121424 LPE 16:1 LPE 16:1 287 212758 910847 430131 17311 78214 LPE 18:0 LPE 18:0 272399 1882893 697434 2072580 109089 1992086 LPE 18:1 LPE 18:1 108623 1932519 10076390 3401324 484048 491668 LPE 18:2 LPE 18:2 5253520 18318432 58736872 60264832 2482998 21148892 LPE 18:3 LPE 18:3 324990 12477653 1766967 23698978 839599 2982260 LPE 20:0 LPE 20:0 100507 617686 50659 1869695 33776 901588 LPE 22:0 LPE 22:0 158341 205 140532 1436810 32933 339229 LPG 16:0 LPG 16:0 360928 12326666 2458274 17277230 579583 2662510 LPG 18:2 LPG 18:2 165834 2094572 1688970 3935299 214678 360823 LPG 18:3 LPG 18:3 11413 2144993 80855 2183624 132485 17556 LPI 16:0 LPI 16:0 500977 1281277 1375911 8161422 683621 1084460 LPI 18:3 LPI 18:3 143027 1582394 198951 712768 250539 550958 L-Tryptophan Tryptophan 512421 4154401 11766804 39491492 27615056 54476985 Luteolin 7-glucoside 86950 2088811 42084 252 155041 8759 Madecassic acid 306265 498417 3462 280 10213 280 Malioxamycin 37154292 13446118 3567695 20275040 10845865 6151934 Malvidin 3_5-diglucoside cation 119380 157 3758 6716 157 1630 Maritimein 126 126 126 126 1358252 126 Medicagenic acid 2878871 2075923 65 65 17916 65 MGDG 34:3 MGDG 34:3 257 961671 118998 107216 257 400592 MGDG 36:5 MGDG 36:5 583084 6558375 759108 2295217 149163 3429518 MGDG 36:6 MGDG 36:6 2412486 55895672 2340993 21900372 800335 4470536 m-Hydroxybenzoylecgonine 131739 77766 133301 110672 1288983 94681 Myricetin Myricetin 236153 23152 90607 44360 39717 65096 N-Acetylleucine N-Acetylleucine 39459 888322 472142 1757907 68807 1545839 N-Acetyl-L-phenylalanine N-Acetylphenylalanine 113667 3186963 567886 659552 113872 6691864 N-Acetyltryptophan N-Acetyl-tryptophan 27673750 1707301 69756 116224 83 77059512 Naringenin Naringenin 13269 176 22922 6170 37400 3665781 naringenin-7-O-glucoside Naringenin-7-O-glucoside 308 319844 4967 308 1298956 266601 Narirutin Narirutin 10159 223 2226 4581 743356 223 N-Caffeoyl-O-methyltyramine 282 282 10643914 282 282 3722395 NCGC00380817-01_C15H20O9_ 49864 2649 2649 2649 908812 2649 Neochlorogenic acid Neochlorogenic acid 7957714 200 200 317853 200 1107358 N-Methyl-L-phenylalanine 177058 43248 52589 141 608624 136802 N-(Phenylacetyl)-L-phenylalanine 227 17405 4187612 186967 12565 385812 Oenin 387 387 387 387 12278 387 omega-Benzoyloxyphloracetophenone 110 111007 10484 110 13055744 110 O_O-Dimethyl dithiophosphate 8568 8568 8568 8568 6211801 8568 OxPI 34:2+1O PI 34:2 291149 139 659411 415474 71753 456049 PA 36:5 PA 36:5 394700 1522387 283611 2454345 1263693 3481658 PA 38:5 PA 38:5 5231 66970 35055 22598 207 1627666 PA 38:6 PA 38:6 3403 47220 22078 216 216 825005 Palatinose Palatinose 19546 213649 13112 46538 187 2640582 PC 36:4 PC 36:4 9747533 761629 9235840 6034160 3379532 2827537 PC 36:5 PC 36:5 4208913 1485383 2166380 13493918 4181534 2393592 PE 34:3 PE 34:3 1883610 477996 1313564 3411622 3904490 2134882 PE 36:4 PE 36:4 24025038 954378 9990816 5318540 7150680 4048790 PE 36:5 PE 36:5 5665577 785330 1173964 7918816 7824913 1944475 Pelargonidin cation 93 5910 4967 93 1201019 93 Petunidin 3-glucoside cation 7135 21152 127 7922 127 127 PG 32:1 PG 32:1 431363 135293 317497 5706844 3135130 99879 PG 34:3 PG 34:3 487350 5751348 340604 5447136 1439568 301059 Phe-Glu Phe-Glu 117 82951 623035776 365218 237891 1199342 Phenylpyruvic acid Phenylpyruvic acid 423252 6198997 1075277 841328 13390448 1407858 Pheophorbide a Pheophorbide a 175 1159815 175 7552 175 175 Phloretin Phloretin 2305139 100 100 100 489125 100 Phlorizin Phlorizin 67274520 1091657 789142 29586 14915794 2728 Phloroglucinocarboxaldehyde 277931 103023 146629 152281 1525141 298714 Phloroglucinolcarboxylic acid 42620 27651 1095 125054 199928 382456 Phytic acid Myo-inositol hexakisphosphate 137 137 137 137 137 137 Pinocembrin 80562 17354 70264 59304 647208 46885 Pinocembrine 69525 30842 46382 902 2161909 61737 (+)-Pinoresinol Pinoresinol 174 1035344 7249 174 7208 174 Polydatin Piceid 41706 165 42254 5690 236798 165 Procyanidin A2 155664 124 3190 124 21120 124 Procyanidin B1 Procyanidin B1 547079 304 3039 304 3522728 304 Procyanidin B2 Procyanidin B2 17040516 31632 6105 6105 20847640 6105 Procyanidin C1 489958 114 114 114 6721844 114 Purpurin Purpurin 271 271 2929 24445 271 271 Quercetagetin-7-O-glucoside 2198 175 3674 175 102362 175 Quercetagetinidin cation 77724 5130 30544 4030 7443 15730 Quercetin Quercetin 83 83 83 6133 83 83 Quercetin 3_4^-di-O-glucoside 465283 68052 43052 6561 55419 7249 Quercetin 3-glucoside Quercetin 3-glucoside 1526871 96 96 96 222375 96 Quercetin-3-O-alpha-L-rhamnopyranoside 38251744 476850 42700 82539 5048789 11173 Quercetin 3-O-.beta.-D-glucose-6^-acetate 20184 107672 266 150911 69476 266 quercetin-3-O-deoxyhexosyl(1-2)pentoside 3220 322 322 322 322 322 Quercetin-3-O-glucose-6^^-acetate 253290 840749 458 6034038 579101 3557 quercetin 3-O-glucuronide 157874 85240 67640 5847818 129870000 25462 Quercetin 3-O-malonylglucoside Quercetin 3-O-malonylglucoside 497349 1775351 1590 12546105 1195544 1590 (-)-Quinic acid Quinic acid 14463730 343676 54475 3601486 584153 3378620 Rhamnetin 11486 166 166 166 8130 166 Rhoifolin 240 240 240 13968 15989787 240 ROSMARINIC ACID Rosmarinic acid 873694 1060732800 153136 4334812 580888 128977 Rutin Rutin 3653639 1046174 62342 145960 1416115 402622 Salvianolic acid B 14543 66904656 14331 198547 51576 532 Scutellarin 23103 368228 2194 5120786 54587316 219 Sebacic acid Sebacic acid 10023 129 4956 985103 17934 24317 Ser-Leu Ser-Leu 2565 584630 25652 1501868 48620 170415 Ser-Phe Ser-Phe 1615 41215 16153 409894 1615 151275 Sinapic acid Sinapic acid 5271 459 175853 4587 459 46218 Spiraeoside 371995 4225 14975 14394 229634 7843 SQDG 31:1 SQDG 31:1 7816 1778214 782 90109 63857 25246 SQDG 32:0 SQDG 32:0 488854 9196479 286051 3621494 1474246 649066 SQDG 34:2 SQDG 34:2 257179 3816108 106956 1375852 43184 2654558 SQDG 34:3 SQDG 34:3 1281241 28966270 421261 12560903 3050755 1056202 SQDG 36:3 SQDG 36:3 230038 2305540 91387 1141511 385233 147972 SQDG 36:6 SQDG 36:6 134973 9997273 9082 4137428 343702 356 Sucrose Sucrose 2072822 5136 212417 240710 712393 39215 Syringetin 3-glucoside 2121 108270 1846 4381 19624 185 Theaflavin Theaflavin 1638 1638 1638 1638 1638 1638 Thr-Leu Thr-Leu 1388 250118 1388 13875 570332 334792 Thr-Phe Thr-Phe 2157 597502 21571 201357 2157 80365 Thr-Val-Leu Thr-Val-Leu 413 11566 413 280729 413 30460 Tiliroside 6511 124 124 124 2183211 124 trans-3_5-Dimethoxy-4-hydroxycinnamaldehyde Sinapoyl aldehyde 2756 151 151 689514 7879 6272 trans-Ferulic acid trans-Ferulic acid 44007 3758675 45159 67328 8013 70221 trans-Traumatic acid Traumatic acid 13257 6840768 50498 4775296 29602 299455 Tricin methyl ether 221 5567996 221 221 221 8446 Tryptophan Tryptophan 349537 3884726 11659114 37961096 26830600 51877560 Tyr-Leu Tyr-Leu 3953 77258 39533 45725 3953 185475 (+)-Usnic acid 11947 14864 9708 193 193 3862 Vaccenic acid cis-Vaccenic acid 108926 140689 160480 127018 19618 105877 Val-Ile Val-Ile 90 74683 110274 367335 90 128367 Val-Leu Val-Leu 1504 99911 223465 932892 1504 484910 Val-Phe Val-Phe 1581 66505 38814 348170 1581 474087 y-Linolenic acid gamma-Linolenic acid 14902 8740648 204984 6613559 5130 523617