Compound P_0.5_PA P_0.5_PB p0.5_PA p0.5_PB P_1_PA P_1_PB p1_PA p1_PB P_2_PA P_2_PB p2_PA p2_PB P_4_PA P_4_PB p4_PA p4_PB P_DMSO_PA P_DMSO_PB pDMSO_PA pDMSO_PB 1-hexadecanyl-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine 1 1 1 1 361866 355590 1 1 376760 388430 1 1 497966 519061 1 1 573825 560106 321713 994555 11-Octadecen-1-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DAT(19:0/24:0(2Me[S],4Me[S]))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "26,26,26-trifluoro-25-hydroxyvitamin D3 / 26,26,26-trifluoro-25-hydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 76684 1 1 1 1 1 1 1 1 1 1 "3beta-hydroxy-estra-5,7,9-trien-17-one" 1 1 1 1 1 1 1 1 1 1 1 56431 1 1 1 1 1 1 1 1 17-tetracosenal 1 1 1 1 1 1 1 1 1 1 1 162267 1 1 1 1 1 1 1 1 "(-)-16alpha,17-Dihydroxy-atisan-3-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "12,13-dihydroxy-11-methoxy-9-octadecenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Salvisyriacolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(16:1(9Z)/0:0/16:1(9Z)) (d5) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2?-(3-Hydroxypropyl)-1?,25-dihydroxy-19-norvitamin D3" 325054 335432 1 302381 265619 287094 301333 438767 262051 250975 1 1 1 1 1 590140 628248 709015 1178186 1419093 Acuminatoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-16:0/15:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-3GalNAcbeta1-4(NeuGcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Stearamide 1 1 1 1 20836 1 1 1 1 127634 1 1 1 1 49442 1 1 87369 14949 1 24-hydroxy-10Z-tetracosenoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 hexadecanedioic acid mono-L-carnitine ester 1 1 19131 48905 1 1 95257 58055 1 1 1 1 1 1 1 1 1 1 1 1 "(23S,25R)-1?,23,25,26-tetrahydroxyvitamin D3 / (23S,25R)-1?,23,25,26-tetrahydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-amino-dodecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25311 1 1 26048 15827 Amphotericin B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(22:1(11Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,2',4',5'-Tetrahydroxy-3-(3-hydroxy-3-methylbutyl)-6'',6''-dimethylpyrano[2'',3'':7,8]flavone" 1 1 41756 43858 1 1 1 66978 1 1 333132 331335 1 1 93234 109677 48161 63744 281692 312504 Galalpha1-3(Fucalpha1-2)Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z)) 71939 85749 1 1 91837 579742 1 1 56747 241097 1 28978 28223 19529 1 1 63996 358129 1 1 PI(20:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/18:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 2597764 6168746 1 1 2981954 4371582 1 1 4353045 2386184 1199576 1 3268129 4637319 1920824 1484898 1808023 5764280 690569 1 "DG(13:0/20:3(8Z,11Z,14Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 83807 1 1 1 1 10-oxo-docosanoic acid 1 58865 1 1 1 36669 59506 114882 1 1 1 1 1 1 92712 98523 117758 133537 154661 143030 PC(O-18:1(11Z)/0:0) 75168 98463 1 1 64414 59641 177265 206955 1 1 1 1 1 1 340883 361005 1 1 1 1 "1,13-Dihydroxy-herbertene" 1 1 1 1 1 1 1 24358 1 17883 12827 1 1 16997 15568 33555 1 1 24335 44591 9Z-Hexacosene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Amoritin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)N-(1-methyl-2-hydroxy-2-phenyl-ethyl) arachidonyl amine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,7-Diethyl-9-methyl-3E,5E,7E,9E-tridecatetraene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "12,15-epoxy-13,14-dimethyleicosa-12,14-dienoic acid" 51164 1 1 57969 1 40546 1 70540 1 1 250786 204930 1 1 1 1 52805 1 1 134950 "PE(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Spruceanol 1 1 1 1 1 32978 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-HOME(8) 381074 863149 1 1 105029 2503531 1 22294 56990 565433 499912 1 1366437 823134 852800 1 83822 212702 1 1 "4,4'-Diapophytoene/ Dehydrosqualene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 88690 1 "PC(20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 563749 1 1 1 1 1 1 1 1 1 1 1 1 1 "11E,14E-Octadecadienal" 1702957 2076122 204667 125712 2416654 1571652 2204287 1332799 860731 1649026 201199 1 3243089 3074387 1620863 1 2986416 3996158 3159577 335748 "PA(17:2(9Z,12Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-oleoyl histidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d17:1/24:1) 53485 1 1 1 1 1 1 1 62400 1 1 1 1 1 1 1 1 1 1 1 N-heptanoyl-homoserine lactone 32510 42329 1 1 1 47131 1 1 51850 43213 1 1 31120 1 1 200339 1 1 1 1 "Anandamide (20:5, n-3)" 1 1 1 1 1 1 1 12735 1 1 1 1 1 1 1 1 1 1 1 1 11(R)-HEDE 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(14:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1570417 "DG(13:0/18:3(9Z,12Z,15Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 112919 1 1 1 1 1 2-amino-4-oxo-pentanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (R)-Stearoylcarnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d14:1(4E)/18:1(9Z)(2OH)) 1 1 1 1 1 1 304018 1 1 1 1 1 1 1 1 51439 1 1 1 1 "(E)-3,7-Dimethyl-2,6-octadienyl decanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Quercetol B 1 1 1 1 1 1 1 1 1 1 1 49349 1 1 1 1 1 1 1 1 "16,17-didehydroprogesterone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(12:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/20:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPC(20:4(5Z,8Z,11Z,14Z))" 1 1 106125 1 1 1 1 231571 1 1 1 1 1 1 1 295380 1 1 280889 342470 "PS(17:2(9Z,12Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(19:1(9Z)/0:0) 1 1 68567 36206 1 1 32277 145946 1 1 110353 1 1 1 1 67893 1 1 80879 136120 "Anandamide (20:l, n-9)" 1 36085 54397 72710 1 1 68896 126982 1 26107 644104 229787 31421 27647 229092 216393 135991 120229 214316 286911 "(20S)-14?,20,25-trihydroxy-26,27-dimethylvitamin D3 / (20S)-1?,20,25-trihydroxy-26,27-dimethylcholecalciferol" 1 1 59710 1 1 1 67849 44074 1 1 1 1 1 1 1 1 1 1 1 1 "PC(14:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 25831 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14-methyl-1-pentadecanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(23R)-23-Hydroxy-3,7-dioxo-5beta-cholan-24-oic Acid" 1 1 1 1 1 63277 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-Methylheptacosan-2-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/20:0) 1 1 1 1 1 1 103376 1 1 1 385058 303882 1 1 1 1 98465 215512 130033 1 "Malvidin 3,7-diglucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Stearoylethanolamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(13:0/20:2(11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/14:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 94486 100908 1 1 144250 136299 1 1 113642 123140 88821 58948 106557 110132 1 67580 1 74296 1 36106 2-heptenedial 1 1 1 1 48711 1 1 1 1 1 1 1 18982 1 1 1 1 1 1 1 "1?,25-dihydroxy-21-nor-20-oxavitamin D3 / 1?,25-dihydroxy-21-nor-20-oxacholecalciferol" 1 1 1 1 1 13689 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LBPA(18:1(9Z)/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,6-Dimethyl-2E,4E,6E-nonatriene" 1 1 1 1 1 1 1 13899 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-14:0/O-1:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galalpha1-3(Fucalpha1-2)Galbeta1-4Glcbeta-Cer(d18:1/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,4-dimethylcyclohexane" 3077213 4136840 267394 807156 2932737 7809726 143551 5523222 2345553 5801330 1 1351274 5985820 2101543 1.67E+07 166668 6228503 7215407 975589 1 FMC-5(d18:1/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oleamide 295394 728426 83135 1 633824 2977434 1325866 467876 55642 1387409 1 1757499 401889 2593495 2631204 103131 72525 19582 207433 236759 "PA(O-20:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1119503 1217710 456782 1080818 783400 771388 764610 890261 820317 871609 4034111 3764394 944425 1000771 3049954 2922945 1110234 1462730 4642225 4371761 "PI(P-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 48489 1 1 1 1 1 1 1 1 1 LysoPC(20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-3-Carene 1 1 1 1 1 15152 1 1 14424 1 33638 1 70753 1 47401 1 22081 212709 1 1 "2',6'-Dimethoxy-3',4'-methylenedioxydihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 54518 1 1 1 1 1 1 1 1 PI(16:0/0:0) 1 1 1 1 1 1 1 1 1 1 746223 1 1 1 1 1 1 1 1 1 "(3Z,6Z,9Z)-dodecatrienol" 1 1 14314 1 1 1 24318 1 1 1 1 1 1 1 1 1 12141 1 11162 1 TG(12:0/17:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-13(16),14-Spongiadiene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6,10-Dimethyl-5(E),9-undecadien-2-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(15:0/21:0/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-18:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 129153 1 1 1 1 1 1 1 1 1 "4,10-undecadiynal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Kanshone A 1 1 1 1 158725 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(20:1(11Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20S)-1?,20,25-trihydroxy-24a-homovitamin D3 / (20S)-1?,20,25-trihydroxy-24a-homocholecalciferol" 1 1 931109 392530 1 1 704000 447143 1 1 1 80261 1 1 106107 66027 1 1 78545 58192 "PA(16:0/22:2(13Z,16Z))" 1 224037 1 1 1 129848 1 107556 1 1 354787 265815 1 193767 241358 178343 1 137660 1 370620 13-Methyl-1-tritriacontene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10687 1 1 1 "PA(O-16:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/17:2(9Z,12Z))" 1 1 1 1 85681 1 1 1 1 1 1 210085 1 1 1 1 79810 1 136468 1 16-Methylheptadecyl isobutyrate 1 1 54948 1 1 1 43970 86075 1 1 1 1 27059 1 1 1 1 1 1 1 PE-Cer(d16:1(4E)/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Stolondiol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-16:0/16:1(9Z)) 1 1 1 1 1 1 40625 53047 1 35267 209203 164191 199685 33061 194486 171762 87665 86785 231986 213649 14-Methylpentadecyl isobutyrate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,4-Epoxy-6Z,9Z-eicosadiene" 1 1 1 1 1 1 1 1 1 1 56199 1 1 1 1 1 1 1 1 30802 (Z)-11-Hexadecenyl formate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12740 1 1 1 "(2S,6R,8S)-2,8-Dimethyl-1,7-dioxaspiro[5.5]undecane" 765864 808279 1133406 1097419 523427 552320 1422134 1809636 528445 526825 12251 1 552099 548063 2414162 2472607 2004241 2154604 3201621 3514002 19-norcholestanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Troleandomycin 1 1 67486 81884 1 1 49768 103149 1 1 278681 244842 1 1 85503 86351 1 1 200184 209962 25-hydroxyvitamin D2 25-(?-glucuronide) / 25 hydroxyergocalciferol 25-(?-glucuronide) 1 1 32396 62934 1 1 57049 59325 1 1 450496 335496 1 1 127806 130483 1 1 335242 369077 (+)-24-Dammarene-3beta-20S-diol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-octadecenal 1 1 1 1 190926 1 104493 1 1 105769 1 1 1 1 329189 30120 1 1 765297 53460 Gibberellin A24 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dodecaprenyl phosphate-galacturonic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 24E-ethylidene-cholest-5-en-3beta-ol 3-O--beta-D-glucopyranoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 KAPA 1 1 16069 24028 1 1 51324 35071 1 1 74436 25622 1 1 41148 22184 1 1 1 22694 "24a,24b-epoxy-23-tetradehydro-24a,24b-dihomo-1?,25-dihydroxyvitamin D3 / 24a,24b-epoxy-23-tetradehydro-24a,24b-dihomo-1?,25-dihydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 podocarpic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Anandamide (20:2, n-6)" 139770 147773 127623 1 62629 81516 98477 187836 88086 78297 1 1 77094 106577 161899 97348 1 264114 1 1 "1'',2''-Dihydro-2'-hydroxycycloosajin" 1 1 60808 1 85526 1 61586 1 1 1 1 1 1 1 202891 242893 384629 1 233322 250300 1-(6-[5]-ladderane-hexanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5S-HETE di-endoperoxide 1 1 1 1 20979 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "bacteriohopane-32,33-diol-34,35-dicarbamate" 1 1 1 1 36346 1 40021 53617 1 35267 207004 163312 1 34047 194486 1 87665 86785 239861 208685 "13,13-dimethyl-tetradecanoic acid" 1 1 1 1 1 1 1 64254 1 1 175060 1 1 10280 1 1 1 1 68543 98641 14S-Methyl-1-octadecene 682319 1 1 15546 1 1 1 58501 481100 1 1 1 1 495789 96893 134633 513700 1 183159 110626 "PE(22:5(4Z,7Z,10Z,13Z,16Z)/P-18:1(11Z))" 479440 892282 1379873 1085047 677735 658656 1665668 2190824 741759 609402 4708449 3981554 419365 456167 4980320 4541594 1492350 1656022 3966145 4014698 Limocitrol 3-[alpha-L-arabinopyranosyl-(1-3)[galactosyl-(1-6)]-galactoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(17:0/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 373046 1 1 1 1 1 1 1 218830 232371 1 1 1 1 PI(18:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "14,14,14-Trifluoro-11Z-tetradecenyl acetate" 1 1 1 1 1 1 1 1 1 1 1 10994 1 1 1 1 1 1 1 1 PS(12:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 508663 370149 DG(21:0/21:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-8,16-Dihydroxy-19-serrulatanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6-Ethyl-4-methyl-3E,5E,7E-decatriene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d18:0/26:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (R)-2-Amino-3-hydroxypropanoic acid 23952 1 1 1 1 1 1 1 1 36669 1 1 21363 1 1 1 1 1 1 1 N-acetylsphingosine 1-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Estradiol valerate 1 1 58756 53790 1 1 1 86814 1 1 1 1 1 1 1 62457 1 1 1 1 (21-Methyl-8Z-pentatriacontene 91638 75154 1 1 1 1 1 162967 49302 51998 1 1 1 1 1 1 85051 90966 131426 134220 dodecanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+)-18-Hydroxy-7,16-sacculatadiene-11,12-dial" 1 1 1 1 1 1 1 1 1 1 1 1 1 36708 1 1 1 1 1 1 10-keto palmitic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(17:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "7E,10-undecadien-4-olide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-14-Methyl palmitic acid 3657763 3756784 62130 105734 2360018 2230848 378162 102941 2523327 2619405 381751 1 2631370 2661449 1858553 604327 2607981 2924311 1355934 352984 Malvidin 3-glucoside-4-vinylguaiacol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Linoleyl palmitate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 FMC-5(d18:1/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(19:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(17:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(18:2(9Z,12Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13R-Methyl-6E-heneicosene 1 1 52333 48884 1 1 45483 82516 1 1 1 1 1 1 165582 187326 27441 58159 83388 136167 "38:5(20Z,23Z,26Z,29Z,32Z)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C17 Sphinganine 3691528 3901116 80401 94319 2374331 2242389 74597 146819 2558192 2556464 707100 1 2654316 2667597 1569112 247636 2652388 2973350 1233934 312440 "3,5-Di-O-methyl-8-prenylafzelechin-4beta-ol" 44840 615371 1 1 1 550356 30716 1 347354 68817 327939 1 16657 1 528647 152181 513586 678108 393015 1 Penaresidin B 1 1 1 1 1 1 1 25726 1 1 99722 1 1 1 38159 27296 17448 30332 107410 114781 Chamuvaritin 1 1 446221 440601 1 1 1 545575 1 1 3118740 3092940 1 1 154661 731773 1 1 265601 3146097 "10,14-Dimethyl-1-octadecene" 1 1 1 35077 1 1 44145 64899 1 1 1 1 1 1 102342 128529 21078 14636 81424 103307 "TG(15:0/22:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(19:0/0:0) 243661 224882 1 226936 137066 135165 340593 426750 186397 166605 141190 116589 183712 179293 114374 465533 98793 1 1056042 50698 PC(24:0/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-cis-Deguelin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(11Z))" 1 1 499855 1 149730 156762 1 765043 175483 174166 916671 751903 1 1 1554413 1525425 1 1 752931 776626 "1,16-Heptadecadien-3-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-[3]-ladderane-decanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d16:1(4E)/20:0(2OH)) 1 1 1 1 1 1 1 31362 1 1 1 37324 1 1 1 1 1 1 31044 1 20-oxo-heneicosanoic acid 16916 1 1 1 1 1 1 1 1 1 1 1 1 19895 1 1 1 22905 75922 1 "anteiso (4E,14-methyl-d16:1) sphingosine" 147971 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17676 1 1 GlcCer(d18:1/26:1(17Z)) 780837 249318 1 1 368800 743175 13168 1 108414 1 1 13371 836475 1 1 258564 28249 419012 328498 1 SQDG(16:0/14:0) 701035 691272 1085615 1134187 710685 697391 1631575 2004091 679118 639461 4539059 3755604 556979 118789 4494200 4430355 1624013 1562092 4011060 3932167 Hydroxyphthioceranic acid (C39) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Coenzyme Q9 1 1 1 1 1 1 1 1 1 1 1 73703 1 1 1 1 1 1 1 1 PS(17:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 202705 Linoleyl stearate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Kaempferol 3-p-coumarate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 30-(-2-(O-2-hydroxy-ethane)-3-hydroxy-propane)-hopane 1532433 2868308 380212 82309 179159 1 56556 14032 1214006 7070761 395084 768665 573570 124936 1 228080 147263 3098164 2409352 63021 2-Amino-3-methylbutanoic acid 3148193 3280604 189631 181340 3327984 3215544 205993 306650 3390745 3206396 1 1 1875162 1 401218 454805 1298068 1 1039966 1154417 "PI(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-O-(Glcb)-6-O-(Glcb)-(25R)-5alpha-spirostan-3beta,6alpha,23S-triol" 1 1 52785 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 249450 "(R)-5-Hydroxy-2,4-dimethoxydalbergiquinol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 554646 11-dehydro-TXB2-d4 1 1 142375 149335 1 1 133883 195606 1 1 612684 430492 1 1 1 1 1 1 519655 547468 TG(12:0/18:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(t18:0/26:0(2-OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-stearoyl taurine 1 1 1 1 18338 19306 341664 1 1 1 1 1 20706 1 11839 1 388623 379569 1 12037 10-HpODE 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(8-[3]-ladderane-octanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphoethanolamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 ?-Vinyl acrylic acid 137933 1 280405 185647 182658 176085 1 470922 173541 167929 1 397673 113372 108087 985342 46067 96309 86496 365909 244686 Cholest-5-ene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(18:1(9Z)/0:0/18:1(9Z)) (d5) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2alpha,7beta,15beta,18-tetraacetoxy-cholest-5-en-3alpha-ol" 66162 1 1 13817 1 1 1 1 1 1 1 1 1 1 1 1 1 1 74405 91707 Cholesteryl 11-hydroperoxy-eicosatetraenoate 37311 186751 717937 1409762 1792773 16311 2460259 1136008 2459994 186029 207062 1912451 226402 2273796 13375 5262992 722669 695731 8582019 397714 PI(12:0/12:0) 1 1 67348 66289 1 1 64599 77095 1 1 412462 335650 1 1 178476 178923 1 1 299073 340140 "PS(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2E,5E)-Undecadienal" 1 1 1 1 1 29903 1 1 1 1 147679 1 26587 1 1 1 1 1 1 1 "16:4(4Z,7Z,10Z,13Z)" 1 1 1 1 26082 439129 1 1 1 1 1 1 105430 1 1 1 1 1 66189 1 PC(10:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6beta-acetoxy-24-methylcholestan-3beta,5alpha,22R,24-tetrol" 75168 98463 1 150328 64414 59641 177265 206955 1 1 1 1 1 1 341306 361005 1 1 1 1 "2-nonene-4,6,8-triynal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:4(6Z,9Z,12Z,15Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:2/24:0) 93116 117132 1 1 98049 123827 1 1 120399 121802 92384 69993 101843 115262 1 1 1 37779 1 1 "(6RS)-6,19-epidioxy-24,24-difluoro-25-hydroxy-6,19-dihydrovitamin D3 / (6RS)-6,19-epidioxy-24,24-difluoro-25-hydroxy-6,19-dihydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/19:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,1'-(OH)2-3,4,3',4'-Tetradehydrolycopene" 27733 1 1 302095 1 1 534977 216285 1 1 148539 347013 1 1 23654 41071 1 49756 134106 508711 PE(15:0/24:1(15Z)) 1 1 212266 217500 1 244428 224960 1 245182 1 919024 729463 274188 1 571884 537938 1 1 773602 732202 "PG(13:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 195652 1 1 223078 1 1 1 1 1 1 1 PI(18:1(9Z)/0:0) 1 1 1 1 687922 684924 1 1 400082 417845 1 1 310171 1 701333 399219 1 1 1 1 Tetranor-PGE1 216691 225042 94374 94258 230488 244663 108216 171333 191898 180334 1 346507 191958 188565 226258 262971 257908 273997 367129 428902 "1,13-Tetradecadien-3-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Patuletin 3-(2''-feruloylglucosyl)-(1-6)-[apiosyl-(1-2)-glucoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11Z-heptadecen-1-ol 1 1 1 1 512964 1 1 1 1 1 133471 1 118067 186043 4227517 275536 1 1 8354021 346961 N-(2'-(4-benzenesulfonamide)-ethyl) arachidonoyl amine 4148366 4309747 1211857 1 3866968 3714244 1 1794793 3598060 3342607 1.72E+07 1.20E+07 3663901 3647351 229314 4328708 5515297 5628922 1.66E+07 1.32E+07 PI(22:1(11Z)/0:0) 1 1 77354 47414 1 1 65453 82434 1 1 461863 355429 1 1 159314 154909 1 1 357015 393372 Cer(d18:0/15:0) 1.22E+07 1.21E+07 3816519 531662 1.14E+07 153676 4715672 11127 1.06E+07 1782385 9766875 2614190 1.10E+07 9082078 300950 1 1.30E+07 53399 111471 78487 "31-hydroxy-32,35-anhydrobacteriohopanetetrol" 1 1 1 1 1 1 1 1 25485 1 1 1 1 1 1 1 1 1 1 1 EB 1213 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Linoleamide 22043 447811 15753 1 58190 213577 17821 31041 104807 32815 1 1 1 445062 25759 42806 26903 260979 429167 48566 (-)-beta-thujone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ovaliflavanone A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/14:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,15-Hexadecadien-3-one" 1 12952 1 1 1 1 1 1 1 1 73372 1 1 1 188342 1 1 1 1 1 "(5Z)-4,4-difluoro-1?--hydroxyvitamin D3 / (5Z)-4,4-difluoro-1?--hydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(15:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-20-Acetoy-9-hydroxy-1,6,14-rhamnofolane-triene-3,13-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(3-methylbutyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(O-20:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-oxo-nonadecanoic acid 1 1 1 1 1 1 1 17047 1 1 1 34973 1 1 45490 67425 40983 35276 56430 120976 "(22E)-(25R)-25-hydroxy-26-methyl-22,23-didehydrovitamin D3 / (22E)-(25R)-25-hydroxy-26-methyl-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 254121 1 1 1 1 1 1 1 1 1 "2,4,2'-Trihydroxy-6'',6''-dimethyl-3'-prenylpyrano[2'',3'':4',5']chalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 55284 1 1 10885 1 1069711 698276 1 1 1 965823 1 1 1020937 1 "(25S)-3-oxo-12beta-acetoxy-cholest-1,4-dien-26-oic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(19:0/22:2(13Z,16Z))" 509631 1 808990 812781 538387 1 933060 1215265 532652 1 2567365 1759526 481220 1 1789491 1865692 1 1 1575156 1374872 "PI(20:4(5Z,8Z,11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 357132 1 1 1 1 1 PE(14:0/22:1(11Z)) 1 255973 1 1 1 237554 1 1 1 1 1657357 1 1 268154 1095143 981815 417400 395028 676337 731156 "(22E)-1?-hydroxy-22,23-didehydrovitamin D3 / (22E)-1?-hydroxy-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-18:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(13:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(E)-3,7-Dimethyl-2,6-octadienyl octanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,8-Dimethyl-1,3(E),7-nonatriene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(d20:0/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(E)-3,7-Dimethyl-2,6-octadienyl dodecanoate" 69776 69010 71381 75389 51686 48968 83021 118860 59583 51577 1 259477 55887 1 148957 180827 135734 122144 131578 217998 "1,2-dihydrostilbene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl heptanoate" 76305 145279 55807 58486 42715 42968 43167 86904 74204 81715 1 1 61685 53572 93285 112794 142774 138042 188366 227821 TG(12:0/14:0/22:0)[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-stearoyl glutamic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 641516 2083733 all-trans-retinyl linolate 3862705 1833476 664853 1 259680 5888150 466708 1 2206951 5198501 142600 44953 1884322 2009290 2035251 46724 6996374 3162693 1037630 83082 C16 Sphinganine 1 1 1 1 1 1 1 18692 1 1 62564 1 1 1 1 24104 1 1 28042 41206 Muconic dialdehyde 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21195 20006 1 23577 11-hydroxy-dodecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(13:0/22:1(11Z)) 332500 297949 215426 75129 183507 1 137747 384861 241587 219018 461753 974483 1 281283 186631 378416 404826 331536 696917 714736 PG(14:0/22:1(11Z)) 265818 1 1 1 1 1 1 1 1 301166 2015616 2156038 1 1 1 2318649 1 1 1 1 (+)-18-Methyl-eicosanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "7-Ethyl-3,11-dimethyl-1,3Z,6E,10E-tridecatetraene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Clavepictine B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4,6-undecatrienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6k-PGF1alpha-d4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(12:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(13:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (S)-2-aceto-2-hydroxy-butanoic acid 131493 123823 1 1 108537 102988 1 1 106207 106886 1 1 65281 54654 1 1 70960 77197 1 1 N-arachidonoyl tyrosine 1 1 199271 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(isobutyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(P-16:0/12:0) 395872 4641820 4351847 91947 567325 391068 6834842 108802 1057577 211065 9063454 349707 575370 630824 353457 383564 2.20E+07 372461 283343 152336 10Z-Pentacosene 1 14312 45478 50204 1 1 50144 70350 1 1 1 149671 1 1 81063 104128 29951 26846 57303 61226 PA(O-16:0/14:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 33489 "PA(17:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 2629672 1 1 1 1 1 1 1 1 1 GPA(16:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 731582 1 1 1 1 1 407806 436937 1481630 950012 PS(O-16:0/14:1(9Z)) 3139999 4375928 1 192075 882427 4444611 1481725 1 3786506 3025728 1880717 1 3000075 2764729 2539415 1456155 4928474 4109893 1772642 1 11-trans-LTE4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(15:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Etn-1-P-Cer(d14:1/18:0) 1270151 287282 1 1 2977672 1565301 1361337 114975 2075608 415115 728417 601788 262530 298775 2680240 588974 1786490 1104737 298021 300219 "DG(16:0/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Tridecene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 84006 25-hydroxy-cholesterol(d3) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(16:0/22:5(4Z,7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4601510 4422531 1 1 1 1 PA(P-20:0/19:1(9Z)) 115077 105737 1 1 1 1 89193 25374 109691 1 30203 620564 1 206661 1 1 83328 37349 1 673606 PE(15:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 2651854 3288196 1 1 1 1 1 1 1 1 Cytochalasin B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(20:4(5Z,8Z,11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Docosanediol-1,14-disulfate" 3397814 3462288 363942 158357 3372170 3248723 658719 1442221 2960648 2796677 1282703 7259704 2845221 3016866 556926 2766362 4609079 4768566 1.11E+07 6466473 "GPA(18:0/20:4(5Z,8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-18:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 158020 1 1 1 1 1 1 126645 1 185114 1 1 1 1 1 1 34795 "PA(20:2(11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dioleoyl-sn-glycerol" 1 1 1 1 1 1 1 1 1 1 1 16305 1 1 10670 1 1 1 1 1 LPA(0:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(16:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(3S-hydroxydecanoyl)-L-serine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4,6,8-decatetraenal" 1 1 1 1 1 1 1 1 1 1 1 94088 1 1 58082 1 1 1 1 1 10-undecenal 1 1 1 1 1 22428 1 45625 1 1 1 1 1 1 1 67421 1 1 1 1 11-amino-undecanoic acid 757140 805258 1189771 1102381 529467 542870 1441554 1872994 540649 536525 1 1 561327 545961 2389088 2491715 2000840 2165960 3292135 3522386 SM(d18:2/21:0) 240980 1 1 1 242155 217607 1 1 230692 196297 1 1 222342 208442 339556 1 1 267986 569837 538026 Lipid A -disaccharide-1-P 5.65E+07 5.26E+07 1.05E+07 467663 4.51E+07 4.72E+07 741829 2193910 4.46E+07 2.65E+07 1211926 1007835 4.30E+07 1381008 2.15E+07 381275 4.82E+07 4.96E+07 1.71E+07 1.37E+07 3-Ethyltridecan-2-one 8870013 1567168 1 3379614 1491970 8839623 6943642 2981105 6542416 5105449 1771507 1136028 3612755 8306350 5063766 1 4239179 9829726 1.21E+07 1126979 "DG(15:1(9Z)/18:3(9Z,12Z,15Z)/0:0)[iso2]" 80958 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-methyl-1-(2-methyl-2-propenyl)-cyclopentane 1 2215614 1 70314 313882 1204506 1 94543 3100621 636608 30768 1 25391 1507756 2672520 1 1784072 690972 1 37762 "1,12E-Pentadecadiene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3alpha,5beta,7alpha)-23-Carboxy-7-hydroxy-24-norcholan-3-yl-beta-D-Glucopyranosiduronic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Megalomicin C1 1 1 1 1 1 1 1 1 1 1 684243 534361 1 1 1 1 128150 126795 620831 353723 Nitenin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20S)-1?,20,25-trihydroxyvitamin D3 / (20S)-1?,20,25-trihydroxycholecalciferol" 1 1 38327 1 1 1 37604 13070 1 1 1 1 1 1 10778 1 1 1 1 1 TG(12:0/16:0/22:1(11Z))[iso6] 4937442 1610663 319298 1 3484179 3631702 1142706 1 4277534 4336664 1 72544 952953 4520365 1054155 96046 4749758 4000770 1405167 128530 "DG(22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 216641 1 1 1 1 1 1 1151642 2173541 1 1 1 1912373 1 1 1590542 1489601 oleanolic acid 3-O-beta-D-glucosiduronic acid 1 1 88147 105501 1 1 110307 151914 1 1 559029 457537 1 1 189428 194047 1 1 417732 445030 (+)-16-Methyl stearic acid 1650160 1642224 1 1 1156172 1121549 350482 40602 1234730 1243612 588634 46487 1285176 1221119 1265512 573492 1185902 1310154 1233763 81117 delta2-THA 58412 1 41044 42504 1 1 41212 80712 51926 1 1 1 1 1 105533 1 1 1 150725 209138 Eicosanoyl-EA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 47447 1 1-tetradecanyl-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol) 412262 535784 239693 216641 349667 467520 276536 411699 324160 205759 1763714 1624400 412805 461491 2353894 1918026 261095 242238 2123004 1509820 "DG(14:1(9Z)/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(16:0/5:0(CHO)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 139036 136976 1 225629 Emmotin A 1 1 1 1 1 1 1 18748 36405 1 1 1 1 38675 1 1 1 1 1 1 2-Ethylacrylic acid 2984407 3027631 147916 155916 2870628 2949568 153302 243852 3338854 3059078 1 1 1 1 308391 359358 1 1 857439 910475 13-amino-tridecanoic acid 24877 26955 1 1 1 1 1 1 21603 1 1 1 1 15762 1 48682 1 39097 54378 1 22-iso-teinemine 109072 96813 178706 168488 1 72839 181706 255817 79562 71992 734308 596082 84023 84633 339079 435811 206452 218962 400170 525886 Lamioside 42634 1 22351 17830 32557 1 24663 1 1 1 138726 1 20946 1 64109 88601 78788 74032 66363 85998 "PE(19:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2E,4E)-nona-2,4,-dienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glycocholic Acid 481340 445264 1 90192 368907 356305 11410 1 330750 1 1219594 1046727 423934 1 69519 1 474742 451943 149582 1075879 "1,2-dimethylcyclopentane" 1262155 3045043 243809 701788 4205439 4370724 1809732 66422 4799166 3575859 650778 482372 4558338 786504 1521781 544591 2677618 3315419 1717066 635401 10-keto myristic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(12:0/22:2(13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22354 1 1 1 1 1 "(20S)-1?,20,25-trihydroxy-24-norvitamin D3/(20S)-1?,20,25-trihydroxy-24-norcholecalciferol" 21729 109931 369631 146547 19581 1 438607 266619 13316 1 1 41366 1 1 123100 55311 1 265691 82157 48410 "27-nor-24S-methylcholestan-3beta,4beta,5alpha,6alpha,7beta,8beta,14alpha,15alpha,24-nonol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-2-nonen-1-al 1 1 97975 90676 1 1 1464489 153606 1 1 1 1 1 1 191284 299100 114499 1 713529 300780 "2,4-Dimethyl-2E,4E-hexadienal" 18762 144314 1 1 107985 36528 1 1 1 1 1 1 1 1 1 1 23115 200773 1 1 PE(12:0/17:1(9Z)) 261355 295627 1 1 275506 300203 1 1 283644 306628 291961 240967 200613 307591 216001 206975 115016 146335 166680 195373 PE(12:0/16:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 307886 1 1 1 1 1 1 1 1 "26,26,26-trifluoro-25-hydroxy-27-norvitamin D3 / 26,26,26-trifluoro-25-hydroxy-27-norcholecalciferol" 1 1 50615 165816 1 1 168008 122980 1 1 1 17168 1 1 68441 23877 1 1 27411 19169 Docosanedioic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 438596 1 1 1 1 1 DG(19:0/22:0/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10E-nonadecenoic acid 1 1 1 1 1 1 1 1 1 29512 1 1 1 1 1 14346 1 1 1 1 "5-Heptynoic acid, 7-hydroxy-; 7-Hydroxy-5-heptynoic acid" 1 1 12375 17991 1 1 17500 1 1 1 39936 1 1 1 1 32276 1 1 1 1 Hippuristanolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-16:0/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20S)-1?,20,25-trihydroxy-26,27-diethylvitamin D3 / (20S)-1?,20,25-trihydroxy-26,27-diethylcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(13:0/18:2(9Z,12Z))" 210030 322465 1 1 201193 226480 1 1 180054 215879 309432 234706 203477 231772 267641 245421 410805 118282 249002 236190 PG(P-16:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(6R)-vitamin D3 6,19-(4-phenyl-1,2,4-triazoline-3,5-dione) adduct / (6R)-cholecalciferol 6,19-(4-phenyl-1,2,4-triazoline-3,5-dione) adduct" 1 1 1 1 1 290051 1 1 1 169063 1 1 1 1 1 1 1 1 229444 178007 (Z)-7-Dodecenyl formate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10531 1 1 24091 51506 (±)-Catechin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE-Cer(d16:1(4E)/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-stearoyl valine 1 15396 1 1 1 1 1 1 15467 1 1 1 1 1 1 1 1 1 1 1 "Anandamide (20:3, n-3)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12554 1 1 1 26718 48138 TG(12:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(18:1(9Z)/0:0) 1 1 1 300805 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Ethylpentane 1 1 1 1 1 1 1 1 1 1 1 58813 1 1 1 1 1 1 1 1 PGF2? dimethyl amine 1 1 158647 166440 1 26499 151509 1 1 1 714140 518142 1 1 1 316447 177715 190044 560856 585679 Malonylmalvin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15-methyl-15R-PGD2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Pisatin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(19:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 126552 1 1 1 1 1 1 1 244467 1 1 1 1 PC(0:0/4:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Termitomycesphin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Leucodelphinidin 3-O-(beta-D-glucopyranosyl-(1-4)-alpha-L-rhamnopyranoside) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CoA(22:1(13Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/14:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)N-(1R-methyl-propyl) arachidonoyl amine 1 1 112869 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3E,4Z,7,11-Tetramethyl-6,10-tridecadienal" 1 1 41218 1 115048 1 1 96808 1 1 203958 1 48147 1 911272 155566 23616 823576 80920 1 Ins-1-P-Cer(t18:0/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11-methoxy-12,13-epoxy-9-octadecenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(P-20:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17?-Ethinyl estradiol 17300 1 1 1 1 1 1 1 1 1 1 23785 19908 22130 130206 1 1 1 1 1 "TG(12:0/13:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 530245 1 1 1 1 1 1 1 1 1 1 1 (E)-2-Octenyl 2-methyl-(E)-2-butenoate 1 1 38572 40976 1 1 30242 1 1 1 1 1 1 1 72203 96161 60381 1 11304 1 TG(13:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CoA(18:0(3OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d16:1/22:1) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Rosinidin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(O-16:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(19:0/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-16:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 900119 342769 163957 1 1 1 1 1 1 1 PE(17:0/0:0) 191343 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(14:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:4(6Z,9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arachidonoyl Ethanolamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22E)-3alpha,6beta,7beta-Trihydroxy-5beta-chol-22-en-24-oic Acid" 1 1 107114 1 1 1 120246 1 1 1 325680 1 1 1 99263 122826 1 1 1 1 "(2E,6E,10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/13:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6]" 545541 1 1 1 361866 355590 1 1 380920 388430 1 1 497966 1 1 1 575765 561156 866597 997797 "(+/-)-2,16,16-trimethyl-5,8,11,14-all-cis-tricosatetraenoyl-2'-fluoroethylamine" 1 1 1 1 1 1 41591 74496 1 1 319188 1 1 1 122412 140296 53789 50687 1 1 PG(18:1(9E)/0:0)[U] 128829 126233 1 1 130026 122462 1 1 1 120850 1 1 80026 77058 1 54377 1 1 1 1 C18 Sulfatide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-HETE-Ala 415330 410307 1 1 242387 238391 14058 1 268352 277673 297545 1 501716 503360 355326 422268 85900 189534 16327 12563 "methyl 12,13-epoxy-9,15-octadecadienoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(14:0/22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(18:0/22:5(4E,7E,10E,13E,16E))[U]" 1 1 186461 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(17:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31051 1 1 "TG(16:0/22:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7-O-Methylisolupalbigenin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MG(16:0/0:0/0:0)[rac] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuGcalpha2-3Galbeta1-4GlcNAcbeta1-3(Galalpha1-3Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-deoxy-20-hydroxyecdysone 22-phosphate 1 1 1 1 246626 252912 1 1 216563 1 1 1 1 123715 1 1 1 201483 1 1 Kaempferol 3- (2'''-sinapylsophoroside) -7-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11-(3-acetoxy-1-propynyl)-1?,25-dihydroxy-9,11-didehydrovitamin D3 / 11-(3-acetoxy-1-propynyl)-1?,25-dihydroxy-9,11-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11E-Hexadecen-1-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/16:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Stoloniferone F 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pramanicin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(t20:0/24:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 346202 365470 1 1 "PG(14:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(24E)-24,26-dimethyldesmosterol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(22:1(13Z)/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(22:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 165258 1367847 1 1 166712 2935097 1269156 1 1 3281818 7831336 189872 1 4050573 2366642 110150 1 2740333 1619028 "18Z,21Z-Heptacosadien-10-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(17:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(O-16:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(20:4(5Z,8Z,11Z,14Z)/24:1(15Z))" 1 1 247244 1 1 1 563836 1 1 1 1 1 1 1 1 1 1 1 1 1 5a-Androst-3-en-17-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fludrocortisone acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-16:0/19:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d18:0/13:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-16:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GPSer(16:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7115462 1 PS(14:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "32,35-anhydrobacteriohopaneterol" 3924231 423711 711973 1 2955989 4299615 452934 673108 5021615 414900 3946522 1181156 435343 1686524 959770 96223 6180663 4657334 6069694 56870 "TG(21:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Ursolic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14-Fluoro-11E-tetradecenyl acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 636767 1 1 1 1 1 1 1 1 1 1 1 1 1506489 1 1 14-fluoro-myristic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Purpuritenin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(2:0/O-16:0)[U] 1 1 1 1 1 124311 1 1 1 1 1 1 120314 1 1 1 1 1 1 1 "DGDG(18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4-oxo-9Z,11Z,13E,15E-octadecatetraenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Ceriferol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Euchrenone b3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?-hydroxy-24,25,26,27-tetranorvitamin D3 23-carboxylic acid / calcitroic acid" 435461 444852 1 172042 263867 311470 157777 1 294884 351109 335724 265826 523458 454288 325997 445685 92281 36794 1 10347 "(22E)-26,26,26,27,27,27-hexafluoro-25-hydroxy-22,23-didehydrovitamin D3 / (22E)-26,26,26,27,27,27-hexafluoro-25-hydroxy-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "30:3(5Z,9Z,23Z)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d17:0/27:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(5R,7S)-7-Methyl-1,6-dioxaspiro[4.5]decane" 33436 1 30987 1 1 1 27976 61098 1 1 1 1 1 1 75370 62903 1 19699 27004 1 DG(P-14:0/18:1(9Z)) 1 239999 202578 1 174784 1 1 1 15184 201423 1 1 135803 67527 1 1 1 408713 1 1 PC(11:1(10E)/11:1(10E))[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(17:0/22:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 gibberellin A3 O-beta-D-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11?-Hemiglutaryloxy-1,25-dihydroxyvitamin D3" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,5,4'-Trihydroxy-6'',6''-dimethylpyrano[2,3:7,6]flavone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Alloxanthin/ Tetradehydrozeaxanthin / (Cynthiaxanthin)/ (Pectenoxanthin) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-1,2-campholide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 666601 1 1 1152293 166045 1 Galbeta-Cer(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,8-Dimethyl-4E,8E-decadien-10-olide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Octadecene 46995 44353 101516 111403 29149 25200 98298 153247 33687 23357 1 1 39569 36812 187452 252983 46675 60977 109788 122300 TG(18:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-geosmin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Castillene B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "22:1(5Z)(9Me,13Me,17Me,21Me)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(18:2(9Z,12Z)/0:0)" 1 1 1 1 518919 572654 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Acutifolin A 1 1 1 1 1 1 1 1 1 1 1 31506 1 1 1 1 1 1 1 1 "(4E,8E,d18:2) sphingosine" 1 1 1 1 1 1 1 1 1 1 290920 215939 1 1 1 1 1 1 1 1 "(2S,4R,6R,8S)-2,4,8-Trimethyl-1,7-dioxaspiro-[5.5]undecane" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5alpha-androstane-3,17-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(18:0/22:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(O-20:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Usnic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPC(17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lasalocid A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(P-20:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,5,8,3',4',5'-Hexahydroxyflavone" 1 1 1 1 1 1 1 1 1 1 1 96181 1 1 1 1 1 1 1 1 "(22E,24E)-1?,25-dihydroxy-22,23,24,24a-tetradehydro-24a-homovitamin D3 / (22E,24E)-1?,25-dihydroxy-22,23,24,24a-tetradehydro-24a-homocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(14:0/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(16:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 p-Cymene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Salinixanthin/ 1',2'-Dihydro-1',2'-dihydroxy-4-ketotorulene 1'-glucoside ester" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(14:1(9Z)/20:1(11Z)) 1 1 1 1 1 1 43720 1 1 1 1 1 1 1 1 1 1 1 1 1 Avermectin B1b 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 163933 PE(12:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 85565 1 1 113434 1 1 1 1 1 135739 125226 N-hydroxy arachidonoyl amine 1 1 70315 70809 1 1 70729 119776 1 1 1 1 1 1 1 102634 1 86037 67393 82065 PG(15:0/0:0) 4795849 4841455 1 1 5864052 4336119 2928450 3565515 5698943 5436512 1 3127872 5699799 49370 6291270 1 4711664 4730826 6246037 4678104 "PC(P-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-ethyl-hydracrylic acid 15673 1 24935 1 21570 15021 45903 30338 20956 1 1050393 941554 1141691 1 1140362 523855 36451 10656 842803 670084 PC(10:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12730 1 CerP(d18:0/16:0) 1 1 1 1 1 1 1 1 1 1 1 145885 1 1 1 1 1 1 83900 1 "1?,25-dihydroxy-24-oxo-23-azavitamin D2 / 1?,25-dihydroxy-24-oxo-23-azaergocalciferol" 1 1 1 1 1 1 1 1 1 43118 1 1 1 1 1 1 1 1 1 1 "(20S)-1?,25-dihydroxy-20-methoxy-26,27-dimethylvitamin D3 / (20S)-1?,25-dihydroxy-20-methoxy-26,27-dimethylcholecalciferol" 1 1 1 1 1 1 82790 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-12:0/0:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 74941 1 1 1 Sugeonyl acetate 61267 1783596 1 1 37449 40481 59256 1 21434 1553857 1 11782 1902071 57777 1815657 1 10167 2082445 212268 59370 Hexandraside C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(22:1(11Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(P-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 830467 1 1 1 1 1395148 1 1 2436017 2066238 1 1 2778968 2575983 1 1 1 1 "TG(12:0/21:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Spisulosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-octadec-9-en-12-ynoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 109541 1 1 adonitoxigenin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(22:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(12:0/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3b,16a-Dihydroxyandrostenone sulfate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-16:0/17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "BPG(C20,C20,C20,C20)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (2-Hydroxymethyl-cyclohexyl)-acetic acid lactone 1 1 1 1 1 1 1 1 13237 20548 1 1 1 30078 1 1 1 17904 1 1 5-O-Methyl-8-prenylafzelechin-4beta-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(5E)-(24R)-24,25-dihydroxy-[6,19,19-trideutrio]vitamin D3 / (5E)-(24R)-24,25-dihydroxy-[6,19,19-trideutrio]cholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(8-[5]-ladderane-octanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(20:1(11Z)/22:0/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-[5]-ladderane-decanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(6:0/6:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lipoxin D4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-butanoyl-lhomoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl phenylalanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,1-dimethyl-2-propylcyclohexane" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:3(6Z,9Z,12Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C16-OH Sulfatide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(18:3(9Z,12Z,15Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25-iso-etioline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 147099 1 Oleoyl Ethanolamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Artocommunol CC 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(t18:0/22:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(17:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 519129 1473163 1 1 1635540 384632 1 1 380204 1948910 1 1 514322 1011012 1 1 821359 1 1 1 N-oleoyl phenylalanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13-Methyl-1-hentriacontene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(16:0/22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oleic acid(d2) 1 1 1 1 1 1 1 1 1 1 1 46487 1 1 1 36325 1 1 1 1 "26,26,26,27,27,27-hexafluoro-25-hydroxy-23,23,24,24-tetradehydrovitamin D3 / 26,26,26,27,27,27-hexafluoro-25-hydroxy-23,23,24,24-tetradehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 190559 1 1 1 1 1 1 1 "1,2-didocosanoyl-sn-glycero-3-phosphosulfocholine" 448190 1433522 1 1209296 23957 1142761 2140055 1 60554 1273908 1 1 1005620 80455 620752 503005 1576276 2178000 455628 189508 "3,4,7-Trihydroxy-5,4'-dimethoxy-6,8-dimethylflavan" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lilaline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/18:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,4,7-Trihydroxy-5-methoxy-8-prenylflavan 4-O-(beta-D-xylopyranosyl-(1-6)-beta-D-glucopyranoside)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(12:0/22:1(11Z)/0:0)[iso2] 27120 32918 1 1 1 1 1 1 48575 1 1 39410 21280 32433 51949 20942 13164 1 70843 72898 "PE(17:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(12:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18762 1 "1beta,3beta,5alpha,6beta-tetrahydroxyandrostan-17-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3alpha,7alpha,12alpha-Trihydroxy-24-nor-5beta-cholan-23-al" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10Z-Heneicosene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 41763 1 PA(O-16:0/21:0) 2923794 5207236 1934209 1078005 185113 1552218 1301175 311529 1252446 3272900 8980991 8638004 4167339 4645654 7833126 9129709 2734066 6696493 8533387 7447095 "2,3-Dinor-11b-PGF2a" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Aldosterone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LacCer(d14:1/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11?-(chloromethyl)-1?,25-dihydroxyvitamin D3 / 11?-(chloromethyl)-1?,25-dihydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Exiguaflavanone M 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 42697 36627 1 1 Didrovaltratum 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Octacosene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2',6'-Dihydroxy-4'-methoxy-3'-(2-hydroxybenzyl)dihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GPSer(18:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11-dehydro-2,3-dinor-TXB2" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(14:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8-Prenylquercetin 4'-methyl ether 3-rhamnoside 358508 351107 1 1 483582 519085 1 1 506127 489472 1 1 280811 309382 1 1 83897 73251 1 25355 "PA(19:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1707423 1 1 938715 684034 1 303685 1924246 1 "3,5,7-Trihydroxy-6-methoxy-4'-prenyloxyflavone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4'-Hydroxy-4-(4-hydroxystyryl)-5,7-dimethoxyflavan" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hildgardtene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2?-(benzyloxy)-1?,25-dihydroxy-19-norvitamin D3 / 2?-(benzyloxy)-1?,25-dihydroxy-19-norcholecalciferol" 1 1 1 1 1 1 1 1 1 1 192033 1 1 1 1 1 1 1 261733 226832 3beta-Acetoxy-4-oplopanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Helilupolone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(15:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22E)-(24R)-1?,24,25-trihydroxy-22,23-didehydrovitamin D3 / (22E)-(24R)-1?,24,25-trihydroxy-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(14:1(9Z)/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(8Z,d18:1) sphingosine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17-phenyl trinor PGF2? 1 1 1 1 1 1 1 1 101249 1 1 1 99030 1 1 1 1 1 1 1 Solanidane skeleton 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(18:0/22:5(7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Prenylresveratrol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(22:1(11Z)/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cucumerin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 51088 1 1 1 1 1 "35-aminobacteriohopane-32,33,34-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d18:2/15:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(17:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DAT(16:0/23:0(2Me[S],4Me[S]))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12539 1 1 1 "TG(12:0/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Borneol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Prephytoene diphosphate 1 1 1 1 1 1 1 1 1 1 1 176209 1 1 1 1 1 1 112634 1 "PC(20:4(5Z,8Z,11Z,14Z)/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(P-17:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d18:0/17:0) 271017 86040 245916 433392 2951377 2842666 186542 1.07E+07 5904794 451043 127700 574622 9869932 1875742 516009 292498 7933632 1171404 2.80E+07 163988 Heptadecanoyl Ethanolamide 1 1 1 1 1 28429 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE-Cer(d14:1(4E)/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(22:0/22:4(7Z,10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Manoalide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(1R,2R)-3-oxo-2-pentyl-cyclopentaneoctanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(16:0/22:5(4E,7E,10E,13E,16E))[U]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10Z-Hexadecenyl acetate 1 1 1 1 65175 1 1 1 1 20175 1 1 1 1 1 1 1 1 1 1 Sorbaldehyde 1 1 1 1 1 1 24130 1 1 1 1 1 1 1 1 1 1 1 1 1 22:6 Cholesteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (R)-4-Methoxydalbergione 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 geodisterol-O-sulfite 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(18:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GlcCer(d14:1(4E)/20:0(2OH)) 69972 1 60147 1 1 163521 102145 528745 1 49096 772282 659318 148706 115622 2822222 643024 1 1 605697 540984 PS(O-16:0/O-16:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11beta-PGF2alpha-EA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(24R,25S)-25,26-epoxy-1?,24-dihydroxy-27-norvitamin D3 / (24R,25S)-25,26-epoxy-1?,24-dihydroxy-27-norcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(12:0/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(15:1(9Z)/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Brosimone H 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(20:1(11Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(E)-3,7-Dimethyl-6-octenyl 3,7-dimethyl-2,6-octadienoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17570 L-Octanoylcarnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-16:0/18:2(9Z,12Z))" 265742 525183 1 1 202662 1105294 1 1 870743 814470 1696193 111449 1357524 1041723 620592 94870 1 2027737 96265 1 6-Hydroxycyanidin 3-rutinoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11Z-Eicosenal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(15:1(9Z)/18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z))[iso3]" 20010 25876 1 1 25769 36279 1 1 27040 30430 1 1 29310 31100 1 1 1 1 1 1 "(25R)-26,26,26-trifluoro-1?,25-dihydroxyvitamin D3 / (25R)-26,26,26-trifluoro-1?,25-dihydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sulfated Dihydromenaquinone-9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (5E)-isovitamin D2 / (5E)-isoergocalciferol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C18-OH Sulfatide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1486291 1469670 1 1 "TG(14:0/22:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Cer(d14:2(4E,6E)/22:1(13Z))" 1 1 1 1 1 77352 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Aplidiasphingosine 320486 404651 1 1 272319 227787 1 1 1 1 818416 546978 1 1 312497 329682 310205 311776 474257 581512 TG(17:0/17:1(10Z)/17:0) (d5) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Spongipregnoloside A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 39338 1 1 1 1 1 1 39829 1 1 1 1 1 1 1 PE(9:0/9:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-[5]-ladderane-butanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galalpha1-3Galbeta1-4Glcbeta-Cer(d18:1/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(O-22:1(13Z)/22:3(10Z,13Z,16Z))" 1 158147 1 1 1 1 1 1 1 1 1 1 1 1 1 1 145626 1 1 1 Lithocholic acid taurine conjugate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "18-hydroxy-9S,10R-dihydroxy-stearic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(O-18:0/13:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-Hydroxytephrosin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GPIns(18:1(9Z)/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d14:1(4E)/20:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-(O-alpha-D-galactopyranosyl)-(1,3R,27R)-octaconsanetriol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-Nonadecen-2-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(19:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,6-epoxy-18R-HEPE" 1 1 1 1 127454 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-HpOTrE 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22:2-Glc-Campesterol 1 158147 1 1 1 1 1 1 1 1 1 1 1 1 1 1 145626 1 1 1 (+)-Desoxyscalarin 53864 1 52479 1 1 12423 22429 1 1 1 1 1 1 1 1 1 10941 1 1 1 "PA(18:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DL-2-amino-octanoic acid 1 1 1 1 1 1 1 13302 1 1 1 1 1 1 1 1 1 1 1 1 Chlorophorin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 40269 1 1 1 1 1 1 1 1 1 1 1 25104 1 1 1 Erythromycin ethylsuccinate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-20:0/17:2(9Z,12Z))" 1 1 1 1 1 46481 1 1 1 1 1 1 1 1 1 191771 476229 83092 1 1 Hydroxyphthioceranic acid (C37) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(18:1(9Z)/4:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Dysideapalaunic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (3R)-3-isopropenyl-6-oxoheptanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+)-14,15-Epoxy-thapsan-14-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(16:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuAcalpha2-8NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Tetradecene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11,12-dihydroxy arachidic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:0/22:2(13Z,16Z))[iso6]" 1 191267 1 1 1 559348 1 1 1 49184 22036 1 1 271817 1 1 1 557992 1 1 PE-Cer(d14:1(4E)/24:1(15Z)(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(6R)-25-hydroxyvitamin D3 6,19-sulfur dioxide adduct / (6R)-25-hydroxycholecalciferol 6,19-sulfurdioxide adduct" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-HpOME 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cortisone acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3alpha-hydroxy-5alpha-androstane-17-one 3-D-glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Nonanoic acid, 3-amino-, (R)-" 11245 1 33914 1 1 1 29357 42024 1 1 1 1 1 1 43503 1 1 1 44438 55511 "PG(22:2(13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22E)-(25R)-1?,25-dihydroxy-26-methyl-22,23-didehydrovitamin D3 / (22E)-(25R)-1?,25-dihydroxy-26-methyl-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-2-Butenyl butyrate 1 1 1 1 1 1 1 18595 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-26,27-dimethyl-24a,24b-dihomovitamin D3 / 1?,25-dihydroxy-26,27-dimethyl-24a,24b-dihomocholecalciferol" 1 1 1 1 1 1 22659 1 1 1 1 1 1 1 1 1 1 1 1 1 Palmitoylcarnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-(1-hydroxypropan-2-yl)isolongifol-4-ene 103604 1 1 1 804446 280428 25293 1 348300 725399 1 1 153916 434755 115346 60576 64519 508730 486844 1 22:0 Campesteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/22:3(10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5beta-Cholane-3alpha,12alpha,24-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22E)-1alpha,3beta-Dihydroxychola-5,16,22-trien-24-oic Acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Phytosphingosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(19:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(14:0/P-18:1(11Z)) 1 1 1 16085 34378 51882 45158 54549 1 43306 1 1 1 107223 686301 90286 1 1 874132 1 CerP(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 75127 44134 1 1 1 1 PE(P-20:0/19:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,3S-dihydroxy-8E-decen-5-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPC(14:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(12:0/18:1(9Z)) 4383704 5479049 1625629 1665118 5395422 5413939 2630107 3281385 4277988 5183828 9023679 8662683 4392944 4574970 1.05E+07 9138667 3484187 4515664 8495462 7341874 "7,8-Didehydroastaxanthin" 1 92450 1 42358 1 1 1 50495 1 90411 285960 312665 1 1 107189 98019 1 1 1 1 "LPA(0:0/18:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,5-dimethoxystilbene" 1 78033 1 1 1 1 1 1 1 82745 1 1 1 1 1 1 1 59181 1 1 Dihomo-?-Linolenoyl PAF C-16 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fulvinervin B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Amino-4-methylpentanoic acid 725402 693394 208075 205054 1025304 1008180 245301 378175 889885 886915 1 1 676915 683872 392889 461052 646539 646214 745255 855225 "TG(12:0/19:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pelargonidin 3-(6''-p-coumarylsambubioside)-5-(6'''-malonylglucoside) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gibberellin A44 diacid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,5,7-Trimethyl-2E,4E,6E,8E-decatetraene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (R)-10-hydroxystearic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(9R,13R)-10,11-dihydro-12-oxo-15-phytoenoic acid" 40090 1 1 1 1 1 1 49165 1 1 1 1 1 1 1 1 76896 59108 1 1 Cer(d14:1(4E)/24:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(P-20:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21260 1 1 1 1 1 formyl 7-oxo-11E-tetradecenoate 167064 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(19:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/20:0/22:0)[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(O-16:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Dilophol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Euchrenone a14 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuAcalpha2-3Galbeta1-3(NeuAcalpha2-6)GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,2-Dimethyl-3-butenoic acid" 733709 764756 223556 229203 1036421 1225956 254913 395569 941907 1136604 1 1 730946 761722 400420 485150 671878 700608 832530 950266 N-docosahexaenoyl histidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Methyl-undecanoic acid 1 1 1 18611 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-14:1(1E)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-hexenedial 1 1 1 1 1 1 1 1 1 27938 1 1 1 1 1 1 1 1 1 1 "TG(12:0/17:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl butyrate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4S-hydroxy-8-oxo-(5E,9Z,13Z,16Z,19Z)-neuroprostapentaenoic acid-cyclo[7S,11S]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/12:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2378006 Cuscutic resinoside A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avermectin A2a 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(15:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "10,16-dihydroxy-palmitic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(18:4(6Z,9Z,12Z,15Z)/13:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Dodecanoyl-2-tridecanoyl-sn-glycero-3-phosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Hydroxy-24-keto-octacosanolide 1 1 1 1 1 1 1 26656 1 1 1 1 1 1 1 1 1 1 1 1 (24R)-5alpha-ergostan-3-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Isostearic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 28658 51916 "9-hydroxy-7E-Nonene-3,5-diynoic acid" 1 1 1 1 1 1 1 1 1 1 69865 1 1 1 1 1 1 1 1 1 "(22E)-3alpha,12alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid" 1 1 85974 10676 103758 55142 1 51564 1 32388 1 1 1 386413 35128 15828 208994 24717 21511 19333 Palmitoleamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(t18:0/18:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(16:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Minabeolide-5 95629 96362 1 1 1 1 1 1 1 1 346261 1 91059 1 150743 1 122887 1 211104 1 PG(17:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ouabain 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-O-(alpha-l-rhamnopyranosyl-(1-4)-beta-D-glucopyranosyl)-26-O-(beta-D-glucopyranosyl)-(25R)-spirost-5-en-3beta-ol 1 1 1 1 1 1 1 1 1 1 1 594681 1 1 1 1 1 1 1 1 "(9S,10S)-9,10-dihydroxyoctadecanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:2(9Z,12Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-hydroxy palmitic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Cer(d14:2(4E,6E)/18:1(9Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(23:0/26:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2',4'-Dihydroxy-6'-methoxy-3'-(2-hydroxybenzyl)-5'-(3 x 2-hydroxybenzyl)dihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Collettiside I 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Cleistanthol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "10,12-hexadecadienal" 1 1 1 1 1 1 1 36119 1 1 1 1 1 1 69224 57761 1 1 462654 74749 10-hydroxy-16-oxo-hexadecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galalpha1-3(GalNAcbeta1-4)Galbeta1-4Glcbeta-Cer(d18:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-2:0/O-2:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Formononetin 7-O-(6''-acetylglcoside) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2',4',6',3,4-Pentahydroxy-3'-geranyl-5-prenyldihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-2?-(3-hydroxypropoxy)-19-norvitamin D3 / 1?,25-dihydroxy-2?-(3-hydroxypropoxy)-19-norcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "7E,9E,11-Dodecatrienyl acetate" 1 1 1 1 1 1 1 1 39277 1 1 1 1 1 1 1 1 47863 1 1 "PA(15:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(6-aminohexanoyl)-6-aminohexanoic acid 1 53940 1 1 52342 1 1 37505 1 47213 121805 1 42811 37984 1 1 1 1 1 1 18-acetoxy-1?-hydroxyvitamin D3 / 18-acetoxy-1?-hydroxycholecalciferol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(21:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(21:0/22:2(13Z,16Z))" 1 48091 1 1 1 33580 1 1 30760 1 1 1 11294 1 1 1 1 1 1 1 PA(19:1(9Z)/0:0) 77030 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 all-trans-phytofluene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(3-oxo-octanoyl)-homoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-Geranyl-3,4,2',4'-tetrahydroxydihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-(8-[3]-ladderane-octanyl)-sn-glycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(t20:0/26:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12a-Hydroxyisomillettone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4-heptadienal" 1667468 1 1 12026 647544 577394 1722598 1 1349637 1716357 82892 12803 705870 1666119 1437094 1 486733 456652 105402 126664 "PG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 124294 1 49542 1 102542 129277 1 1 267843 195956 1 1 330098 271039 75294 70292 161863 146839 "LysoPE(0:0/24:6(6Z,9Z,12Z,15Z,18Z,21Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ceriporic acid B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(19:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ceriporic acid C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(P-16:0/14:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Grandiflorone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Kazinol H 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(24R)-1?,24,25,26-tetrahydroxyvitamin D2 / (24R)-1?,24,25,26-tetrahydroxyergocalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,5-epoxy-17R-HDHA" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(O-18:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-3-hydroxy pelargonic acid 613889 894441 2198282 2286852 866275 14289 4477028 3383805 900452 940338 1 1 671136 779221 1.12E+07 7489974 2098609 2085437 5665179 3540504 PA(16:0e/18:0) 1 1 1 1 1 1 1 53040 1 1 91450 73087 1 1 79618 69240 1 1 52201 1 TG(17:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Triacetin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 phorbol 13-acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gibberellin A20 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CerP(d18:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(P-16:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-oleoyl alanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPE(0:0/18:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3a,5b,7a,12a)-24-[(carboxymethyl)amino]-1,12-dihydroxy-24-oxocholan-3-yl-b-D-Glucopyranosiduronic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(16:0/P-18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Phaseollidin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/16:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Behenoyl-EA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuAcalpha2-3Galbeta-Cer(d18:1/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-11?-phenylvitamin D3 / 1?,25-dihydroxy-11?-phenylcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cholestanyl glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (Z)-7-Octadecenyl 3-methylbutanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/17:1(9Z)) 1 154228 1 1 1 1 1 29058 315315 1 678245 575556 1 422083 1322820 55463 98901 492465 1195232 62909 Citraconic acid 1 1 1 1 10882 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(13:0/22:2(13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "C14:5n-1,3,5,7,9" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 39526 1 1 1 Sphingosylphosphoryl choline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7-chloro-2E-heptenoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Safflomin C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20R,24R)-20-fluoro-1?,24-dihydroxy-26,27-cyclovitamin D3 / (20R,24R)-20-fluoro-1?,24-dihydroxy-26,27-cyclocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Dodecene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(13:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(14:0/22:4(7Z,10Z,13Z,16Z))" 104290 1 1 1 63693 1 1 1 1 72009 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/18:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-16:0/13:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Crocetin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dichamanetin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sterigmatocystin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(14:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(22:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Erosenone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11,12,13-TriHOME" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Diphylloside C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(17:1(9Z)/0:0) 791691 718280 1 1 1119260 1187970 37520 1 726870 854494 424039 305689 770032 844925 1 1 891339 933966 1 1 PG(O-16:0/13:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Alantolactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-oleoyl tryptophan 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cholesterol glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(15:1(9Z)/22:2(13Z,16Z))" 1 1 1055560 1063591 1 598963 1385254 1827921 1 1 3784276 2772900 1 1 3602765 3209482 1 1 3042314 2816573 (-)-Solavetivone 1 64529 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-2-Hexenyl (E)-2-octenoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(13:0/22:4(7Z,10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acutifolane A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11-Deoxy-16,16-dimethyl-PGE2" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(18:0/22:3(10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,4'-Dimethoxyfurano[2,3:7,8]flavone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2',4',6',3-Tetrahydroxy-3'-geranyl-6'',6''-dimethylpyrano[2'',3'':4,5]dihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(t18:0/16:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "26,26,26,27,27,27-hexafluoro-1?a-hydroxyvitamin D3 / 26,26,26,27,27,27-hexafluoro-1?a-hydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C24:1 Sulfatide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "18:1(5Z)(9Me,13Me,17Me)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6-Methoxyflavone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,4,3',4'-Tetrahydrospirilloxanthin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,6R-Dimethyl-2E-octen-1,8-dioic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,2-Dimethyl-4-pentenoic acid" 38595 1 1 1 1 48926 1 1 45272 31014 1 1 1 1 13234 1 46902 1 1 52874 1-Heptadecene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21955 1 1 1 24246 1-(10-methyl-hexadecanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphoethanolamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Paramethasone acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(14:0/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7-dehydrocholesterol-d7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6-dehydrotestosterone 17-glucosiduronic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(9Z,12Z)-octadeca-9,12-dien-6-ynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LBPA(16:0/18:1(9Z)) 39970 1 1 1 34470 1 1 1 1 1 1617170 816291 108495 1 344085 219028 224690 282706 1135044 837130 "PI(P-20:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:2/22:1) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 579504 422601 1 1 1 1 1 1 1 1 "(5E)-(3S)-1alpha,25-dihydroxy-3-deoxy-3-thiavitamin D3 3-oxide / (5E)-(3S)-1alpha,25-dihydroxy-3-deoxy-3-thiacholecalciferol 3-oxide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)7-epi Jasmonic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14alpha-methyl-poriferast-9(11)-en-3beta-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Heptanoic acid, 2-amino-, (1)-; Heptanoic acid, 2-amino-, DL-; (1)-2-Aminoheptanoic acid; alpha-DL-Aminoheptanoic acid; DL-Homonorleucine" 42123 46926 1 1 1 48087 1 1 50290 41671 1 1 1 1 1 1 65420 53654 1 117687 "PI(16:0/22:5(4Z,7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/14:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Orsellinic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(E)-3,7-Dimethyl-2,6-octadienyl nonanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,1,2-trimethylcyclohexane" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:2/18:1) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,4'-Dihydroxydiatoxanthin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C25:3 Monocyclic highly branched isoprenoid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Farfugin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-stearoyl proline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(±)19,20-DiHDPA" 16277 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22836 1 1 1 1 LysoPC(26:1(5Z)) 1 1 1 61742 1 1 32315 1 1 1 1 1 36591 1 81486 113251 1 1 1 1 PS(22:1(11Z)/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arachidonoyl amine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-Hydroxyandrosterone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(20:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DGTS(16:0/16:0) 1 1 1 1 1 1 1 1 1 1 1285235 1 1 1 63701 1 1 1 1 1 PA(20:1(11Z)/0:0) 1 1 1 1 1 1 1 1 1 1 3480204 1 1 1 1 1 1 1 1 1 "TG(19:0/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Chamazulene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(1S)-1-hydroxy-23-oxo-24,25,26,27-tetranorcalciol" 837481 19324 11534 33378 10652 34314 24633 72182 1 59508 1 1 34876 131720 130906 209027 31813 136674 84926 1 10-hydroxy capric acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?-(2-fluoroethyl)-25-hydroxy-26,27-dimethyl-24a-homo-22-oxavitamin D3 / 1?-(2-fluoroethyl)-25-hydroxy-26,27-dimethyl-24a-homo-22-oxacholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(3:0/3:0) 1 1 1 1 1 1 1 10670 1 1 1 1 1 1 1 1 1 1 1 1 "5-Hydroxy-7,4'-dimethoxy-4-phenylcoumarin 5-O-galactoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Hexen-1-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pinocembrin 7-O-benzoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oleoyl-EA(d2) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Artocommunol CA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5beta-Cholane-3alpha,7alpha,12alpha,24-tetrol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(18:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/17:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 179764 1 1 1 1 1 1 1 1 1 Chenodeoxycholic acid glycine conjugate 1 1 1 1 1 1 1 1 1 1 674333 502510 1 1 1 1 226341 1 1 1 "(+)-2-Sterpurene-6,12,15-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PGP-Me 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,3-di-(octadec-9Z-enoyl)-(1-cyano-2-methylene-propane-1,3-diol)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "13,14-dihydroxy-docosanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(19:3(10Z,13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(16:0/24:1(15E))[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-20:0/19:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pyrrhoxanthin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 94195 90769 4-Hydroxymyxol/ 4-OH-myxol/ (Aphanizophyll) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22E)-(24R)-1?,24-dihydroxy-26,27-cyclo-22,23-didehydro-20-epivitamin D3 / (22E)-(24R)-1?,24-dihydroxy-26,27-cyclo-22,23-didehydro-20-epicholecalciferol" 61440 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-15:0/O-1:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,9-dideoxyforskolin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16788 1 1 1 1 1 "4-Pentenoic acid, 3-oxo-" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21190 1 Syriacin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "SQDG(22:5(5Z,8Z,11Z,14Z,17Z)/16:1(13Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Octadecanoic acid, 3-iodo-; 3-Iodostearic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Glycinol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5beta-cholestan-3alpha,4alpha,11beta,12beta,21-pentol-3,21-disulphate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sphingosine-1-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Phytyl diphosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16:2-Glc-Campesterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(17:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(18:0/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-O-alpha-Cadinylangolensin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(14:1(9Z)/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GalNAcalpha1-3GalNAcbeta1-3Galalpha1-3(NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,23-dihydroxy-24,25,26,27-tetranorvitamin D3 / 1?,23-dihydroxy-24,25,26,27-tetranorcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Allylestrenol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(12:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Isomyristic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 cis-and-trans-Inophyllolide 302406 754074 1 1 738756 803578 1 1 429935 688109 1 1 1 507628 364101 1 661847 670753 1 1 18:0 Stigmasteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-Hexynoic acid, 6-hydroxy-" 1 1 1 1 1 1 1 1 1 1 1 28765 1 1 1 33317 1 1 1 1 Dolichoic acid-[18-20] 1 1 1 1 1 1 1 95723 1 1 1 1 1 1 1 1 1 1 1 1 PI(18:0/0:0) 1 1 1 1 1 1 1 1 1 40813 1 1 1 1 1 1 1 1 1 1 Tephrowatsin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 cimicifoetiside A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 42780 PE(12:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(P-16:0/18:4(6Z,9Z,12Z,15Z))" 1 90103 1 1 1 507591 1 1 1 1 3125199 2903295 1 1 2984550 2167894 1 1 5533073 2080227 "1?,2?,25-trihydroxy-19-norvitamin D3 / 1?,2?,25-trihydroxy-19-norcholecalciferolcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-O-(Galb)-(25R)-12-oxo-5alpha-spirostan-3beta-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(P-20:0/21:0) 1 1 1 1 1 1 1 1 1 1 769581 1 1 1 1 1 1 1 1 1 Dideoxymycobactin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(22:1(11Z)/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11?-PGF2?-d4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(13:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 28641 1 1 1 "PG(19:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(22:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(20:2(11Z,14Z)/P-18:1(11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(O-20:0/19:1(9Z)) 148200 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(14:0/22:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Minabeolide-7 1 1 1 1 1 1 1 68464 1 1 1 1 1 1 1 1 1 1 1 1 Prebarbigerone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,6,7,3',4',5'-Hexamethoxyflavanone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z))[iso3]" 142790 1 1 1 1 1 1 1 112180 115470 1 1 1 1 1 1 1 1 1 1 Type IV cyanolipid eicosanoyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/22:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1270880 481120 1 1 1092781 147960 1 1 657799 591017 1 864768 472221 764345 1 1 877473 1594938 1 1 "TG(12:0/15:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-nitro-9E-octadecenoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "GlcCer(d14:2(4E,6E)/18:1(9Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(19:0/22:4(7Z,10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Acetylenic acids; 10-Heptadecen-8-ynoic acid, (E)-; Pyrulic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-cis,6-cis-farnesyl diphosphate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9,11alpha-epoxypregn-4-ene-3,20-dione" 1 1 1 1 1 1 1 1 1 1 1 61964 1 1 1 1 1 1 1 1 Quassin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9,14,19,19,19-pentadeuterio-1?,25-dihydroxyprevitamin D3 / 9,14,19,19,19-pentadeuterio-1?,25-dihydroxyprecholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Heneicosanedioic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19(R)-hydroxy PGF2? 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(butyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "12-oxo-5E,8E,10Z-heptadecatrienoic acid" 1 1 1 1 1 19524 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Boviquinone 4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13-O-Demethyl tacrolimus 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-O-Methylmelleolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Thiocholesterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-Pentylone isomer" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3'-N-Acetyl-4'-O-(10,12-octadecadienoyl)fusarochromanone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Kni 102 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:0/22:5(4Z,7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1739904 1 1 1 1 1 "2,3-Secoporrigenin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 KDdiA-PC 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Acetylphenylalanine beta-naphthyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(S)-(-)-N,alpha-Dimethylbenzylamine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 cis-5-Tetradecenoylcarnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 FK-866 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 HA-1077 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Aminoacridone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hoiamide A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acetyltryptophanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(17:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Capsianoside IV 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Kestose 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 W140 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(21:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Benzimidazolylguanidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 R-95913 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,6-Diethylaniline" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Quillaic acid 3-[galactosyl-(1-2)-[xylosyl-(1-3)]-glucuronide] 28-[6-acetyl-glucosyl-(1-3)-[xylosyl-(1-4)-rhamnosyl-(1-2)]-4-acetyl-fucosyl] ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nb-Pentacosanoyltryptamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oxidized Cypridina luciferin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-alpha-D-Glucosyl-D-glucose 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Astaxanthin diglucoside/ Astaxanthin ?-D-diglucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lemobiline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nigrifactin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Stearoyl-2-Arachidonoyl PC 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-[4'-hydroxy-(E)-cinnamoyl]-L-aspartic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5?-Cholanic acid-3?, 12?-diol N-(2-sulphoethyl)-amide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Linoleoyl glycine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "JWH 018 N-(4,5-epoxypentyl) analog" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-Methyl-4,5-benzoxazole" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fluphenazine enanthate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-Ketorockogenin acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17beta-Hydroxy-2alpha-(methoxymethyl)-17-methyl-5alpha-androstan-3-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Linustatin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Irbesartan 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(2-Pyrimidyl)piperazine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Coenzyme Q10 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(12:0/22:1(11Z)) 2544514 2702907 2739550 2811157 2329189 2430071 3734392 4219575 1783314 2385993 2.52E+07 1.29E+07 2882728 2733741 1.23E+07 9149757 3733025 3857469 1.40E+07 9678518 "PA(20:3(8Z,11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avermectin A1a monosaccharide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Nopol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Mebeverine metabolite (Veratric acid glucuronide) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Rilmenidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-Acetoxy-3-geranylgeranyl-1,4-dihydroxybenzene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cys His Lys 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Ser Ser 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-20:0/20:3(8Z,11Z,14Z))" 3081537 1093044 120450 1 679890 802988 1695745 1662971 818501 1417250 1 1119728 2019561 161498 1 1 29737 1 1 1679281 Dodemorph 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sambacin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DPPP 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lophirone J 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(17:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fortimicin AP 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(14:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 126685 1 1 1 1 1 1 1 1 1 "PI(17:2(9Z,12Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Agelasine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cys Pro Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Stearyl citrate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lisuride 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 HoPhe-Ile-OH 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Methoxy-3-(1-methylpropyl)pyrazine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 L-Glutamic acid n-butyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Aminomethylpyrimidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Diethylaminoethanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-Diethylpyrazine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(8-[5]-ladderane-octanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine 1909730 1 1 1 544158 871506 1 1 1 638644 1 10376 1 1 4198451 1 45939 1 1 25951 NAc-FnorLRF-amide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn-Gly-OH 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-(Pyrazol-1-yl)-L-alanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-nitroheptane 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nanchangmycin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Adenine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(P-18:0/14:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tridodecylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 23-Acetoxysoladulcidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glucosyl (2E,6E,10x)-10,11-dihydroxy-2,6-farnesadienoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fluenetil 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Hydroxylidocaine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-amino-4'-hydroxy-Propiophenone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bikoeniquinone A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DHA (d5) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Docosanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nandrolone phenpropionate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Geranylfarnesyl diphosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Amino-2-piperidone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(1-Oxopropyl)-1H-imidazole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nb-Hexacosanoyltryptamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(20:5(5Z,8Z,11Z,14Z,17Z)/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6'-Hydroxysiphonaxanthin ester/ 6'-Hydroxysiphonaxanthin dodecenoate/ 6'-Hydroxysiphonaxanthin 19-(trans-?2-dodecenoate) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(10betaH,11xi)-11-Hydroxy-13-nor-6-eremophilen-8-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Inositol-P-ceramide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Chivosazole A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Candoxatril 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Clupanodonyl carnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fexaramine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Linoleoyl Glycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cistocardin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dambonitol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CAY10578 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Hydroxy-L-tryptophan 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Medroxyprogesterone glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Aminocyclobutane Carboxylic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PGH2-EA 1 1 1 112483 1 1 94975 1 1 1 439056 1 1 1 1 1 1 1 1 1 "PE(17:0/22:2(13Z,16Z))" 1 1 1 1 645355 1 1 1 1 1 1 1 1 1 1 1 1089411 943032 1 1761414 "9-Fluoro-16alpha-hydroxyandrost-4-ene-3,11,17-trione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Demissine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(14:0/22:4(7Z,10Z,13Z,16Z))" 2266526 2297496 1 3119651 1770958 1 4462605 4653725 1936788 1861486 1.29E+07 9940315 2206004 2229836 1.21E+07 8931527 3693686 109956 1.19E+07 8689101 (R)-Hispaglabridin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ivermectin B1b 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ivermectin B1a 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Acetylindole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Phosphatidyl glycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glc-GP(18:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Arg Arg 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 W123 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glyodin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-(6'-Methylthio)hexylmalic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Coumaroyl-2-hydroxyputrescine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Arg Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Eudesmin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-di-(9Z,12Z-octadecadienoate) 3-(9Z-octadecenoate)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "14-O-(alpha-D-glucopyranosyl)-7S,14S-dihydroxy-7,9,13,17-tetramethyl-2E,4E,8E,10E,12E,16E-octadecahexaenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tegaserod 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 YM-53601 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-(2,3-Dihydro-1H-pyrrolizin-5-yl)-2-propen-1-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(all-Z)-7,10,13-Docosatrienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gabapentin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(18:4(6Z,9Z,12Z,15Z)/24:1(15Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(12:0/20:1(11Z)) 1 297787 1 144885 1 1 499720 352100 1 1 3119886 1 374150 1 1587283 1 508364 525701 63363 1664657 N-acetyl-alpha-D-galactosamine 1-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N2-Fructopyranosylarginine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(14:1(9Z)/17:2(9Z,12Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ptilosaponoside B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Amino acid(Arg-) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Propenyl 2-aminobenzoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Hexadecylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 His Lys Met 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-16:0/20:2(11Z,14Z))" 2095184 8231286 103363 396921 4350682 7583970 1 1 7380419 1506860 2.15E+07 1457519 1990727 6913157 8420825 3972280 9487353 6618004 5290281 1185804 Sitaxentan 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glycerol 1-eicosanoate 2-(9Z-octadecenoate) 3-octadecanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Perindopril glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D-1-Aminopropan-2-ol O-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Octylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 G-418 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Hydroxycinnamic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lys Lys Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(P-16:0/14:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 His Lys Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Palmitic amide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE-Cer(d15:1(4E)/22:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Taurallocholic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Amino-2-methylbutanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-20:0/19:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (1'R)-Nepetalic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Calomelanol A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,2-Dimethyl-3-(4-methoxyphenyl)-4-ethyl-6-(1-pyrrolidinylmethyl)-2H-1-benzopyran-7-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Khellol glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Artobiloxanthone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(16:0/5:1(4E)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(1-Deoxy-1-fructosyl)tryptophan 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6alpha,9-Difluoro-11beta-hydroxypregn-4-ene-3,20-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nomilinic acid 17-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cloethocarb 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dicyclohexylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Amino-2-naphthoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3,2',3'-Tetrakis(3-hydroxytetradecanoyl)-D-glucosaminyl-1,6-?- D-glucosamine 1-phosphate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Succinylcholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avermectin B1a monosaccharide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl tryptophan 1 1 1 1 1 1 72292 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-cis-(R)-allethrin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Dimethylamino-L-phenylalanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Carbendazim 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cohibin C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (R)-Pelletierine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-octadecanoyl-L-Homoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 agavoside A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Diisopropyl phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(24:1(15Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Uracil 5-carbaldehyde 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Benzphetamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13E-Docosenamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Archangelolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-di-(9Z-octadecenoate) 3-octadecanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (3-Arylcarbonyl)-alanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d17:1/26:1) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Hydroxymethylantipyrine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PIP(16:1(9Z)/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Deoxyguanosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Butoctamide hydrogen succinate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 2,3-di-(9Z-octadecenoate) 1-hexadecanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6-Butyryl-5,7-dihydroxy-8-(3',3'-dimethylallyl)-4-phenylcoumarin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3beta,22R,23R,24S)-3,22,23-Trihydroxystigmastan-6-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(20:4(5Z,8Z,11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Butirosin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)-2-(2-Furanyl)pyrrolidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gln Gln Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn Asn Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dolastatin 12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(12:0/22:4(7Z,10Z,13Z,16Z))" 199000 329066 499965 476028 1 69592 696530 1 404080 336263 73807 1 488807 1 571231 1915863 258359 231738 354752 647865 "PG(17:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 26143 1 1 1 1 1 1 1 1 1 1 36569 Guanidinosuccinic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Met Pro Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(5Z)-4,4-difluoro-1?,25-dihydroxyvitamin D3 / (5Z)-4,4-difluoro-1?,25-dihydroxycholecalciferol" 1 1 1 1 1 1 1 57365 1 1 719062 527854 1 1 1 165761 347310 1 893238 781314 4-(2-Pyrazinylethenyl)phenol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-(O-alpha-D-glucopyranosyl)-(1,3R,29S,31R)-dotriacontanetetraol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5?-Deoxy-5?-(methylthio)adenosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-Diethyl-5,6-dimethylpyrazine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pipericine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Virginiamycin M1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-Phenyl-1,3-propanediyl monocarbamate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 UCM707 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bis-(4-cyanophenyl)-methanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,2-Dimethyl-3,4-bis(4-methoxyphenyl)-2H-1-benzopyran-7-ol acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Isopentylideneisopentylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Purine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Notoginsenoside R10 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Undecylprodigiosin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (25S)-5beta-spirostan-3beta-yl beta-D-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Gln His 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2'-Deoxyinosine triphosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-nitrohexane 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Norharman 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Hydroxyvitamin D3 cellobioside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(15:0/22:4(7Z,10Z,13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9alpha-Fluoro-11beta,17alpha,21-trihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "bacteriohopane-,32,33,34-triol-35-cyclitolguanine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dimethylpentylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (R)-Butaprost (free acid) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (S)-5'-Deoxy-5'-(methylsulfinyl)adenosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bopindolol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Triciribine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-L-Leucyl-L-Proline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dehydroisochalciporone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,28-Dicaffeoyloctacosanediol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14-Methyloctadecan-2-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(P-20:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ergostane skeleton 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPC(24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(23R)-1?,23,25-trihydroxy-24-oxovitamin D3 / (23R)-1?,23,25-trihydroxy-24-oxocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/18:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(P-16:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 62860 1 1 1 1 55498 1 1 1 1 1 1 1 1 1 1 "9Z,15Z,22Z-hentriacontatriene" 1 1 75118 66157 1 1 79482 119951 45906 31010 1 42855 49508 40232 78557 84846 1 105442 1 39920 "TG(12:0/14:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3R,4S-Epoxy-6Z,9Z-nonadecadiene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(18:0/22:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16:1-Glc-Cholesterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 KDNalpha2-3Galbeta1-4(Fucalpha1-3)GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl alanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(16:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(18:2(9Z,12Z)/2:0)[U]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(12:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Isoderricin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(O-18:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(P-20:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 pregnan-21-al 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-ditetradecanoyl-sn-glycero-3-phosphosulfocholine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(15:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(10:0/4:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22-oxo-tricosanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-2-Hexenyl 2-methyl-(E)-2-butenoate 1 1 1 1 1 25012 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-8-hydroxy-11E,17-octadecadien-9-ynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Malvidin 3-rutinoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(15:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Abyssinone III 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(22:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "bacteriohopane-31,32,33,34,35-pentol" 1 1 1 1 1 1 1 1 1 1 14135 1 1 1 1 1 1 1 146715 1 "N,N-dimethyl-Safingol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11E-Eicosen-1-ol 1 1 1 1 1 1 1 1 1 1 53153 1 1 1 1 1 1 1 1 30406 Menaquinone-9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(10:0/10:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 M(IP)2C(d18:0/26:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(16:0/0:0) 1 1 1 1 1 1 30679 1 1 1 51545 72675 1 1 1 1 1 1 81652 1 1-O-[(6'-O-tetradecanoyl)-a-D-glucopyranosyl]-(2-tetradecanoyloxy)-eicosan-1-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(21:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Sacculatal 1 1 79755 61096 1 1 56834 121620 1 1 1 1 1 1 60457 81139 113859 85898 96314 96197 PI(14:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1077117 329945 1 1 1 1 1 1 1 1 TG(15:0/22:0/22:0)[iso3] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(d18:0/18:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(16:0/3:1(2E)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 58266 1 1 1 "PA(14:0/22:2(13Z,16Z))" 1 1 1 1 1959271 1 1 1 1 1 3652331 3085965 1 1411859 1 3359450 1 1 3549219 1 "PE(18:0/22:5(4Z,7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-decene-4,6,8-triyn-1-al" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(O-16:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(16:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(4E,8E,10E-d18:3)sphingosine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Crasseride 2a 1 1 1 1 1 1 1 1 1 1 1 539448 1 1 1 1 1 1 1 1 "26,26,26,27,27,27-hexafluoro-1?,25-dihydroxy-23,23,24,24-tetradehydrovitamin D3 / 26,26,26,27,27,27-hexafluoro-1?,25-dihydroxy-23,23,24,24-tetradehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-4-Methoxy-4'-nitrostilbene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(P-18:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21871 1 9-OAc-NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(t20:0/22:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CPA(18:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Kurzichalcolactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(22:4(7Z,10Z,13Z,16Z)/22:1(11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(18:3(6Z,9Z,12Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(O-18:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21-hydroxyallopregnanolone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LacCer(d18:1/14:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE-Cer(d16:2(4E,6E)/20:1(11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(20:3(8Z,11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(P-16:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-deoxy-PGF1? 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-1-Silphinene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "13,17-Dimethyl-1-tritriacontene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(14:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 118501 1 1 1 1 1 1086928 1254665 1 1 1 708749 413795 407062 1562111 1132196 "PE-Cer(d14:2(4E,6E)/22:1(13Z)(2OH))" 1 1 1 1 1 1 1 1 1 81543 1 1 500086 93179 1 1 149333 1 1 1 16-Oxolycoclavanol 1 1 101165 1 1 1 230926 149940 1 1 395980 1 1 1 432594 152765 1 1 1 96362 12a-Hydroxymunduserone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(24:1(15Z)/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(4E,6E,d14:2) sphingosine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(O-16:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1365613 1 1 1 1 1 1 PE(12:0/20:0) 1 1 1 1 1 1 1 1 1 1 892189 1 1 1 1 1 1 1 1420588 944794 "(7E,9E,13E)-5,6,15-trihydroxyicosa-7,9,13-trien-11-ynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(18:3(9Z,12Z,15Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 67259 1 1 1 "24,24-difluoro-1?,25-dihydroxy-26,27-dimethyl-24a-homovitamin D3 / 24,24-difluoro-1?,25-dihydroxy-26,27-dimethyl-24a-homocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Deoxy-3-azido-25-hydroxyvitamin D3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Man-b1-2-Ins-1-P-Cer(t18:0/2-OH-26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 980836 984808 1335788 1 "2E,8E-Undecadiene-4,6-diynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuAcalpha2-3Galbeta1-4Glcbeta-Cer(d18:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/21:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "methyl 15-hydroperoxy-9Z,12Z,16E-octadecatrienoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(t18:0/24:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 385959 363711 1 1 Xeniasterol-a 1 1 1 80055 1 1 1 64617 119186 1 1 1 1 1 1 400502 1 1 1 1 "2-methyl-hopane-17beta,21beta-homohopanol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LacCer(d18:0/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Falcarinol 1 53940 1 1 1 1 1 1 1 1 1 1 1 1 1 1 28700 1 1 1 Scillirosidin 1 13641 1 1 20327 1 25527 1 86610 1 1 16445 1 1 52434 1 14906 17347 1 13101 "(Z,Z,Z)-11,14,17-Eicosatrienyl 4-methylvalerate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(6E,8E,12E,14E)-hexadeca-6,8,12,14-tetraen-10-ynoic acid" 33485 37070 13798 19356 43884 43233 32396 1 36635 1 98658 37413 1 20941 1 51126 21455 74010 1 74316 PS(8:0/8:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl methionine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/16:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(P-16:0/13:0) 1 70251 1 1 1 1 1 1 1 14550 1 1 1 1 1 1 1 1 1 1 "17,18-Epoxy-8,10,13(15)-lobatriene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6-Ac-Glc-GP(18:0/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2',4',5,7-Tetramethoxy-8-methylflavanone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/22:0/22:0)[iso3] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Octadecanoic acid, 18-fluoro-" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-2-Octenyl hexanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CerP(d18:1/8:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3Z,6Z-Eicosadiene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pumilaisoflavone C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(12:0/20:1(11Z)) 1 1 1 1 1 1 1 1 1 1 728733 1 1 1 1 1 548932 493030 993254 963046 "PG(12:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 957524 1 1 1 1 1 1 1 1955043 1200711 Cucurbitacin B 1 487621 1 1 898969 898737 1 1 1 1 536237 471285 428579 430922 697237 479865 1 1 1 1 Fluvoxamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(13:0/18:3(6Z,9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Blumenol C O-[rhamnosyl-(1-6)-glucoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "7',8'-Dihydro-8'-hydroxycitraniaxanthin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1505334 898486 1 1 1407803 1342242 13884 1 74472 33649 1 1 740770 895856 29854 1 1 19662 1 1 Ile Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(5Z)-4,4-difluorovitamin D3 / (5Z)-4,4-difluorocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-trans-C75 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Azoprocarbazine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CAY10580 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Trp Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3R,3'R,13-cis)-b,b-Carotene-3,3'-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-15S-hydroxy-hexadecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Hygroline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hyoscyamine methyl 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2S,4S,6S)-2-[2-(4-Hydroxy-3-meyhoxyphenyl)ethyl]tetrahydro-6-(4,5-dihydroxy-3-methoxyphenyl)-2H-pyran-4-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-di-(9Z-octadecenoate) 3-tetradecanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Krm 1657 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D-erythro-Sphingosine C-20 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Melleolide M 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cannabinol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-(N-Nitrosomethylamino)propionitrile 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-(O-alpha-D-glucopyranosyl)-(1,3R,27S,29R)-triacontanetetraol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Trp Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gamma-Glu-Leu 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Caffeoylcycloartenol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16-phenoxy tetranor PGF2? methyl amide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17-phenyl trinor PGF2? cyclohexyl amide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Norcholestenol iodomethyl (131 I) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Gln Gln 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-arachidonoyl glutamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tecostanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "12alpha-Fluoro-11beta,17beta-dihydroxyandrost-4-en-3-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Crotamiton 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gly Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d18:0/16:0) 103396 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(14:1(9Z)/20:2(11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gly Lys Pro 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (S)-3-Mercaptohexyl butyrate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(13:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2S,4S,6S)-2-[2-(4-Hydroxy-3-meyhoxyphenyl)ethyl]tetrahydro-6-(4,5-dihydroxy-3-methoxyphenyl)-2H-pyran-4-yl 4-acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(15:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acrifoline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(19:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Met Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 BAY-41-8543 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (R)-Prunasin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "29:3(5Z,9Z,23Z)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oseltamivir 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(1-Pyrrolidinyl)-2-propanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ganglioside GM1 (d18:0/14:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tiliacorine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dyclonine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(15:0/24:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6-Acetamido-3-aminohexanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 p-Hydroxytriamterene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3beta,6beta)-Furanoeremophilane-3,6-diol 6-acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Normeperidinic acid glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(t20:0/18:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hebevinoside I 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Alnustone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tridihexethyl 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3',4'-Methylenedioxy-alpha-pyrrolidinopropiophenone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Monopalmitin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-epoxyphylloquinone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dolichyl beta-D-mannosyl phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-aminopyrene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 all-trans-Undecaprenyl phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Hydroxymethyldeoxycytidylate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Heterophylliin F 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Spermine NONOate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Myxalamid D 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-5-(2-Propenyl)-2-oxazolidinethione 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(13:0/20:1(11Z)) 1 1 1 1 1 1 1 1 1 1 391846 1 1 1 1 1 1 1 1 1 Hydroxyprolyl-Isoleucine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)12(13)-EpOME 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-O-?-D-Mycaminosyltylactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]phenanthridine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 His Pro Ser 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10'-apo-beta-carotenal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ganoderic acid H 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Thioperamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-8-(2-Carboxy-1-phenylethyl)-3,5,7-trihydroxyflavone delta-lactone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(19:0/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hydroxyhomodestruxin B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3beta-(1-Pyrrolidinyl)-5alpha-pregnane-11,20-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Euphomine 215303 278546 1 1 551520 546137 1 1 339839 1 1 1 288125 1 1 1 1 1 1 1 Stovaine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(d20:0/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 303179 1 25-Hydroxyvitamin D2 25-(beta-glucuronide) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Mebendazole metabolite (Carbamic acid, [5-(hydroxyphenylmethyl)-1H-benzimidazol-2-yl]-, methyl ester" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2E,4E,6Z)-2,4,6-Decatrienoic acid dehydropiperidide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3beta-(3-methyl-butanoyloxy)-villanovane-13alpha,17-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(1S)-1-hydroxy-23,24-didehydro-25,26,27-trinorcalciol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-CP 55,940" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "32:6(14Z,17Z,20Z,23Z,26Z,29Z)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2'-Hydroxy-4',6'-dimethoxy-3'-methylacetophenone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dynorphin B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lys-Trp-OH 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glu His Lys 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lyciumoside IX 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Diphenadione 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ethyl 3-hydroxyoctanoate O-[glucosyl-(1-6)-glucoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Hexadecanoylpyrrolidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Filipin III 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Norcapillene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Guanidinobutanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-O-Sinapoylglucose 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Rosiglitazone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dihydro-1,1,6-trimethylnaphthalene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Celiprolol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Hydroxy-dAMP 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Coronene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-Methyl-6-(1,2,3,4-tetrahydro-6-methoxy-2-naphthyl)-2(1H)-pyridone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dolichyl phosphate D-mannose 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Flunarizine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SU 5416 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Methylpicraquassioside A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glu His Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(18:4(6Z,9Z,12Z,15Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lusitanicoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(14:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuAcalpha2-3Galbeta1-4Glcbeta-Cer(d18:1/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16-oxo-heptadecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(t18:0/16:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Norselic acid E 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "10,13-Nonadecadiynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 90833 1 1 1 Pinosylvin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(12:0/18:3(6Z,9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(17:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(22:2(13Z,16Z)/0:0)" 1 1 27320 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 73724 110699 "1-(O-alpha-D-glucopyranosyl)-29-keto-(1,3R,31R)-dotriacontanetriol" 1 1 1 1 1 1 1 1 10167 1 1 1 1 1 1 1 1 1 1 1 10-amino-decanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-amino-14,16-dimethyloctadecan-3-ol" 18567 1 1 1 1 1 1 1 1 18503 1 1 18968 1 1 1 1 1 1 1 Enigmol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18389 1 1 1 1 30520 "2-[3,5-Dimethoxy-4-[(3-methyl-2-butenyl)oxy]phenyl]-5,6,7-trimethoxy-4H-1-benzopyran-4-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5-Ethyl-3-methyl-2E,4E,6E-nonatriene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Deutzioside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 24-isopropenyl-22E-dehydrocholesterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:2/14:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(6-[3]-ladderane-hexanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphoethanolamine 1 1 1 1 1 1 1 1 1 1 1235618 1 1 1 1 1 1 1 1 1 (-)-Isolonchocarpin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "13-Octadecene-9,11-diynoic acid, (E)-; Exocarpic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Anhydro-beta-rotunol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(21:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(12:0/22:4(7Z,10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-16-Atisene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 sn-3-O-(geranylgeranyl)glycerol 1-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6E-Octene-2,4-diynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25-Methyl-24-isopropenyl-22E-dehydrocholesterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Kaempferol 3-(6''-malonylglucoside)-7-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(22:0/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22R)-22,25-dihydroxyvitamin D3 / (22R)-22,25-dihydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,4'-Diapo-zeta-carotene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-14-Serratene 75443 1 140572 1 1 1 1 1 57593 1 1 1 58175 70266 1 1 1 1 363338 452995 "PA(12:0/18:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(18:4(6Z,9Z,12Z,15Z)/24:1(15Z))" 1 1 1 34949 1 1 66804 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2E)-2,6-dimethylocta-2,7-diene-1,6-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 24-norcholesterol 1 40006 1 1 1 1 1 1 1 1 241667 213246 1 21996 1 1 1 1 1 1 PA(14:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5-Hydroxy-6,7,3',4',5'-pentamethoxyflavanone 5-O-rhamnoside" 1 142934 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(14:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6-bromo-tricosa-5E,9Z-dienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (20R)-24-Hydroxygeminivitamin D3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6-Methoxy-[2'',3'':7,8]furanoflavanone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Delphinidin 3-glucoside-5-(6-acetylglucoside) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-Ketoetiocholanolone 1 1 1 1 1 1 10403 1 1 1 1 1 13373 1 1 1 1 1 1 1 PI-Cer(t18:0/20:0(2OH)) 1 1 1 50447 1 1 24158 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(14:0/22:3(10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(18:0/P-18:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (Carotenoid K-G) 1'-Hydroxy-4-keto-gamma-carotene glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-HETE-G 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Mannosyl-1beta-phosphomycoketide C31 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 102353 1 Hydrocortisone cypionate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Mayurone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(O-15:0/20:4(5Z,8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-O-(2-O-(2E-decenoyl)-alpha-L-rhamnopyranosyl)-3-hydroxydecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(16:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 934547 1 1 1 22:1-Glc-Stigmasterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Enunicelline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,9-heptadecadien-4,6-diyn-1,8-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Furano[2'',3'':6,7]aurone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(17:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hydrocortisone caproate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "36:5(18Z,21Z,24Z,27Z,30Z)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-5:0/0:0)[R] 1 1 1 1 54617 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-Geranyl-4,2',4',6'-tetrahydroxy-5-prenyldihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 60216 1 1 1 1 1 1 1 1 1 1 1 1 1 22:1-Glc-Sitosterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(16:0/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Eicosapentaenoyl PAF C-16 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galalpha1-3(GalNAcbeta1-4)Galbeta1-4Glcbeta-Cer(d18:1/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-arachidonoyl dihydroxypropylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(10:0/16:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "35-aminobacteriohopane-30,31,32,33,34-pentol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "26,27-diethyl-1?,25-dihydroxy-20,21-methano-23-oxavitamin D3 / 26,27-diethyl-1?,25-dihydroxy-20,21-methano-23-oxacholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2E,4E,6E-Nonatrienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3'-Deoxyderhamnosylmaysin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3Z-Undecene-5,7,10-triynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Luteolin 7,3'-dimethyl ether 5-glucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (2S)-2-hydroxyphytanic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 46842 "32,35-anhydrobacteriohopan-11-ene-tetrol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/16:1(9Z)) 8969332 9982711 1 1 1 8819283 1 1 8680265 8898329 1 1 7683341 8243231 1 1 1 6863241 1 1 PC(O-20:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(O-16:0/18:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuGcalpha2-8NeuGcalpha2-3Galbeta1-3GalNAcbeta1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Matricin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(tetradecanoyl)-sphing-4-enine-1-(2-aminoethylphosphonate) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19-hydroxy-nonadecanoic acid 95235 111317 1 1 84597 73523 1 1 1 88252 1 1 103504 1 1 1 1 1 1 1 "PG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/19:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 68694 N-(3-oxo-hexanoyl)-homoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-deoxy-11-methylene-PGD2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14-hydroxy-heneicosanoic acid 57882 60168 1 1 44877 66944 1 1 70378 1 1 1 66240 62505 1 1 1 1 1 1 24-epi-brassinolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 testolic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 27410 1 6-Methylsalicylic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-arachidonoyl alanine 91062 24740 1 1 64603 1 1 1 26026 134923 1 1 156411 20889 55331 1 16071 1 1 1 "3E,6Z-Heneicosadien-11-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Evasterioside C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(19:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "MGDG(20:5(5Z,8Z,11Z,14Z,17Z)/18:3(9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tauro-b-muricholic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Patuletin 3-(6''-(E)-feruloylglucoside) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(13:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1252467 1 1 1 1 18:1 Stigmasteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Kurilensoside H 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(20:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(12:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,5-(methanoxyethano)isolongifol-4-ene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Rolliniastatin-1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 fumagillin 1 1 1 1 1 1 1 1 1 81055 120088 1 1 1 98618 115607 1 148732 1 1 Arachidonoyl-EA(d8) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPC(P-16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Erythromycin D 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "24,24-difluoro-1?,25-dihydroxy-24a-homovitamin D3 / 24,24-difluoro-1?,25-dihydroxy-24a-homocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,21-dihydroxy-20-oxo-22,23,24,25,26,27-hexanorvitamin D3 / 1?,21-dihydroxy-20-oxo-22,23,24,25,26,27-hexanorcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 37286 1 1 1 "PI(O-20:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(18:0/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 ecdysone 25-O-D-glucopyranoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Campesteryl glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-oxo-Resolvin E1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(15:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tricosanedioic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 152974 1 1 1 1 1 "PA(19:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1262897 1195803 1 804386 PS(20:0/22:0) 1 1 1 1 1 1 1 1 1 1 34765 1 1 1 1 1 1 1 1 1 N-oleoyl glutamic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 13162 1 1 1 1 1 1 PC(13:0/0:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "7,4',5'-Trihydroxy-5,2'-oxido-4-phenylcoumarin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Taurochenodeoxycholic acid 1 1 1 1 1 1 1 1 1 1 1 1 498927 467209 1 1 1 1 1 1 PA(O-18:0/13:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE-Cer(d14:2(4E,6E)/26:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-Oxochola-1,4,6-trien-24-oic Acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5-Hydroxy-3',4'-methylenedioxy-6'',6''-dimethylpyrano[2'',3'':7,8]isoflavone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "13,17-Octadecadiene-9,11-diynoic acid, (Z)-" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 29-demethylgeodisterol-O-sulfite 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(P-16:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(14:0/20:3(5Z,8Z,11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Agnuside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d17:1/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 L-Olivosyl-oleandolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Olprinone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:0/26:1(17Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oligomycin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2(1H)-Quinolinone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bisindolylmaleimide IV 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 n-Pentadecylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Asn Gln 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asiminenin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(12:0/18:1(9Z)/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn Glu Ile 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15-cyclohexyl pentanor PGF2? 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4,12-Octadecatrienoic acid isobutylamide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 S-Acetyldihydrolipoamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PtdIns-(1-arachidonoyl, 2-arachidonoyl-d8)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 beta-Skytanthine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(16:0/22:5(4Z,7Z,10Z,13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 beta-nicotinamide D-ribonucleotide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Ergoline-1,8-dimethanol, 10-methoxy-, (8b)-" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17-phenyl trinor Prostaglandin E2 serinol amide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Aminoethylphosphocholate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Ac-Tyr-Val-Ala-Asp-CHO 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dehydroepiandrosterone 3-glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Procaterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ethyl menthane carboxamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/17:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-(2,4-Cyclopentadien-1-ylidene)-5alpha-androstan-17beta-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Triphenylsilanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "MC-207,110" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Aspidoalbine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (20R)-20-hydroxypregn-4-en-3-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25637 1 5-Hydroxy-7-methoxy-2-tritriacontyl-4H-1-benzopyran-4-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn Glu Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Ethynylaniline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Desmethylmifepristone (RU 42633) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ipecac (Psychotrine) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Stypoltrione 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Ile 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydroneopterin phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(t20:0/22:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Methenamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydroceramide C2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N?-Acetyl-L-arginine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2,4,5-Tetramethylbenzene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dioleoyl phosphatidyl ethanolamine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/16:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asp Lys Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-HETE-Gly 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-4-Hexen-1-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)-2-Propylthiazolidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(4-Amino-2-methylpyrimid-5-ylmethyl)-3-(beta-hydroxyethyl)-2-methylpyridinium 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glu Trp Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(14:0/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hypoxanthine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dierucoyl-SN-Glycero-3-Phosphoethanolamine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(17:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,3-alpha-D-Mannosyl-1,2-alpha-D-mannosyl-1,2-alpha-D-mannosyl-D-mannose" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17a-Aza-D-homoandrost-5-en-3beta-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Di(2-pyridyl)ethylene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Desglucocoroloside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Protocatechoylphloroglucinolcarboxylate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Triricinolein 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Chloroacetic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-dihexadecanoate 3-(9Z-octadecenoate)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sorbitan tristearate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPC(15:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(16:0/22:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Stearoyl-2-Oleoyl-sn-Glycero-3-[Phospho-rac-(1-glycerol)] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Demethylcitalopram 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Flaccidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Armillane 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Eremopetasitenin A2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (S)-4-Amino-5-oxopentanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Phosphonoacetaldehyde 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Santene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gliadin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 L-NMMA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:1/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,8-Dihydroxy-6-methoxy-7(11)-eremophilen-12,8-olide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Acetyl-O-demethylpuromycin-5'-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 beta-D-Gentiobiosyl crocetin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lys Lys Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(20:1(11Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3beta,22E,24R)-Ergosta-4,6,8(14),22-tetraen-3-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Lys Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DISBAC10 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Chaulmosulfone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Callytriol C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-Hydroxy-N-glycyl-2,6-xylidine (3-Hydroxyglycinexylidide)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bifonazole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22R,23R)-22,23-Dihydroxycampesterol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D-Apiitol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(16:0/22:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 AS 1-5 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Diphenylurea 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,4-Methylenedioxybenzoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Hexanol arabinosylglucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oleoyl 3-carbacyclic Phosphatidic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-Dihydro-6-hydroxy-2-(4-hydroxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(12:0/20:2(11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fenbuconazole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Dibenz[a,h]acridine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hydroxyflunarizine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Hydroxy-3-methyl-9H-carbazole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15(S)-Fluprostenol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Epanolol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pantoprazole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Heptadecylfuran 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Cys Met 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Spinetoram 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(19:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Guanidino-1-deoxy-scyllo-inositol 4-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-?-Hydroxybutyl Hydantoin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D-Pantethine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-Dehydroporson 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acridine orange 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,3-Dihydroxy-N-methylacridone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Magnesium protoporphyrin monomethyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Methyldioctylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Lys Thr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6,8-Dihydroxypurine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)10-Gingerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25-Cinnamoyl-vulgaroside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "17-Methyl-3-(2,4-cyclopentadien-1-ylidene)-5alpha-androstane-17beta-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-[(3-Methylbutyl)nitrosoamino]-2-butanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 gamma-Coniceine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(13:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Isometheptene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Capsicoside C2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-(Z)-Tetrahydro-6-(2-pentenyl)-2H-pyran-2-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Phe Tyr Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fluprostenol-d4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(16:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SC-57666 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(Z,Z)-2,9,16-Heptadecatriene-4,6-diyn-8-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3a,7b,12a-Trihydroxyoxocholanyl-Glycine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4-Dimethylpyridine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gln Ile Ile 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 STS-135 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Halaminol A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galalpha1-3(Galbeta1-4GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(22:1(11Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bakkenolide D 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Clavamycin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19'-Hexanoyloxyfucoxanthin 1 1 1 1 1 1 1 1 1 1 2826742 1 1 1 1 1 1 1 1 1 5-O-Methylembelin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17-phenyl trinor Prostaglandin F2?-d4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(1(10)E,4E,6a,8b)-8-Angeloyloxy-14-oxo-1(10),4,11(13)-germacratrien-12,6-olide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MG(0:0/24:1(15Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Prosafrinine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Bornyl acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cloversaponin I 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-Isopropyl-1,4-hexadiene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Flecainide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Tyr Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arachidonoylmorpholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Prednisolone tebutate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 sn-glycero-3-phosphoethanolamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2R,3R,4R)-2-Amino-4-hydroxy-3-methylpentanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Isoxaben 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Benperidol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 FKGK 11 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Aminoheptanedioic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cyprodinil 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "17,21-Epoxy-9-fluoro-11beta-hydroxypregn-4-ene-3,20-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arctolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 [6]-Shogaol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (R)-Roscovitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(9E,11E)-13-oxooctadeca-9,11-dienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9,10-Dihydrokadsurenone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+)-Bornane-2,5-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Donhexocin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Spiramycin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-O-beta-D-Glucopyranosyl-2,3-di-O-palmitoylglycerol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+/-)-2,16,-dimethyl-5,8,11,14-all-cis-docosatetraenoyl-2'-fluoroethylamine" 1 1 1 1 1 102359 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Deferasirox 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Coniine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-methyl sulfolene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Trimethylaminoacetone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-amino-octanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lys Phe Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PtdIns-(4)-P1 (1,2-dihexanoyl)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Isorhamnetin 7-alpha-D-Glucosamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/12:0/17:0)[iso3] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Desmethylpirenzepine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-18:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SP 600125 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-(2-Aminoethyl)indole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lauroyl diethanolamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(19:3(10Z,13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 423304 1 1 1 1 1 1 1 1-tetradecanol 69161 1 1 1 1 1 1 1 1 1 1 1 15534 24985 1 61766 33922 39359 1 1 Ile Lys Lys 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Carpelastofuran 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "N-3,7-Dimethyl-2,6-octadienylcyclopropylcarboxamide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Alfentanil 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Naphthalic anhydride 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2',4',6'-Trihydroxydihydrochalcone 2'-glucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/13:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nupharamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Etacelasil 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6-Epikarpoxanthin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3beta-Fluoro-5beta-pregnan-20-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (S)-3-(Imidazol-5-yl)lactate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "N-Methyl-N,4-dinitrosoaniline" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oxolinic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 E-64c 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Endecaphyllin X 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-[4-(3,4-Methylenedioxyphenyl)butyl]-4(1H)-quinolinone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ethyl aconitate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Fluoroethcathinone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 alpha-Allokainic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CAY10618 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Vomicine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Ile Ile 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Ile Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15:0 Cholesteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4-Diaminotoluene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-Aminoestra-1,3,5(10)-triene-3,17beta-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oxotolrestat 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3',4,6-Tetrahydroxybenzophenone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2,3,4-Tetrahydro-1-[1-hydroxy-3-(4-hydroxyphenyl)-2-propenyl]-6,7-dimethoxy-2-naphthalenol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CAY10633 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asp Phe Pro 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gal?1-4Glc?-Sp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Heptane-1-thiol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Etoposide sulfate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-22-oxavitamin D3 3-hemiglutarate/ 1?,25-dihydroxy-22-oxacholecalciferol 3-hemiglutarate" 1 1 1 1 1 1 1 1 1 1 1 1 423304 1 1 1 1 1 1 1 Dibenzyl disulfide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Hydroxydopamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuGcalpha2-3Galbeta1-4GlcNAcbeta1-3(Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-[1,4-Dihydro-4-nonyl-5-(1-oxodecyl)-3-pyridinyl]-1-dodecanone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(6:2(3E,5E)/14:2(11E,13E))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Quizalofop-P-tefuryl 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Demecarium 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Annofoline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ethyl Oxalacetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Abu-Ile-OH 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-(2,3-Dihydro-1H-pyrrolizin-5-yl)-1-butanone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asparagoside E 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "12-oxo-14,18-dihydroxy-9Z,13E,15Z-octadecatrienoic acid" 31874 119522 1 1 1 1 43618 1 1 1 91765 236797 1 19164 462193 1 1 222878 255293 1 "3,7,8,15-Scirpenetetrol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(12:0/16:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Phenylethylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(24:1(15Z)/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cyclovariegatin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Samin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dodecaprenyl diphosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Adifoline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(11Z)-8,18-methano-retinal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 EPA (d5) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(15:0/22:1(11Z)) 1 1 1 1 1 89144 1 1 113051 1 1 1 1 1 1 1 1 1 1 1 PGS 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(22:1(11Z)/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "24-(dimethoxyphosphoryl)-25,26,27-trinorvitamin D3 / 24-(dimethoxyphosphoryl)-25,26,27-trinorcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-24-oxo-22-oxavitamin D3 / 1?,25-dihydroxy-24-oxo-22-oxacholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(O-18:0/19:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(12:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 95387 1 1 1 1 (+)-?-Tocopherol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 136438 1 1 1 1 1 6-Deoxyerythronolide B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(14:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(21:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(16:0/0:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-3-methylglutaconic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,2,4-Trimethyl-6-(1-oxo-3-phenylpropyl)-1,3,5-cyclohexanetrione" 1 22345 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,4'-Dihidroxy-7,8,2',3'-tetramethoxy flavone 5-glucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GalNAcalpha1-3Galbeta1-3GlcNAcbeta1-3(Galbeta1-3GlcNAcbeta1-6)Galbeta1-3GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Dihydroparasiloxanthin/ 7,8,7',8'-Tetrahydrozeaxanthin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE-Cer(d16:1(4E)/20:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sphingofungin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Aminohexadecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 11560 1 1 1 1 1 1 1 "(17Z)-1?,25-dihydroxy-26,27-dimethyl-17,20,22,22,23,23-hexadehydrovitamin D3 / (17Z)-1?,25-dihydroxy-26,27-dimethyl-17,20,22,22,23,23-hexadehydrocholecalciferol" 1 1 1 1 1 1 1 128164 1 1 1 1 1 1 1 1 1 1 1 1 "TG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Epothilone A 1 1 1 1 1 118182 1 1 1 200458 1 1 1 1 1 1 1 1 1 1 "PC(18:3(6Z,9Z,12Z)/24:1(15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,9Z,16-heptadecatrien-4,6-diyn-3,8-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (S)-3-hydroxyhexacosanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (Z)-7-Dodecenyl butyrate 1 1 1 1 1 1 1 1 1 47163 1 1 1 1 1 1 1 1 1 1 O-Methylpongamol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-5-oxo-1,2-campholide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-trans-LTD4 1 1 1 188045 1 1 1 1 1 1 1 1 1 1 1 558454 1 1 1 1 "PS(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ximaosteroid D 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-[3]-ladderane-dodecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(O-16:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/22:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:1/26:1(17Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fucalpha1-2Galalpha1-3Galbeta1-4Glcbeta-Cer(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/18:0/22:2(13Z,16Z))[iso6]" 4758259 5427271 280948 68606 5239069 4680872 141079 140920 4464173 2219933 701083 64310 4582863 4269020 1402382 216887 4024957 5149407 2055456 39503 "DG(16:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(10:0/11:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Eicosanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11224 22768 Amorphigenin O-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,5,2'-Trihydroxy-7,8,4'-trimethoxyflavone 5-glucosyl-(1-2)-galactoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(14:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(13:0/18:3(6Z,9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(14:0/22:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-methyl-tetradecanedioic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(12:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(6S)-vitamin D2 6,19-sulfur dioxide adduct / (6S)-ergocalciferol 6,19-sulfur dioxide adduct" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 284927 1 1 1 124249 1 1 125349 1 1 1 15498 48873 1 1 1 1 96287 "4,2',3',4'-Tetrahydroxychalcone 4'-O-(2''-O-p-coumaroyl-6''-O-acetyl)glucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(21:0/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(±)11,12-DHET" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (20S)-3beta-Hydroxy-5alpha-cholan-24-oic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Catechin-4-ol 3-O-beta-D-galactopyranoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Cer(d16:2(4E,6E)/24:0(2OH))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-2?-(3-hydroxypropoxy)vitamin D3" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "MGDG(18:3(9Z,12Z,15Z)/16:3(7Z,10Z,13Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3'-Prenylrubranine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3S)-3',7-dihydroxy-2',4',5',8-tetramethoxyisoflavan" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(15:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,7,3',4',5'-Pentahydroxy-3,6,8-trimethoxyflavone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl valine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Minabeolide-2 1 1 1 1 1 150106 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(17:0/26:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(17:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 VD 2716 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Spongipregnoloside D 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14-F2-dihomo-IsoP 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Adapalene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Teleocidin B-1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lepidiumterpenyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Imatinib 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "15(R),19(R)-hydroxy PGF2?" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pumiloside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Desoxypeganine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nitramine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Diminazene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cromakalim 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12S-acetoxy-punaglandin 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Antibiotic X 14889C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Capsi-amide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(22:2(13Z,16Z)/21:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GalNAcalpha1-3GalNAcbeta1-3Galalpha1-3(NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Calomelanol D-1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(5'-Phosphoribosyl)-5-formamido-4-imidazolecarboxamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-thio-Acetyl MAGE 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Naphthylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "17-?, 21-Dihydroxy-11,20-dioxo-5-?-pregnan-3-?-yl-?-d-glucuronide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2S,4S)-Monatin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asp Gly His 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4-Undecadiene-8,10-diynoic acid 2,3-dehydropiperidide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11,13-Dihydrotaraxinic acid glucosyl ester" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-O-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(E)-3,7-Dimethyl-2,6-octadienyl heptanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 43873 1 Butacaine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(12S,15S)-15-O-Demethyl-10,29-dideoxy-11,12-dihydro-striatin C" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(12:0/20:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(Z)-6-Tetradecene-1,3-diyne-5,8-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Albafuran A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-O-ethyl PAF C-16 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(13:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Piperaduncin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/19:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-di-(9Z,12Z-octadecadienoate) 3-hexadecanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Febrifugine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dicyclohexylcarbodiimide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-Diacetoxy-7,8-Epoxy-24,29-Dinor-1,3,5-Friedelatriene-20-Carboxylic Acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Famotidine sulfoxide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-oleoyl tyrosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acebutolol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (Ac)2-L-Lys-D-Ala 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Deoxy-D-glucitol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 UDP-N-acetyl-6-(D-galactose-1-phospho)-D-glucosamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glu Glu Thr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Di-demethylcitalopram 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-O-Methylarmepavine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6-bromo-24-methyl-pentacosa-5E,9Z-dienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (R)-Mahanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Metoprolol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dioleoyl-rac-glycerol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-11-Hydroxy-9,15,16-trioxooctadecanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,4-Bis(p-fluorophenyl)butyric acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydro Isorescinnamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-6:0/0:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Naphthoquinone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pirbuterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sporidesmolide I 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Niazirinin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fluconazole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C-2 Ceramide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Labriformidin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Janthitrem E 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 28-Glucosyloleanolic acid 3-arabinoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Uscharidin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Heptyl-3-hydroxy-quinolone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-oleoyl threonine 1 1 1 1 40896 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-docosahexaenoyl GABA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Stigmastanyl glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DAT(16:0/24:0(2Me[S],3OH[S],4Me[S],6Me[S]))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-2:0/O-1:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-9:0/O-1:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(P-20:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 135869 1 1 1 1 1 "PC(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(d18:0/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "13-tetradecen-2,4-diyn-1-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(8-[5]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22E)-1?-hydroxy-24-oxo-26,27-cyclo-22,23-didehydrovitamin D3 / (22E)-1?-hydroxy-24-oxo-26,27-cyclo-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(22:5(4Z,7Z,10Z,13Z,16Z)/24:1(15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Hydroxyundecan-6-one 1 153590 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "10S,17S-DiHDoHE" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2'',6''-Di-O-Acetyl isovitexin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PGE2-dihydroxypropanylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(P-16:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 sn-caldarchaeo-1-phosphoethanolamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d17:1/0:0) 1 1 1 1 1 1 1 45643 1 1 1 1 1 1 1 1 1 1 1 1 Galbeta1-4GlcNAcbeta1-3(Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(20:5(5Z,8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-O-(3R,4-dihydroxy-2-methylene-butanoyl)-beta-D-glucopyranose" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(24R)-1?,24,25-trihydroxyvitamin D2 / (24R)-1?,24,25-trihydroxyergocalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3alpha,7alpha,12alpha-trihydroxy-27a,27b-dihomo-5beta-cholestane-26,27b-dioic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GlcCer(d18:2/23:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Kurilensoside I 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20S)-1?,25-dihydroxy-20-ethoxy-26,27-dimethyl-24a-homovitamin D3 / (20S)-1?,25-dihydroxy-20-ethoxy-26,27-dimethyl-24a-homocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 M(IP)2C(d18:0/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-O-alpha-D-glucopyranosyl-(2-hexadecanoyloxy)-eicosan-1-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-hydroxy-estra-1,3,5(10),7tetraen-17-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(17:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 129388 1 1 1 DG(15:1(9Z)/22:1(11Z)/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(12:0/14:0) 1 1 1 1 1 116027 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Isorhamnetin 3-(2'''-acetyl-alpha-arabinopyranosyl)-(1-6)-galactoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(12:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(P-18:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-O-(alpha-L-rhamnopyranosyl-(1-2)-alpha-L-rhamnopyranosyl)-3-hydroxydecanoic acid 1 1 1 1 1 99300 1 1 1 1 1 1 1 1 101644 1 1 1 1 1 N-arachidonoyl glutamic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3'-Dehydrolutein/ Philosamiaxanthin/ 3-Hydroxy-?,?-caroten-3'-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galbeta1-3(NeuAcalpha2-6)GalNAcbeta1-4(NeuGcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPE(0:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 11859 1 1 1 1 1 1 1 1 1 1 31249 1 16alpha-Hydroxyestrone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl glutamic acid 1 1 1 1 1 1 1 1 49541 1 1 1 1 1 1 1 1 1 1 1 Xestoaminol C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GlcCer(d18:1/14:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "trans,trans-hepta-2,4,6-trienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (Z)-5-Dodecenyl (Z)-5-dodecenoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2E,4E,6Z)-7-(7,7-Dimethyl-4,5,6,7-tetrahydro-1H-inden-2-yl)-3-methyl-octa-2,4,6-trienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4-Dodecadienoic acid pyrrolidide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ganglioside GD3 (d18:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Ile Ile 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(diphenylmethylene) Glycine benzyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Butalbital 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dibekacin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Verbasoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "CL(1'-[22:1(13Z)/22:1(13Z)],3'-[22:1(13Z)/14:1(9Z)])[rac]" 1 982393 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Neolinustatin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Clidinium 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Triamcinolone hexacetonide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D-erythro-Sphingosine C-15 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ubiquinone 8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ethambutol aldehyde 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5-ethyl-5-(pentan-2-yl)-1-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Acetylpyrazine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+)-threo-2-Amino-3,4-dihydroxybutanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "7,8 Dihydrokawain" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Caffeine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lys Pro Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 alhpa-tocopheronolactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,8-Diazabicyclo[5.4.0]undec-7-ene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Hexadecanoyl-2-(14-pentadecenoyl)-sn-glycero-3-phosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lys Val Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPC(22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cys Ile Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Doxacurium chloride 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2'-Oxoaloesol 7-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn Gln His 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Deoxysepiapterin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn Thr Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Hydroxyclonazepam 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Flunitrazepam 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 R-L3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3S,3'S,5R,5'R,6R)-3,6-Epoxy-5,6-dihydro-3',5,8'-trihydroxy-beta,kappa-caroten-6'-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "MGDG(18:5(3Z,6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,1'-[1,12-Dodecanediylbis(oxy)]bisbenzene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Melatonin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Samandarine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Artemoin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Chlorhexidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-Diethyl-5-methylpyrazine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-abscisic aldehyde 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Ile 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 trans-2-Enoyl-OPC8-CoA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(13:0/20:4(5Z,8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Dehydrodeguelin,7a,13a-Didehydrodeguelin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Prostaglandin F2?-biotin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Amino-6-ribitylamino uracil 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20S)-20-cyclopropyl-1?,25-dihydroxy-16,17-didehydro-21-norvitamin D3 / (20S)-20-cyclopropyl-1?,25-dihydroxy-16,17-didehydro-21-norcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(3-Methylbutanoyl)-6-apiosylglucose 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lagerstroemine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "14,14,14-Trifluoro-11E-tetradecenyl acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuAcalpha2-3Galbeta1-3(Fucalpha1-4)GlcNAcbeta1-3(Fucalpha1-3GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z)) 1 1 1 1 12286 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dioleoyl PC" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,3-Dibenzyltetramethyldisiloxane" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Di(2-ethylhexyl) adipate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Levonorgestrel acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(14:0/22:4(7Z,10Z,13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Lys Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Isomangiferin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(5-Methyl-3-pyridinyl)-1-decanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 ?-Linolenoyl Ethanolamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 37725 1 1 3'-N-Acetyl-4'-O-(14-methylpentadecanoyl)fusarochromanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 UH-301 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Cyclopropyl-trans-2-cis-6-nonadienamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glu Thr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-iodo-octadecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,5-Pyridinedicarboxylic acid, 4-(2,1,3-benzoxadiazol-4-yl)-1,4-dihydro-2,6-dimethyl-, mono(1-methylethyl) ester" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13-Hydroxylupanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Devazepide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C22 Sulfatide 1 1 1 1 1 1 505477 1 1 1 57062 34880 1 1 120030 1 1 1 1 1 N-Formyl-4-amino-5-aminomethyl-2-methylpyrimidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bis (2-hydroxypropyl) amine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 prolintane 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Aristolochic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Ile Lys 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D-Pantetheine 4'-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(Cyclohexylmethyl)-N-methylbenzenamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ofloxacin-N-oxide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-Dihydroxycarbamazepine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ferimzone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,3-ditetradecanoate 2-(9Z-octadecenoate)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(13:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Proline betaine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Phosphodimethylethanolamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acetylleucyl-leucyl-norleucinal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Isopropyl-3-methoxypyrazine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7-Oxociguatoxin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Madlongiside C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Hydroxyenterodiol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Baptifoline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cinnarizine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8-hydroxy Guanosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oxytetracycline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9-Azabicyclo[3.3.1]nonane, 1H-indazole-3-carboxamide deriv." 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 AM2232 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Hexadecyl Lysophosphatidic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,4-Difluoro-17beta-hydroxyandrost-5-en-3-one propionate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Phe Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Saccharopine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Estradiol Cypionate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bryostatin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Stearoyl-2-Docosahexaenoyl-sn-Glycero-3-[Phospho-rac-(1-glycerol)] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "25-hydroxy-16,17,23,23,24,24-hexadehydrovitamin D3 / 25-hydroxy-16,17,23,23,24,24-hexadehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 alatolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Tephrosone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Malvidin 3-O-(6-O-(4-O-feruloyl-alpha-rhamnopyranosyl)-beta-glucopyranoside)-5-beta-glucopyranoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Triflupromazine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 9-O-Acetylneuraminic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 His Lys Pro 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(6-[5]-ladderane-hexanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphoethanolamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 774096 1 1 1 1 Didesmethylpheniramine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D-Mannosyl-L-rhamnosyl-D-galactose-1-diphospholipid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15-Palmitoylsolamin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(13:0/20:2(11Z,14Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 10803 1 1 1 28377 1 1 1 1 1 Triacanthine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dipyridamole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "10,12-Tetradecadienal" 1 1 1 1 1 1 422227 1 1 1 1 1 14550 1 1 30966 1 1 1 1 Fructoselysine 6-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asp Ile Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE-Cer(d14:2(4E,6E)/21:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Arachidonoyl Dopamine-d8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Malyngamide C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galalpha1-3Galalpha1-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Slaframine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(11:0/18:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-4'-Methylresveratrol 3-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 tiracizine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CAY10583 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(18:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d15:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Keto-4'-hydroxyalloxanthin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nalbuphine-3-glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,8,11,14-all-cis-docosatetraenoylethanolamine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 264589 1 1 1 212664 PA(12:0/15:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tragopogonsaponin K 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(20:2(11Z,14Z)/18:3(6Z,9Z,12Z)/20:2(11Z,14Z)) (d5)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,3-Dideacetyl-7-Deacetoxy-7-Oxokhivorin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Delphinidin 3-caffeylglucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Spinoside A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(16:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 97629 95033 1 1 1 1 "di-trans,poly-cis-Octaprenyl diphosphate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-[2-(1H-Indol-3-yl)ethyl]docosanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 L-a-Lysophosphatidylserine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arachisprenol 12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 HU210 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(14:0/22:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Vinaginsenoside R12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cinnzeylanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8-O-Methyloblongine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+/-)-5-[(tert-Butylamino)-2'-hydroxypropoxy]-1,2,3,4-tetrahydro-1-naphthol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Miserotoxin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-16:0/16:0) 1 1 48748 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Asp Gly 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gal?1-3GalNAc?-Thr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Leukotriene A4-d5 methyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Melilotoside B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/22:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 ZK118182 isopropyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(21:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 69802 1 1 1 1 1 1 1 "PA(20:4(5Z,8Z,11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Adlupone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Alytesin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(12:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Agaritinal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tribenzylamine n-oxide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(12:0/22:0/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Boc-Pro-DVal(NMe)-Val-OMe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Netilmicin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Biperiden 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SQDG(16:0/16:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 678780 1 1 1 Solacapine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hovenidulcigenin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(0:0/8:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dezocine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(17:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(20:3(8Z,11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Olomoucine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nonoxynol-9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arachidonyl carnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ginsenoside F3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Aminoimidazole ribonucleotide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Prorocentrolide B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/18:0/22:0)[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Anandamide (18:4, n-3)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)-UR-144 N-(4-hydroxypentyl) metabolite 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cycrimine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Alangicine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Arg Ile 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(±)N-(2-fluro-ethyl)-2,16,16-trimethyl-5Z,8Z,11Z,14Z-tricosatetraenoyl amine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Hydroxybenzaldehyde O-[xylosyl-(1-6)-glucoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C-6 NBD-dihydro-Ceramide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fluphenazine depot 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Desmethyldescarbamoylnovobiocin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Methylcytidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Deacetyldiltiazem 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 His Met Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(d18:0/18:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Boc-Phe(NMe)-Gly-OMe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 trans-2-Enoyl-OPC6-CoA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPC(26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dimethylaminoethyl reserpilinate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(17:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 91606 1 1 1 1 1 Fortimicin KL1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Mesaconitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N2-Maltulosylarginine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(16:0/22:6(54Z,7Z,10Z,12E,16Z,19Z)(14OH))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Retinylphosphate mannose 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CAY10433 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acotiamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4'-Methyl-alpha-pyrrolidinopropiophenone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:1/25:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N4-Phosphoagmatine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(24R)-5b,8b-Epidioxyergosta-6,22E-dien-3b-ol 3-glucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Epihydroxy-2'-deoxymugineic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Citrusin F 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gravolenic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Arg 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d18:0/h17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 JWH 309 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (20S)-24-Hydroxy-19-norgeminivitamin D3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C17 Sphinganine-1-phosphate 1 17604 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Octadecyl fumarate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cyanofenphos 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Talinumoside I 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(13:0/22:0) 1 1 1482856 1501785 1 726429 1975554 2523475 696608 1 5250272 3955437 1 1 1 4480738 1 1987330 4349017 4164569 "PA(20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 enantio-PAF C-16 221975 1 1 1 1 185084 1 1 1 181604 1 1 1 1 1 1 1 1 1 64973 Mycalolide B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dieporeticenin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5''-Phosphoribostamycin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 isopropamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-(8Z,11Z,14Z-Eicosatrienoyl)-sn-glycero-3-phosphocholine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-trans,6-cis,10-trans-geranylgeranyl diphosphate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Progeldanamycin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "L,L-Cyclo(leucylprolyl)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 methyl 4-[2-(2-formyl-vinyl)-3-hydroxy-5-oxo-cyclopentyl]-butanoate 1 1 1 1 1 1 1 1 1 1 84317 1 1 1 1 1 1 1 1 1 Cer(d20:0/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Heptadecanoyl carnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Xylometazoline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Trospium 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "16-Glutaryloxy-1?,25-dihydroxy-20-epivitamin D3" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Genipin 1-beta-gentiobioside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acetyl Tyrosine Ethyl Ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2E,4E)-2,4-Dodecadienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ochrolifuanine A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hericene A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-amino-hexadecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Distearoyl phosphatidyl serine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Proglumide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-18:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 tetranor-PGEM-d6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 His Ile Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2alpha,3alpha-(Difluoromethylene)-5alpha-androstan-17beta-ol acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(10:0/13:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(Z)-11beta,21-Dihydroxypregna-1,4,17(20)-trien-3-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-8beta-Presilphiperfolanol 261328 236671 22357 1 1 60795 1 76188 1 1866146 1 1 1 257428 183415 83483 1394328 1161610 1 41006 (+)-Echinoisoflavanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 30923 1 decanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20R)-17alpha,20-dihydroxycholesterol" 1 43394 1 1 1 1 1 1 15466 1 16519 1 1 1 1 1 1 1 1 1 1-(8-[3]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphoethanolamine 1.50E+07 9.33E+07 1939676 1633234 5.69E+07 764567 1.98E+07 7365841 4.99E+07 5.06E+07 2.61E+07 7634683 542889 5.09E+07 2.67E+07 1.12E+07 5.77E+07 5.49E+07 2.21E+07 1.05E+07 Oleandolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C20 Sulfatide 1 1 289735 1 1 1 1 253272 1 1 10975 1 1 1 1.08E+07 7588304 1 1 1.21E+07 202887 "3'-Geranyl-2',4',6'-trihydroxychalcone" 1 1 1 1 1 1 1 1 1 1 478957 1 1 1 1 1 1 1 1 1 11-dehydro-TXB3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(1R,2S,4R)-(+)-Bornyl acetate" 1 1 4.48E+07 1 6228191 1 1274641 4.54E+07 1 1117780 1 969709 1 802962 1.04E+07 1 1 1424805 7.02E+07 231250 "PG(15:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 678484 543305 1 387801 967662 980633 1 1 3619223 2561768 1 1 2536584 2268642 1 1 2697064 2110812 Gibberellin A36 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(12:0/22:4(7Z,10Z,13Z,16Z))" 1 1 477266 484413 1 1 679095 835484 1 1 1 1 1 1 1523248 1 1 1 1 1 "5-hydroperoxy-7-[3,5-epidioxy-2-(2-octenyl)-cyclopentyl]-6-heptenoic acid" 1 1 1 1 1 1 1 1 1 1 109882 1 1 1 1 1 1 1 1 134757 PI(13:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 9688872 5015702 1 1 7043899 1 1 1 4044510 1 N-palmitoyl taurine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sativic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(19:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 263723 268971 1 1 PC(20:0/P-18:1(11Z)) 1 1 1 1 18550 1 1 110887 1 1 1634086 50384 1 1 1271133 254350 484427 1 935178 322941 N-oleoyl asparagine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 68743 65031 1 1 1 1 1-Dodecanoyl-sn-glycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 95474 97799 22:2-Glc-Stigmasterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CerP(d18:1/26:0) 39707 1 1 1 1 410725 14101 435468 20898 14667 155584 760413 24267 101903 3881285 2043850 194496 31290 2146601 1173113 "(-)-7-epi--9,10-dihydrojasmonic acid" 1 424222 10636 1 1 1 11893 31999 16137 165939 1 1 1 24337 27571 37290 22559 239720 33971 1 TG(12:0/12:0/19:0)[iso3] 1 1 1 1 1 1 288226 79571 1 1 390876 1 1 1 818921 180598 1 1 1147190 27548 Galbeta-Cer(d18:1/18:0) 1 1 1 1 1 1 1 1 1 1 1 132273 1 1 1 125045 1 1 112763 96884 3E-Hexene-2-one 1 1 2.80E+07 1 1 1 1254591 4.50E+07 1 1 391059 1 1 1 1.04E+07 1 1 1 7.37E+07 229133 3-oxoglycyrrhetinic acid 1 1 421769 147330 1 1 275998 1 1 1 1 1 1 1 1 35047 1 1 1 1 PS(15:0/22:0) 1 1 1 1 1 1 1101248 1449407 1 1 2550651 2087620 1 1 2804535 2661228 1502159 1397132 1 1 2'-Hydroxy-4'-methoxy-3-phenylpropiophenone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "GlcCer(d15:2(4E,6E)/20:0(2OH))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ginkgolide J 1 1 1 1 1 1 53479 85791 1 1 383070 389830 1 1 93469 102080 1 1 1 1 (-)-Jolkinol A 80493 1 1 1 1 55537 1 1 1 40380 1 1 1 78445 1 1 1 1 1 87691 SM(d18:2/15:0) 744918 3358035 1 127694 6796633 7394615 3371571 259431 149088 49452 1 1706706 1346378 42260 3369953 1 1 881893 923619 1 "(4OH,8Z,t18:1) sphingosine" 1 380303 1 1 1 10548 1 41390 31020 159385 1 1 141018 76923 40580 46450 1 139662 30489 1 GlcCer(d15:1/22:0) 1 1 1 1 1 1 719697 1 1 1 1 328503 1 1 2163850 1342304 1 1 2256171 1413866 "(6RS)-22-oxo-23,24,25,26,27-pentanorvitamin D3 6,19-sulfur dioxide adduct / (6RS)-22-oxo-23,24,25,26,27-pentanorcholecalciferol 6,19-sulfurdioxide adduct" 1 1 1 90218 1 1 1 1 1 101467 1 1 1 1 1 1 184298 177567 1 1 "5,7-Dimethoxy-8-prenylflavan" 1 1 1 1 1 1 1 1 23057 1 1 58203 36185 1 1 1 1 1 1 1 "PS(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 662465 252179 1 1 1 1 1 1 1 1 "PC(10:2(2E,4E)/10:2(2E,4E))[S]" 500845 495220 1 1 898969 903358 1 1 1 1 538247 471285 428579 441378 700204 479865 772278 1 1 1 PC(0:0/5:0)[U] 1 1 1 1 1 1 1 1 1 1 85745 1 1 1 1 39672 1 1 1 1 "3Z,6Z,9Z,12Z,15Z-Tricosapentaene" 1 1 177430 147759 1 1 180325 277458 1 1 1 1 1 1 356522 401110 1 1 218638 285359 "PS(O-16:0/18:2(9Z,12Z))" 150392 247573 398883 436203 226903 227069 504636 725504 238521 234991 1 1 478564 246500 24805 11141 1 1 1 123071 "PS(17:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 72515 93115 1 1 1 1 1 1 221105 200667 1 1 1 1 3-O-(beta-D-glucopyranosyl-(1-6)-beta-D-glucopyranosyl) ethyl 3-hydroxyoctanoate 92106 84378 1 1 73526 1 62152 34327 59229 63416 314290 182541 77134 53059 54071 50050 144237 124427 254705 229968 PS(13:0/20:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 181079 16:0-Glc-Campesterol 1 1 1 1 18550 1 1 111719 1 1 1634086 50384 1 1 1272545 254350 350523 278112 938167 1 (±)-2-Methylbutyric acid 4.13E+07 7.19E+07 1.35E+07 822701 6.77E+07 5.28E+07 1 1 3.76E+07 6.27E+07 3.88E+07 7129721 6.49E+07 5.85E+07 7.08E+07 2.89E+07 6.75E+07 6.26E+07 3960423 1.29E+07 "PG(17:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 181828 229189 1 1 498233 414777 1 1 568685 507292 1 1 1 1 "PG(O-20:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 12287 12673 1 1 3344287 1 1 1 1 1 "PG(O-16:0/20:2(11Z,14Z))" 1.48E+07 2.66E+07 262113 198930 5543724 2.39E+07 8778375 1 2.20E+07 4633174 9794381 2311598 7108727 2.16E+07 5447926 303598 9992475 8527636 7568434 2328301 PG(P-16:0/15:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 955115 1 1 442503 327701 1 1 1 1 PS(14:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 267455 209647 1 1 1 1 Cucurbitacin J 1 1 1 1 1 538038 1 1 1 1 1 1 1 1 910835 449929 1 1 1 1 GlcCer(d18:0/20:0) 1 1 335658 530379 1 1 13400 1 1 1 32253 1 1 1 62255 1 1 1 1 1 N-stearoyl phenylalanine 95859 1 1 1 1 1 161464 234552 1 1 1 1 85592 1 317865 1 1 1 1 1 PA(17:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1864269 1 1 1 1 1 "11-Eicosenoic acid, 14-hydroxy-, [R-(E)]-" 380764 480395 1 1 113690 59029 1 1 454521 47824 1 1 404882 27471 27450 1 56932 392331 58569 1 Dehydroergosterol 1 1 1 105841 72237 1 1 1 1 1 1 443998 84772 75786 289554 351515 166070 197134 1 1 1-hexadecanyl-2-((2'-alpha-glucosyl)-beta-glucosyl)-3-beta-xylosyl-sn-glycerol 1 1 1 1 1 1 1 1 1 1 906696 599187 1 1 558179 583637 1 1 756512 387826 1-tetradecanoyl-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2069251 1 1 1 1 1 PS(17:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18669 1 1 1 1 1 3'-O-methylbatatasin III 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18193 1 1 1 1 1 "TG(12:0/13:0/18:4(6Z,9Z,12Z,15Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 46839 1 1 1 1 1 PS(O-18:0/13:0) 1 1 1 1 1 1 1 1 1 1 1 708906 1 1 559848 435903 1 1 434783 1 "(20S,22E)-3beta-Hydroxychola-5,16,22-trien-24-oic Acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 120764 1 87287 1 1 132329 PS(16:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 287531 1 1 1 1 1 "3Z,6Z,9Z,12Z,15Z-Pentacosapentaene" 1 1 20361 22002 1 1 1 48159 1 1 1 1 1 1 63268 73430 1 1 57765 66585 1-(10E-Undecenyl)-2-acetyl-sn-glycero-3-phosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17862 1 1 1 1 1 1-Methoxyphaseollidin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 70670 1 1 1 1 1 PG(17:0/22:1(11Z)) 1 1 1 1 1 17910 23777 1 1 1 112131 1 1 1 108000 80423 1 1 1 1 "12beta-hydroxy-24-norcholesta-1,4,22E-trien-3-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17497 1 1 1 1 1 "6E,8E,14Z-Hexadecatriene-10,12-diynoic acid" 1 1 60783 29214 1 1 79537 75425 1 1 283080 33043 1 1 232621 152722 28126 1 758466 95957 SQDG(16:0/16:0) 433782 444674 1128282 1179019 713002 640531 1520410 1962176 681533 625142 2914979 2478238 421949 1 3528497 3346650 1 1 1 1 N-oleoyl glutamine 1 1 1 1 1 1 1 1 1 1 236901 1 1 1 15466 1 1 1 1 106091 SM(d18:2/24:1) 1 1 1 1 1 1 1 1 1 1 180734 133976 1 1 164441 130154 1 1 1 1 "TG(12:0/13:0/20:3(8Z,11Z,14Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 33109 1 1 18710 115483 1 1 1 294370 "PA(13:0/20:3(8Z,11Z,14Z))" 1 1 101011 1 1 1 1 1 1 1 1 1 1 1 367057 1 1 84414 80585 1 2-keto-n-caprylic acid 1 1 1 66244 1 1 61902 1 1 1 1 1 1 1 71766 1 1 1 1 1 "TG(18:4(6Z,9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 35709 1 1 41678 1 1 1 1 1 LTB4-d4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 20612 1 1 1 1 1 2-Keto valeric acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 40994 1 1 1 1 1 "(22E)-1?,25-dihydroxy-26,27-dimethyl-22,23-didehydrovitamin D3 / (22E)-1?,25-dihydroxy-26,27-dimethyl-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 50714 1 1 1 26323 23099 1 1 1 1 "PS(O-16:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 30547 1 1 1 1 1 LysoPC(18:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 182493 1 1 1 1 1 PI(O-16:0/0:0) 344150 425711 1 1 858069 851864 1 1 526807 514072 530673 456374 390036 393617 693333 478807 1 1 1 1 Afzelechin 4'-O-beta-D-glucopyranosdie 1 1 1 1 1 1 1 1 1 1 1 1 1 1 360630 1 1 1 1 1 "1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-3-(8-(2E,4Z-decadienoyloxy)-5,6-octadienoyl)-sn-glycerol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 51736 1 1 1 1 1 PS(O-16:0/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 581726 1 1 1 1 1 "1?,25-dihydroxy-3-deoxy-19-norvitamin D3 / 1?,25-dihydroxy-3-deoxy-19-norcholecalciferol" 1 1 1 69181 1 1 1 113922 1 1 1 1 1 1 130410 1 1 1 1 1 PC(O-18:1(9E)/O-18:1(9E))[U] 1 1 1 1 1 1 1 1 1 1 1 32386 1 1 424411 214282 1 1 64049 238819 (-)-7-Fernen-3alpha-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 66404 1 1 1 1 1 PG(12:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1188030 1 CPA(16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 142705 1 318010 1 "26,26,26,27,27,27-hexafluoro-25-hydroxy-16,17,23,23,24,24-hexadehydrovitamin D3 / 26,26,26,27,27,27-hexafluoro-25-hydroxy-16,17,23,23,24,24-hexadehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 51057 1 "PA(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 90370 1 "GlcCer(d15:2(4E,6E)/22:0(2OH))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 707697 650001 1016155 1 "11beta,12beta-Dihydroxy-5beta-cholan-24-oic Acid" 1 1 1 1 1 1 1 1 1 1 1 331033 1 1 1 1 1 1 248649 272143 "24R-methylcholest-22E-en-3beta,4beta,5alpha,6alpha,8beta,14alpha,15alpha,25R,26-nonol" 634818 752913 1 1 1 573906 1 198229 1 525161 1286613 787319 1 572612 1 1 1 1 2002669 1343070 PS(O-16:0/16:0) 1 1 1 1 1 1 1 404455 1 1 188938 1 1 1 1 5320846 1 1 338602 1 "PS(20:2(11Z,14Z)/0:0)" 70030 185232 1 1 1 1 1 1 1 88562 166197 1 1 112133 1 1 1 1 81197 1 LTB4 ethanol amide 1 1 1 1 1 1 1 38164 1 1 1 1 1 1 1 1 1 1 35322 1 PS(O-20:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 29321 1 PA(17:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 97477 1 PA(P-16:0/16:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 123146 262143 232993 "PA(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 543686 1 PG(P-16:0/16:1(9Z)) 1 1 1 1 1 1 1 746369 1 1 650416 1686066 1 1 1 1 1 1 5646106 444936 PI(O-16:0/19:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 45522 1 PI-Cer(d18:0/20:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 42550 1 "1,1,2,3-tetramethylcyclohexane" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14169 1 19-Oxo-9-cis-retinoic acid 119582 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 55852 1 PG(12:0/20:1(11Z)) 1.57E+07 1.60E+07 30262 1 4101802 1 29721 1 1 1 1 1 1.40E+07 2656031 1 1432654 1 1 910843 1 "PA(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13173 1 SM(d16:1/23:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 41954 1 15-dehydro-A-norcholestanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 112100 1 Succinic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13845 1 Fluoxymesterone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 23847 1 6-C-Glucopyranosylcatechin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2523379 PI(P-16:0/15:1(9Z)) 1 1 1 1 1 1 1 1 1 1 4617263 3796701 1 1 1 4780914 1 1 1 4224637 "PA(15:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 75163 1?-hydroxy-24-methylvitamin D2 / 1?-hydroxy-24-methylergocalciferol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 154564 "38:4(23Z,26Z,29Z,32Z)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 44435 5-Oxo-ETE-d7 1 1 1 1 1 1 1 1 1 13699 1 1 1 1 1 1 1 1 1 21827 "16-Glutaryloxy-1?,25-dihydroxyvitamin D3" 220072 227948 1 1 1 172206 1 1 1 1 1 1 1 1 1 1 1 1 1 141828 Capsaicin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12924 1 1 1 19651 8-Epiiridodial glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 195017 Myrtucommulone A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 79803 "4,4'-Diapophytofluene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 201782 DG(12:0/20:0/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18318 "(5Z,9E,14Z)-icosa-5,9,14-trienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 62982 GlcAbeta-Cer(d18:1/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 76952 1 1 85900 1 1 1 129422 "PA(12:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 198565 "PI(P-20:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 182961 "15-Octadecene-9,11,13-triynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 170743 "PG(O-18:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 9732732 1 1 687986 1 1 1 1 1 4091856 "PC(13:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2506690 PS(12:0/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3837856 "(25R)-5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 137740 "PA(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 252381 247763 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Prenyldihydropinosylvin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(6-[5]-ladderane-hexanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(12:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-arachidonoyl glycerol-d5 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(15:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (Z)-3-Hexenyl hexadecanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPC(20:3(5Z,8Z,11Z))" 220072 227948 1 1 1 172206 1 1 1 165553 1 1 1 1 1 1 1 1 1 1 Gibberellin A8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(12:0/15:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Octylglycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(20:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 4521929 1 1 1 1 1476161 1 1 1007713 3702219 1 1 1 1 1 1 1 1 PS(O-16:0/19:1(9Z)) 1174943 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(O-20:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,7-Dihydroxy-3',4'-dimethoxy-5'-prenylflavanone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(15:1(9Z)/22:2(13Z,16Z))" 23916 1 1 1 1 1 1 1 1 1 1 50168 1 1 1 46153 1 1 1 1 "4,4'-dihydroxy-3,5-dimethoxydihydrostilbene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 37588 1 1 1 1 "PE(O-18:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 499344 459015 1 1 381130 1 1571157 873381 769081 1 1 PC(12:0/20:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 523682 1 1 1 449966 1 1 1 1 (+)-Scalarin 30282 1 1 1 29572 1 1 1 1 1 1 1 1 1 1 114736 1 1 1 1 "9-hydroxy-hexadecan-1,16-dioic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 115419 1 1 1 1 PA(22:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 106135 1 1 1 1 PG(13:0/20:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 273254 1 1 1 1 3-oxo-5S-amino-hexanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 54753 1 1 1 1 "2,4-Decadiynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13909 1 1 1 1 Neurosporaxanthin ?-D-glucopyranoside 1 1 1 1 1 1 104211 1 1 1 1 1 1 1 1 250956 1 1 1 1 Undecanedioic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 66363 1 1 1 1 "PI(15:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 786054 763772 1 1 "PE(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GlcCer(d14:1(4E)/24:1(15Z)(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(3S-hydroxy-butanoyl)-homoserine lactone 53801 86529 1 1 172173 169035 1 1 63615 61513 1 1 63070 42777 1 1 183112 220999 1 1 DG(21:0/22:1(13Z)/0:0)[iso2] 10568 386959 1 1 15668 40633 1 1 145884 111914 1 1 980380 15867 1 1 182749 10266 1 1 "PC(16:1(7Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1357877 721994 1 1 1829909 635880 1 1 1339965 1611703 1 1 963531 1013371 1 1 1421191 905583 1 1 LysoPC(24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(22:2(13Z,16Z)/0:0)" 1173065 1 1 1 489369 1 1 1 1226311 1 1 1 1 1 1 1 1 1 1 1 22:3 Stigmasteryl ester 1 15130 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(18:4(6Z,9Z,12Z,15Z)/P-18:1(11Z))" 4133384 1 1 1 1 1 1 1 1 1.30E+07 1 1 1 1.27E+07 1 1 8243171 1 1 1 dolichyl D-xylosyl phosphates 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/15:1(9Z)) 1 1 1 1 1 1 1 273553 1 1 1 1 1 1 1 1 497543 101260 1 1 "PA(O-16:0/22:2(13Z,16Z))" 1 343669 1 1 219992 1 1 1 363821 215369 1 1 432867 535141 1 1 1 1 1 1 PG(13:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(O-18:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(16:1(9Z)/P-18:1(11Z)) 3653918 1.31E+07 1 1 1 1.44E+07 1 1 1 1.37E+07 1 1 1 1.22E+07 1 1 6716975 9039031 1 1 "(25S)-5alpha-cholestan-3beta,6beta,15alpha,16beta,26-pentol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/16:1(9Z)) 1 30258 1 1 18075 1 1 1 1 1 1 1 13603 1 1 1 1 1 1 1 PI(O-18:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 5512109 1 1 1 1 1 1 1076744 1 1 "C25:2 6,7-Epoxy highly branched isoprenoid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-dihexadecanoyl-sn-glycero-3-phosphosulfocholine" 1 29483 1 1 1 1 1 1 1 1 1 219232 1 45292 1 1 144715 1 1 1 PA(13:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-trans-LTC4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(24:1(15Z)/P-18:1(11Z)) 1 1 1 20317 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/20:1(11Z)) 1 1 1 1 1 1 1 1 1 184072 1 1 1 1 1 1 1 1 1 1 "PA(13:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 193794 1 1 1 PI-Cer(d20:0/26:0) 1 1 1 1 1 1 1 1 1 1 133532 1 1 1 1 1 1 1 1 1 "PA(20:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1466933 1 1 1 1 1 1 1 1 1 PG(18:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 210494 1 1 1 1 1 1 1 1 1 PC(O-18:0/13:0) 757403 737586 1 1 673043 734084 1 1 803823 545458 1449905 1310272 728740 771922 1 1 1 1 1 1 "CL(1'-[14:1(9Z)/14:1(9Z)],3'-[14:1(9Z)/15:1(10Z)])[rac]" 1 1 1 1 1 1 1 1 1 1 28728 1 1 1 1 1 1 1 1 1 10-F2-dihomo-IsoP 1 1 1 1 1 1 1 1 1 1 127613 1 1 1 1 1 1 1 1 1 PG(14:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 117935 1 1 1 1 1 1 1 1 1 4-Methoxyphlorizin 1 1 1 1 1 1 1 1 1 1 14469 1 1 1 1 1 1 1 1 1 pentanamide 1 1 1 1 40729 11888 1 1 1 1 19926 1 1 1 1 1 10200 1 1 1 "PC(20:3(5Z,8Z,11Z)/P-18:1(11Z))" 1 1 1 1 1 1 1 1 1 1 69339 1 1 1 1 1 1 1 1 1 11Z-Heptacosene 1 1 1 1 1 1 1 1 1 1 25745 1 1 1 1 1 1 1 1 1 1-(8-[3]-ladderane-octanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine 1 1 1 1 1 1 1 1 1 1 73571 1 1 1 1 1 1 1 1 1 "(22S)-1?,22,25-trihydroxy-23,24-tetradehydro-24a-homo-20-epivitamin D3 / (22S)-1?,22,25-trihydroxy-23,24-tetradehydro-24a-homo-20-epicholecalciferol" 1 1 1 1 1 1 1 1 1 1 35687 1 61865 1 1 1 1 1 1 1 "PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/19:0)" 1 1 1 1 1 1 1 1 1 1 98474 1 1 1 1 1 1 1 1 1 Erucicoyl-EA 1 1 1 1 1 1 1 1 1 1 60585 1 1 1 1 1 1 1 1 1 "PE(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 87323 1 1 1 1 1 1 1 1 1 16:3-Glc-Campesterol 1 1 1 1 1 1 1 1 1 1 69339 1 1 1 1 1 1 1 1 1 "2,4-dihydroxy-butanoic acid" 1 1 1 1 1 1 1 1 1 1 1992057 1507877 1 1 1 1 1 1 1 1 "PG(17:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 73571 1 1 1 1 1 1 1 1 1 "PG(20:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 84420 1 1 1 1 1 1 1 1 1 10E-Tridecen-2S-ol 1 1 1 1 1 1 1 1 1 1 420547 1 1 1 1 1 1 1 1 1 "14-methyl-20,14-retro-retinoic acid" 1 1 1 1 1 1 1 1 1 1 97204 1 1 1 1 1 1 1 1 1 ajugalactone 1 1 1 1 68994 1 1 1 1 1 188539 1 1 1 1 1 1 1 1 1 "PE(20:3(5Z,8Z,11Z)/P-18:1(11Z))" 1 1 1 1 1 1 1 1 1 1 165464 1 1 1 1 1 1 1 1 1 "2,4,7-tridecatrienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 42968 52095 1 1 PA(16:0/22:1(11Z)) 1 1 1 1 1 37647 1 1 1 1 1 1 1 1 1 1 265433 1 1 1 Antiarone J 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 23174 1 1 1 Demissidine 1 1 1 1 1 1 1 1 1 21586 1 1 1 1 1 1 50207 1 1 1 "DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 194891 1 1 1 "3R,7R-Dimethyltridecan-2S-ol" 1 1 1 1 1 1 1 1 1 1 1 39155 1 1 1 1 18814 1 1 1 N-stearoyl serine 1 1 108147 1 1 1 87651 1 1 1 1 1 1 1 1 1 141539 1 1 1 Calicogorgin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 36618 1 1 1 PC(O-12:0/O-1:0)[U] 132050 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 104831 1 1 1 PC(O-18:1(9Z)/O-1:0) 34116 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Mannosyl-1beta-phosphomycoketide C33 859762 71423 1 1 1 3511339 1 1 4305614 1 1 1 10856 1 1 1 1 1 1 1 PS(19:1(9Z)/0:0) 206177 1 1 1 1 1 1 1 1 1 1 1 253815 339914 1 1 1 1 1 1 PS(19:0/22:1(11Z)) 47941 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-16:0/19:0) 809173 834907 1 1 569087 533573 1 1 626193 552378 1 1 662894 576161 1 1 1 1 1 1 "PS(14:0/20:5(5Z,8Z,11Z,14Z,17Z))" 223792 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE-Cer(d14:1(4E)/23:0) 7883442 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/15:0) 10337 1 1 1 1 1 1 1 1 1 1 53195 1 1 1 1 1 1 1 1 (R)-b-amino-isobutyric acid 31380 1 1 1 1 1 1 1 1 46152 1 1 1 1 1 1 1 1 1 1 PI(17:0/22:0) 40750 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 KDNalpha2-3Galbeta1-4Glcbeta-Cer(d18:1/22:0) 48451 46400 1 1 47335 51577 1 1 76907 72928 1 1 102572 79045 1 1 1 1 1 1 PI(19:1(9Z)/0:0) 31299 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Verazine 22522 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPE(0:0/22:2(13Z,16Z))" 89035 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl tyrosine 42751 45537 1 1 29109 1 65936 1 1 1 1 1 1 1 1 1 1 1 1 1 Pyruvate 22161 1 1 1 23240 1 1 1 1 36669 1 1 21363 1 1 1 1 1 1 1 "LysoPE(0:0/22:5(4Z,7Z,10Z,13Z,16Z))" 178148 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Crotonic acid 21585 17722 1 1 1 1 1 1 1 25805 1 1 1 1 1 1 1 1 1 1 Butyl 4'-O-butanoyl-6-O-hexadecanoyl-neohesperidoside 20097 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(6-[5]-ladderane-hexanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine 23916 68996 1 1 1 27214 1 1 1 1 1 1 52365 1 1 1 1 1 1 1 "PG(P-18:0/17:2(9Z,12Z))" 366572 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ins-1-P-Cer(d18:1/22:0) 43577 1 1 1 30366 11589 1 1 1 1 1 1 402042 27614 1 1 1 1 1 1 "PC(19:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 23470 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20R)-17,20-dihydroxypregn-4-en-3-one" 34471 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(12:0/16:0) 515228 1 1 1 81925 1 1 1 133755 1 1 1 1 1 1 1 1 1 1 1 "3Z,6Z,9Z-Docosatriene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 23570 1 1 "PG(15:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 284671 1 1 "PA(P-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 4337755 1 1 1.39E+07 1 1 1 1 1 1 1 1 1 1 1 1 9145117 1 1 "PS(13:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 151647 1 1 Lespedezaflavanone F 1 1 1 1 118748 1 1 1 1 1 1 297899 1 1 1 1 1 414260 1 1 "8Z-Decene-4,6-diynoic acid" 1 1 1 1 1 1 1 20365 1 1 1 1 1 1 1 1 1 16894 1 1 "PA(O-16:0/18:3(6Z,9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13698 1 1 PG(12:0/20:0) 1 1 1 1 1 1 36675 1 1 1 1 1 1 30644 1 1 1 2633303 1 1 "MGDG(20:5(5Z,8Z,11Z,14Z,17Z)/16:3(7Z,10Z,13Z))" 1 1 1 1 334175 309694 1 1 338010 331003 1 1 238830 1 1 1 1 804602 1 1 2-dehydroecdysone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 146431 1 1 Vomitoxin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 123910 1 1 1-O-Hexadecyl-2-O-docosahexenoyl-sn-glycero-3-phosphorylcholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 30589 1 1 "PC(16:0/22:6(3Z,6Z,9Z,12Z,15Z,18))[U]" 1 14864 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15882 1 1 Cer(d18:1/17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6-Nitrochrysene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Vanilloloside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acetylcorynoline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glu Glu Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Oleoyl Lysophosphatidic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Solanocapsine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-tetradecanoyl-L-Homoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Penbutolol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Arachidonoyl-L-Alanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tetradecyl Phosphonate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "16alpha,17beta-Dihydroxyandrost-4-en-3-one dipropionate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lankamycin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11beta,16alpha,17alpha,21-Tetrahydroxy-9alpha-fluoropregn-4-ene-3,20-dione 16,17-acetonide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Gln Thr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 U-73122 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC-M6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(23S)-26,26,26,27,27,27-hexafluoro-1?,23,25-trihydroxyvitamin D3 / (23S)-26,26,26,27,27,27-hexafluoro-1?,23,25-trihydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 9-Octadecenoic acid 1-[[(1-oxohexadecyl)oxy]methyl]-2-(phosphonoxy)ethyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cyanidin 3-[6-(4-glucosylcoumaryl)sophoroside] 5-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pinidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Etidocaine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Correolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 20-Deoxynarasin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,5-Didecanoylpyridine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,6 dimethylheptanoyl carnitine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Asn Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 p-Hydroxynorpropoxyphene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ticlopidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hericenone G 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9-Fluoro-11beta-hydroxy-16alpha-methylandrosta-1,4-diene-3,17-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3beta,4-Dimethyl-4-aza-5alpha-cholestane" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-(3-Methylbutyl)-1H-pyrrolo[2,3-b]pyridine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Palmitoyl-2-linoleoyl PE 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PGDM-d4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (13S)-13-Dihydrodaunorubicin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(2-fluro-ethyl) arachidonoyl amine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Asn 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 AM1172 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(O-18:0/19:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Amino-3-(4-hydroxyphenyl)propanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25-Hydroxy-24-epi-brassinolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(12:0/17:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CAY10470 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Hydroxymugineic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(13:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1012222 1 1 1 1 1 1 1 1 "11,12-DiHETrE-EA" 1 1 1 1 1 1 1 1 1 1 1 53944 1 1 1 1 1 1 1 1 "22:3(5Z,9Z,19Z)(13Me,17Me,21Me)" 1 1 1 1 1 1 1 1 1 1 1 257112 1 1 1 1 1 1 1 1 "(5S,6R)-beta-carotene 5,6-epoxide" 1 1 1 1 1 1 1 1 1 1 1 120063 1 1 1 1 1 1 1 1 "9,10-Epoxy-3Z,6Z-tricosadiene" 1 1 1 1 1 1 1 1 1 1 1 37247 1 1 1 1 1 1 1 1 PG(22:1(11Z)/21:0) 1 1 1 1 1 1 1 1 1 1 1 40759 1 1 1 1 1 1 1 1 "PC(22:5(4Z,7Z,10Z,13Z,16Z)/P-18:1(11Z))" 1 1 1 1 1 17910 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(6RS)-22-hydroxy-23,24,25,26,27-pentanorvitamin D3 6,19-sulfur dioxide adduct / (6RS)-22-hydroxy-23,24,25,26,27-pentanorcholecalciferol 6,19-sulfurdioxide adduct" 1 1 1 1 1 41805 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galbeta-Cer(d18:1/16:0) 1 1 1 1 1 421620 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-18:0/22:1(11Z)) 1 1 1 1 1 40898 1 1 1 1 1 1 1 32586 1 1 1 1 1 1 "PS(O-20:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 19732 1 1 1 1 1 1 1 12524 1 1 1 1 1 1 11-keto pentadecanoic acid 1 1 1 1 1 34196 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(P-16:0/0:0) 1 1 1 1 554927 544374 1 1 334682 307968 1 1 288125 1 1 1 1 1 1 1 dolichyl phosphate 1 1 1 1 1 63021 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tautomycetin 1 1 1 1 1 53259 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl threonine 1 1 1 1 1 26970 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(23:0/26:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-deoxyecdysone 22-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fucalpha1-2Galalpha1-3Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Eicosapentaenoyl Serotonin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Linolenyl behenate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(16:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3beta,22E)-26,27-Dinorergosta-5,22-dien-3-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 a-[1-(diethylamino)ethyl]-p-hydroxy-Benzyl alcohol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lys Phe Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2'-Apo-beta-carotenal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avenacin B-2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(18:1(9Z)/0:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Austalide G 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(25R)-5alpha,6alpha-epoxy-24R,26R-dimethyl-26,27-cyclo-cholestan-3beta-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22E, 24x)-Ergosta-4,6,8,22-tetraen-3-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cytochalasin Opho 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TyrMe-Asp-OH 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4,6-trimethyl-2,15-tetracosadienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 FMNH 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-methyl-9-(phenoxycarbonyl) Acridinium fluorosulfonate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Methyl (7Z,9Z,9'Z)-6'-apo-y-caroten-6'-oate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pendimethalin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(13:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Ser Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-Pyrrolidinepropanol, a-(4-hydroxycyclohexyl)-a-phenyl-, trans- glucuronide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(3-Oxododecanoyl)homoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(12:0/20:2(11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gymnodimine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Etioporphyrin III 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galalpha1-3(GalNAcbeta1-4)Galbeta1-4Glcbeta-Cer(d18:1/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PIP(16:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Kanamycin A 3'-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Chlorophyll a 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Kifunensine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)-Mevalonolactone 1 1 36676 1 1 1 30609 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(P-18:0/0:0) 1 1 1 1 1 1 25211 1 1 1 1 1 1 1 1 1 1 1 1 1 2-chloro-palmitic acid 1 1 1 1 1 1 22796 1 1 1 1 1 1 1 1 1 1 1 1 1 28:7(n-6) 1 1 71701 1 1 1 102503 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(O-16:0/15:1(9Z)) 1 1 1 1 1 1 15864 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,8,11-Dodecatriynoic acid" 1 1 1 1 1 1 1 16194 1 1 1 1 1 1 1 1 1 1 1 1 "PS(O-18:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1276534 1 1 1 1 1 1 1 1 1 1 1 1 "12,13-Dimethyl-5,14-dioxabicyclo[9.2.1]-tetradeca-1(13),11-dien-4-one" 1 1 1 1 1 1 1 111628 1 1 1 1 1 1 1 1 1 1 1 1 "PS(14:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 583675 1 1 1 1 1 1 1 1 1 1 1 1 "(16,16-dimethyldocosa-cis-5,8,11,14-tetraenoyl)propylamine" 1 1 1 1 1 1 1 1883596 1 1 1 1 1 1 1 1 1 1 1 1 "PE-Cer(d14:2(4E,6E)/23:0)" 1 1 1 1 1 1 1 274771 1 1 1 1 1 1 1 1 1 1 1 1 "2-tridecene-4,7-diynal" 1 1 1 1 1 1 1 37686 1 1 1 1 1 1 1 1 1 1 1 1 PG(19:0/0:0) 1 1 1 1 1 1 1 1 1 187857 1 1 1 1 1 1 1 1 1 1 "PS(19:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 43405 1 1 1 1 1 1 1 1 1 1 5beta-scymnol sulfate 1 1 1 1 1 1 1 1 1 31253 1 1 1 1 1 1 1 1 1 1 10-methyl-1-dodecanol 1 1 1 1 1 1 1 1 14053 13328 1 1 1 1 1 1 1 1 1 1 "PG(15:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 317089 1 1 1 1 1 1 1 1 1 1 "PS(15:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 328147 1 1 1 1 1 1 1 1 1 1 PA(18:0/22:0) 1 1014122 1 1 1 1 1 1 1 670065 1 1 1 769275 1 1 1 1 1 1 Anhydroeschscholtzxanthin 1 1 1 1 49307 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Neolinderatone 1 1 1 1 607817 1 1 1 1 1 1 1 569826 1 1 1 1 1 1 1 15(R)-15-methyl PGF2? 1 1 1 1 581473 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,7,10,13,16,19-Docosahexaynoic acid" 1 1 1 1 32483 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-18:0/22:1(11Z)) 1 1 1 1 69981 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(25R)-1beta,3alpha,7alpha-trihydroxy-5beta-cholestan-26-oic acid" 1 30697 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15-HETE-GABA 1 49628 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPE(0:0/20:4(5Z,8Z,11Z,14Z))" 1 437555 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-hydroxy-11-dodecenoic acid 1 20361 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(17:0/22:4(7Z,10Z,13Z,16Z))" 1 58483 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(13:0/20:4(5Z,8Z,11Z,14Z))" 1 83867 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22R)-3alpha,7alpha,22-Trihydroxy-5beta-cholan-24-oic Acid" 1 1 1 1 1 1 1 1 1 1 1 1 54035 1 1 1 1 1 1 1 PC(4:0/4:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fuc?1-2Gal?1-4Glc?-Sp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pro Pro Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4,6-Trimethylacetophenone imine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gly Lys Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "8-Prenylquercetin 7,4'-dimethyl ether 3-rhamnosyl-(1-4)-rhamnoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Alpinumisoflavone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/16:0/22:0)[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Jasmolone glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "26,26,26,27,27,27-hexafluoro-25-hydroxyvitamin D3 / 26,26,26,27,27,27-hexafluoro-25-hydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Italidipyrone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Hexadecyl-L-hydroxyproline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-((3-Cholamidopropyl)dimethylammonium)-1-propanesulfonate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "17,20-dimethyl Prostaglandin F1?" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(P-20:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3'-Hydroxy-T2-triol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avermectin A2a aglycone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(12:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1(3)-glyceryl-PGF2? 1 1 1 1 1 1 1 1 1 1 1 1 1 30579 1 1 1 1 1 1 PC(18:1(9E)/2:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 45046 1 1 1 1 1 1 DG(19:0/22:1(13Z)/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 46158 1 1 1 1 1 1 PE(O-16:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 141031 1 1 1 1 1 1 Fucalpha1-2Galalpha1-3Galbeta1-4Glcbeta-Cer(d18:1/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 29338 1 1 1 1 1 1 "10,12-Tetradecadiene-4,6-diynoic acid, (E,E)-" 1 1 1 1 1 1 1 1 68039 1 1 1 1 1 1 1 1 1 1 1 C20-OHSulfatide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(O-16:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3S,6R)-9,10-seco-5(10),6,7-cholestatrien-3-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Jervine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cyproheptadine glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4'-Methoxy-alpha-pyrrolidinopropiophenone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cryptophorine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Histrionicotoxin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-[Octahydro-4,7-dimethyl-1-oxocyclopenta[c]pyran-3-yl]nepetalactam" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Furmecyclox 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dalfopristin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12alpha-Hydroxy-3-oxo-5beta-chol-9(11)-en-24-oic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 XLR11 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (5-D-ribonyl)hopane 1 1 43138 19422 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(18:4(6Z,9Z,12Z,15Z)/P-18:1(11Z))" 1 1 373379 407008 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 20-trifluoro-LTB4 1 1 14066 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11?-(4-dimethylaminophenyl)-1?,25-dihydroxyvitamin D3 / 11?-(4-dimethylaminophenyl)-1?,25-dihydroxycholecalciferol" 1 1 25846 30017 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 70778 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(24:1(15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 34704 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DAT(19:0/24:0(2Me[S],4Me[S]))" 1 1 1 1 1 1 1 1 1 1 330489 223868 1 1 138793 96204 421308 117087 497704 1 (R)-2-methoxyhexadecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 54800 1 1 1 217602 256754 PA(O-16:0/17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 420414 434875 1 (2-Hydroxymethyl-cyclohexyl)-acetic acid lactone 25758 1 1 1 111154 1 1 1 1 1 1 1 11376 16095 1 1 1 1 6213 1 "5-Hydroxy-7,4'-dimethoxy-4-phenylcoumarin 5-O-galactoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18927 1 "26,26,26-trifluoro-25-hydroxyvitamin D3 / 26,26,26-trifluoro-25-hydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12411 20594 12396 22757 17-tetracosenal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21494 1 30153 20906 "2-Geranyl-3,4,2',4'-tetrahydroxydihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5852 1 2-deoxyecdysone 22-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 30905 1 "(5E)-(24R)-24,25-dihydroxy-[6,19,19-trideutrio]vitamin D3 / (5E)-(24R)-24,25-dihydroxy-[6,19,19-trideutrio]cholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 245144 1 DG(16:1(9Z)/0:0/16:1(9Z)) (d5) 1 33047 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1085016 1136819 935348 970123 "2?-(3-Hydroxypropyl)-1?,25-dihydroxy-19-norvitamin D3" 1 1 37686 64511 1 1 1 1 1 1 1 55095 1 1 1 1 72277 376746 58975 1078116 PG(O-20:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 46662 179022 1 1-(8-[5]-ladderane-octanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 382323 420414 440902 1 "(25S)-5alpha-cholestan-3beta,4beta,6alpha,8beta,15alpha,16beta,26-heptol" 1 1 753947 830266 1 577961 657306 423140 1 1 353691 340315 1 1 473374 401503 657202 789945 797007 869306 10-[5]-ladderane-decanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 28283 1 10-Nonadecen-2-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 36136 38841 35083 60090 Linoleoyl Ethanolamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5798 1 Stearamide 1 1 1 1 1 1 1 1 1 1 1 10979 1 1 1 1 12668 7579 5734 6062 24-hydroxy-10Z-tetracosenoic acid 78503 77897 135444 176194 41524 1 87884 80300 1 34503 148835 166624 47035 1 157930 189404 254506 469182 390042 325692 "(23S,25R)-1?,23,25,26-tetrahydroxyvitamin D3 / (23S,25R)-1?,23,25,26-tetrahydroxycholecalciferol" 1 101887 179012 253528 1 1 1 206795 1 64791 281321 308370 84805 1 228663 1 1 88333 43510 60265 12-amino-dodecanoic acid 23617 1 116066 107574 1 1 87636 75012 1 1 143289 126820 1 31124 125518 132351 187868 206577 151599 164793 Artoindonesianin B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 69825 1 1 125711 152759 1 "TG(12:0/19:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 90785 1 "TG(12:0/18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 71048 1 "5,2',4',5'-Tetrahydroxy-3-(3-hydroxy-3-methylbutyl)-6'',6''-dimethylpyrano[2'',3'':7,8]flavone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 231655 237120 212467 227741 Galalpha1-3(Fucalpha1-2)Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z)) 220703 898917 626611 541397 806385 873100 495210 760394 115149 425704 1344634 940028 92173 83946 1233379 889241 1449887 1771602 1751760 2180002 "5,6-epoxy-18R-HEPE" 1 1 1 1 1 1 1 1 1 1 37016 1 19886 1 1 1 1 1 6439 1 12-HpOTrE 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15771 6614 7934 Ins-1-P-Cer(t18:0/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21854 1 "6,9,12,15,18,21-Tetracosahexaynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21422 1 "TG(12:0/18:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 4189705 4171574 2374799 1234599 2334559 2939659 59029 1 3690141 3916842 1009707 503739 3875267 1658934 1 1 131476 1 177921 1 10-oxo-docosanoic acid 235518 190628 1 1 208160 192046 290773 346070 155607 153842 466551 466690 214344 161052 399402 360618 183115 204200 152597 168013 9Z-Hexacosene 1 1 1 1 1 16651 1 1 1 1 1 1 1 1 1 11641 1 120234 48646 27952 "12,15-epoxy-13,14-dimethyleicosa-12,14-dienoic acid" 1 121483 11771 1 1 1 1 1 1 1 205861 286445 1 103877 195226 280739 40424 25925 41410 19859 "PE(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 139364 85551 48321 210300 10-HOME(8) 769256 296865 533574 42531 837249 1095581 847075 1 912250 743952 974074 252816 1088463 1244226 2413089 63786 27613 14290 17545 1 "27-Nor-5b-cholestane-3a,7a,12a,24,25-pentol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8817 1 "TG(12:0/19:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 240074 1 "DAT(16:0/24:0(2Me[S],3OH[S],4Me[S],6Me[S]))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 33964 56736 1 "11-Eicosenoic acid, 14-hydroxy-, [R-(E)]-" 333906 108814 1 1 191077 326504 1 16357 122532 1181549 15018 15592 909909 62737 20910 1 96297 1 61764 77024 "11E,14E-Octadecadienal" 1023862 935505 3780414 1 2786056 2674650 885608 107047 2349717 572521 3325150 179415 2656861 971823 1598149 146524 93925 27098 74676 69320 MIPC(t18:0/22:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 294533 286602 352259 297557 Ceriporic acid B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13802 17017 "Anandamide (20:5, n-3)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 410032 11800 1 DG(13:0/20:1(11Z)/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 420895 632223 283858 295036 PC(O-18:1(9Z)/O-1:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 264265 278309 254037 222516 PG(O-16:0/0:0) 1 1 335273 1 1 1 1 1 1 71894 128363 1 1 1 377733 1 1 190936 109684 30504 "DG(13:0/18:3(9Z,12Z,15Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 20461 1 47558 74632 SM(d16:0/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 92080 175437 119081 120157 "PC(15:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 28420 1 "PG(12:0/20:5(5Z,8Z,11Z,14Z,17Z))" 262326 1 1 203127 1 1 1 1 1 1 1 1 1 1 1 1 639144 647744 542465 521084 "11-hydroperoxy-12,13-epoxy-9-octadecenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14958 1 1 1 48791 1 "TG(16:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 67768 1 (+)-Hirusten-12-oic acid 31282 26678 50348 70865 22363 23198 40095 48982 1 1 70913 66520 1 1 55364 65424 1 70141 70196 91784 "26,26,26,27,27,27-hexafluoro-25-hydroxy-16,17,23,23,24,24-hexadehydrovitamin D3 / 26,26,26,27,27,27-hexafluoro-25-hydroxy-16,17,23,23,24,24-hexadehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 28070 1 1-tetradecanoyl-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 66289 1 "PA(20:3(8Z,11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18833 1 "1,2-didocosanoyl-sn-glycero-3-phosphosulfocholine" 255473 1026093 114051 1 787256 43582 419745 14664 138744 29905 17133 1 678211 34483 167459 1 44290 51695 26942 25667 TG(14:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 12397 15065 1 1 108357 55595 109155 1 PE(19:1(9Z)/0:0) 1 292036 1 127159 1 1 102382 1 1 1 1 1 1 1 110876 97530 188168 137774 211776 198455 C24:1 Sulfatide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16046 1 "Anandamide (20:l, n-9)" 306872 303993 281205 429173 280509 252386 396753 382493 191057 215186 573413 498576 277192 268182 324065 303856 410464 277517 406941 262214 3alpha-hydroxy-5alpha-androstane-17-one 3-D-glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6951 1 14-methyl-1-pentadecanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 9276 1 "(23R)-23-Hydroxy-3,7-dioxo-5beta-cholan-24-oic Acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18272 128317 194259 126891 "TG(20:2(11Z,14Z)/18:3(6Z,9Z,12Z)/20:2(11Z,14Z)) (d5)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 23489 1 33269 28279 "3,4,7-Trihydroxy-5-methoxy-8-prenylflavan 4-O-(beta-D-xylopyranosyl-(1-6)-beta-D-glucopyranoside)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 91280 107407 86894 100944 11-Methylheptacosan-2-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 45115 22187 50335 62753 10-F2-dihomo-IsoP 1 64556 118367 187701 1 1 83880 60178 32582 1 1 1 1 1 45694 42928 61538 87427 87830 110744 DG(12:0/22:1(11Z)/0:0)[iso2] 26285 168319 1 1 57378 35227 1 1 46500 1 1 1 43462 1 1 1 112981 1 92816 1 Heteroflavanone B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 132037 1 Stearoylethanolamide 1 1 1 1 1 1 1 1 1 1 1 87404 1 23224 1 1 1 1 32004 22340 "(22E)-(25R)-1?,25-dihydroxy-26-methyl-22,23-didehydrovitamin D3 / (22E)-(25R)-1?,25-dihydroxy-26-methyl-22,23-didehydrocholecalciferol" 1 1 1 108276 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10013 1 "1?,25-dihydroxy-21-nor-20-oxavitamin D3 / 1?,25-dihydroxy-21-nor-20-oxacholecalciferol" 1 1 1 1 1 1 1 1 1 1 84963 1 1 1 1 1 15618 20388 14654 19196 "PE-Cer(d14:2(4E,6E)/22:1(13Z)(2OH))" 272887 230448 1 64897 49297 1 54783 1 55511 82978 1 1 99658 45221 1 1 72965 157519 168674 37278 PG(12:0/0:0) 1 1 75889 106653 1 1 182284 1 1 1 34483 52036 1 1 1 1 119321 1 158452 155981 "(1R,2S,4R)-(+)-Bornyl acetate" 482686 1 1.37E+07 1 1 1 1.48E+07 1 1 1 1.45E+07 1 1 159112 2.57E+07 1 1 1 42644 1 "4,6-Dimethyl-2E,4E,6E-nonatriene" 13847 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8153 6857 8667 "1,4-dimethylcyclohexane" 5258569 1349095 1 112278 1666795 1299219 4805214 1 479529 942571 288876 145803 1 301807 6120193 475032 34215 18438 20504 8239 FMC-5(d18:1/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25843 52849 16746 18130 Oleamide 1904945 2252016 37114 86098 2475245 431325 95502 70951 314987 2559584 1 171830 510971 1280997 166806 140782 30781 21092 20831 39164 "PA(O-20:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 45455 1 889443 948336 1123227 1340050 (+)-3-hydroxy pelargonic acid 156102 166666 611327 651687 104380 87972 335043 302903 126631 125044 761823 774504 139502 112525 427630 492690 1 1 226352 255091 (-)-3-Carene 17712 42949 18488 1 1 10913 35260 1 1 1 50072 1 1 1 1265828 1 5950 10736 13266 7584 16-Oxolycoclavanol 906704 960281 471573 280059 1304419 1695595 442131 1 1285882 1548450 209435 202383 1991551 1792628 1 1 12451 17858 10850 22249 "1?,25-dihydroxy-26,27-dimethyl-24a,24b-dihomovitamin D3 / 1?,25-dihydroxy-26,27-dimethyl-24a,24b-dihomocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18354 17251 "PC(18:0/22:5(4E,7E,10E,13E,16E))[U]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 257201 1 1959039 421798 "3R,4S-Epoxy-6Z,9Z-nonadecadiene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 61908 1 50463 1 LacCer(d14:1/16:0) 11018 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 43318 1 PA(O-20:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5483 1 "TG(16:0/22:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 95019 58527 105954 1 1-Hepten-3-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13595 1 DG(15:0/21:0/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 78458 60809 1 1 92776 71606 153962 148126 202056 190897 "PA(O-18:0/17:2(9Z,12Z))" 1 1 1 62898 13454 1 1 1 1 1 14177 68464 1 1 1 1 316775 397832 377661 434714 "4,10-undecadiynal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 9098 9957 5190 (-)-Kanshone A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10273 1 Didrovaltratum 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6165 1 "PI(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 31293 20873 1 1 1 61899 1 1 15740 21506 1 1 1 1 1 1 1 1 311643 1 5-(1-hydroxypropan-2-yl)isolongifol-4-ene 218266 1 1 1 10313 155403 12538 1 1 1 477533 1 16439 1 1 20291 18939 12698 20395 26123 "(20S)-1?,20,25-trihydroxy-24a-homovitamin D3 / (20S)-1?,20,25-trihydroxy-24a-homocholecalciferol" 1 1 161394 64563 1 1 78075 32481 1 1 44898 39274 1 1 61313 30984 57652 41811 71321 46195 MG(16:0/0:0/0:0)[rac] 14451 1 1 1 1 1 1 1 1 21178 1 1 1 1 1 1 1 1 6767 1 PI(O-16:0/15:1(9Z)) 1 1 1 3734883 242553 1 1.02E+07 518034 1 1 7369825 5273457 1 1 1420790 5327059 1 1 618306 1 PC(O-16:0/19:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 92556 1 "PS(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 358889 1 "PE(12:0/22:2(13Z,16Z))" 1 1 283920 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1348053 1 PE-Cer(d16:1(4E)/18:0) 1 1 1 1 1 1 1 29281 1 1 1 1 1 1 28377 1 293474 367983 449922 524009 Iridotrial glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 54929 1 "3,4-Epoxy-6Z,9Z-eicosadiene" 15117 1 1 1 1 1 1 1 11675 1 1 1 1 1 1 1 28365 1 100829 93022 (Z)-11-Hexadecenyl formate 25880 38700 48856 1 1 1 1 1 1 26848 1 16664 33806 32270 27499 1 181637 212588 156941 156932 "(2S,6R,8S)-2,8-Dimethyl-1,7-dioxaspiro[5.5]undecane" 934148 815717 1084549 1146217 702320 742825 809050 791828 511001 528358 1372193 1369708 1004892 1051606 756088 773972 1827788 1832808 1347243 1376502 "PC(22:2(13Z,16Z)/0:0)" 174635 1 788554 1 1 81410 1 1 1 1 1 93940 1 1 1 1 1 1 120447 204337 2-deoxy-20-hydroxy-5alpha-ecdysone 3-acetate 1 1 714732 790438 1 1 635866 423819 1 1 373064 330762 1 1 406848 376185 665436 755170 848348 912941 Cer(d18:0/16:0) 1 1 1 1 1 1 1 1 1 1 32702 205996 1 1 1 1 1 1 4.59E+07 1 PS(16:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 36030 22865 "11-(3-acetoxy-1-propynyl)-1?,25-dihydroxy-9,11-didehydrovitamin D3 / 11-(3-acetoxy-1-propynyl)-1?,25-dihydroxy-9,11-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18686 1 Troleandomycin 1 1 347056 1 1 1 1 1 1 1 1 1 1 1 1 1 2098722 2366731 2033438 2209642 11E-Hexadecen-1-ol 1 1 1 1 1 1 1 1 1 1 1 1 10966 1 1 1 24013 129505 16223 99023 25-hydroxyvitamin D2 25-(?-glucuronide) / 25 hydroxyergocalciferol 25-(?-glucuronide) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 928674 1149308 833020 1007278 1-tetradecanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7792 1 "PC(18:2(9Z,12Z)/2:0)[U]" 1 1 1 164515 1 1 1 1 1 1 1 1 1 1 1 1 563381 121161 186097 159500 "TG(12:0/22:3(10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 51894 94069 1 11-octadecenal 1 1 472457 1 1 1 37659 1 1 11640 615443 34336 1 16882 519746 1 11151 17049 11695 27130 "1,4-cholestadienone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 466773 268926 348487 Dodecaprenyl phosphate-galacturonic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 183835 227035 "2-amino-14,16-dimethyloctadecan-3-ol" 1 1 1 1 1 1 1 1 1 1 43102 1 1 1 1 1 1 1 6053 1 podocarpic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7060 11067 10353 14855 "Anandamide (20:2, n-6)" 360333 383740 772033 62413 1 1 753379 669425 244452 1 98531 72984 1 1 67369 53716 974557 774998 1167172 886279 "1'',2''-Dihydro-2'-hydroxycycloosajin" 2039821 1966338 2462218 2940680 1627768 1739154 2852832 2748736 1786488 1728926 2272386 2509355 1 1 1827603 1989055 6046608 5546110 6659100 6050376 1-(6-[5]-ladderane-hexanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 27078 1 1 109735 89735 152311 "TG(17:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19431 68563 74414 1 PI-Cer(t18:0/16:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22638 31874 "PI(12:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14939 1 PG(12:0/17:0) 1 1 548470 489291 1 1 337095 434516 1 1 1 623917 1 1 705895 534655 1 1 68556 1 "(22E)-1alpha,3beta-Dihydroxychola-5,16,22-trien-24-oic Acid" 1 1 59046 1 1 1 1 1 1 1 1 1 1 1 1 1 1 75734 6894 1 14S-Methyl-1-octadecene 987411 999570 130285 128548 955049 883467 106840 101313 1155058 1 129597 130317 1085566 21511 109675 140809 1.21E+07 1.30E+07 9088624 9813212 Glabrescione B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 34766 26888 11039 18501 Phytosphingosine 1 1 1 1 1 196734 1 1 1 1 1 1 265268 268961 1 1 1 1 663782 1 "PC(19:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 9557 18769 15416 "PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 150689 975405 820785 891225 "14,14,14-Trifluoro-11Z-tetradecenyl acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15661 14872 7105 6420 PS(12:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 50203 1 "(-)-8,16-Dihydroxy-19-serrulatanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6696 12442 "6-Ethyl-4-methyl-3E,5E,7E-decatriene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5813 1 "PE(14:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 137592 1 1 1 1 1 1 205933 1 1 1 573896 1 "DG(22:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 4181638 3795116 1 1 9534936 3039307 1 1 5806376 452816 1 1 6655017 4236426 464522 1 33681 1 SM(d18:0/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 616510 595619 460147 502430 (21-Methyl-8Z-pentatriacontene 252080 263665 220360 228432 217038 223083 223593 141228 236480 236243 199928 194618 283046 1 166979 153741 290258 47216 83389 282573 "24,24-difluoro-1?,25-dihydroxy-26,27-dimethyl-24a-homovitamin D3 / 24,24-difluoro-1?,25-dihydroxy-26,27-dimethyl-24a-homocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 346843 1 "PS(O-18:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 234327 236720 348060 265586 dodecanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 10801 1 1 1 77344 20742 47353 10-keto palmitic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16115 23926 1 DG(12:0/16:1(9Z)/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 131072 1 "1,3S-dihydroxy-8E-decen-5-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 23001 1 "7,8-Didehydroastaxanthin" 214485 199485 1 1 1 1 1 1 1 120479 1 1 135360 1 1 1 1 1 142047 1 (+)-14-Methyl palmitic acid 5483169 5449441 1927736 880880 5253580 5278482 1859475 896120 6199383 6520296 1531743 725876 6188704 6004063 3905980 104517 1 1 4.59E+07 4.90E+07 N-oleoyl alanine 1 1 1 1 1 1 1 1 248629 228528 1 1 288651 1 1 264780 336623 412310 300335 289818 PA(O-16:0/19:0) 1 1 1 2911246 1 1 1 1 1 1 1 1 1 1 4828498 1 3862926 4249694 5106227 5509793 "PE(17:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 946440 1002864 1049415 1 "2E,8E-Undecadiene-4,6-diynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6385 1 Cer(d18:0/13:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 118226 95308 76289 118059 FMC-5(d18:1/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17208 1 13R-Methyl-6E-heneicosene 61669 58790 107030 102458 83720 62158 91780 69862 58564 63007 130269 111306 70520 73699 64136 85332 139181 241204 198294 97450 C17 Sphinganine 5748815 5664981 1049026 224529 23682 5514469 1547800 229184 6506401 6832591 217866 158618 6433297 6226584 202614 141348 7.13E+07 7.42E+07 5.16E+07 5.47E+07 "3,5-Di-O-methyl-8-prenylafzelechin-4beta-ol" 64683 18028 682092 1 278236 1 1 794974 135476 1 400620 30625 16079 1 1 1 1 1 111771 129410 "32,35-anhydrobacteriohopaneterol" 282404 70840 53495 62204 4594070 90143 80944 43116 2814896 974679 142003 48434 4457573 85886 34081 39244 25766 1 27940 114415 "PG(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 71040 1 "2?-(benzyloxy)-1?,25-dihydroxy-19-norvitamin D3 / 2?-(benzyloxy)-1?,25-dihydroxy-19-norcholecalciferol" 1 1 903324 718829 1 1 1072992 545041 1 1 1006856 689021 1 1 666404 415585 1 1 75666 28308 Penaresidin B 1 36182 73434 99270 1 1 53485 83869 1 34298 96473 114030 36386 38203 64701 67982 105999 132064 106379 106838 "PI(14:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 87410 1 Chamuvaritin 14355 1 144425 1 1 1 1 1 1 1 1 1 1 1 1 1 1534766 1771123 1441580 1708592 (+)-Ursolic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 68510 1 "methyl 15-hydroperoxy-9Z,12Z,16E-octadecatrienoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8032 1 "(5E)-(3S)-1alpha,25-dihydroxy-3-deoxy-3-thiavitamin D3 3-oxide / (5E)-(3S)-1alpha,25-dihydroxy-3-deoxy-3-thiacholecalciferol 3-oxide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31468 124297 27247 PE(19:0/0:0) 1010231 187492 332688 190457 1375966 1408909 835266 204334 1104922 1361428 174106 381311 1796430 1896762 95455 87280 106931 46017 101380 13149 22-oxo-tricosanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1123167 1 Sulfamisterin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 50768 1 "TG(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31207 12449 "DG(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 43875 1 1 1119712 1 1 1392797 2231336 1 1 2614785 2021690 1 37045 2609339 2051816 8748573 9196874 1.22E+07 1.30E+07 "1,16-Heptadecadien-3-one" 46761 1 1 1 1 1 1 1 1 1 1 1 1 55801 1 1 85314 439158 150001 556209 10-[3]-ladderane-decanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6296 1 74895 20898 Cer(d16:1(4E)/20:0(2OH)) 1 1 44688 1 1 1 22824 1 1 1 1 1 1 1 1 1 172638 166936 231079 212007 14-fluoro-myristic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 47814 1 20-oxo-heneicosanoic acid 37588 1 84517 144808 1 23238 1 83832 1 20145 88917 1 1 1 1 1 300106 329250 253654 316373 Helilupolone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 377445 1 "anteiso (4E,14-methyl-d16:1) sphingosine" 24194 18017 1 1 18359 1 1 1 1 23966 1 1 20663 20823 1 1 162033 171361 132593 129015 GlcCer(d18:1/26:1(17Z)) 728894 463153 11865 148669 1263468 52768 12222 1 1 355366 72142 14068 112152 122169 1 1 1 855708 925929 411368 SQDG(16:0/14:0) 966536 2.93E+07 700249 1 365682 2.81E+07 976627 1 2.09E+07 1191603 1 1 144426 606481 1 1 1 1 518031 558024 Hydroxyphthioceranic acid (C39) 1 1 1 1 1 1 1 1 1 1 124319 1 1 1 96703 1 1 205855 352618 185302 9-OAc-NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 36656 36171 5617 Coenzyme Q9 1 1 1 1 1 1 1 1 1 1 102192 133256 1 1 167961 1 397475 338763 477513 415088 PS(17:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 267898 1 538160 797313 3-O-(alpha-L-rhamnopyranosyl-(1-2)-alpha-L-rhamnopyranosyl)-3-hydroxydecanoic acid 1 1 1 126931 1 1 63325 1 1 1 1 1 1 1 1 1 240965 218729 224754 193805 30-(-2-(O-2-hydroxy-ethane)-3-hydroxy-propane)-hopane 209246 3513128 1 299426 22370 1 73816 89569 28058 604117 2051822 41521 154689 3549841 6965101 33324 1 66716 57464 39803 "PA(19:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 533823 638997 187199 "TG(18:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 71557 63191 "Dihydroparasiloxanthin/ 7,8,7',8'-Tetrahydrozeaxanthin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22934 1 "PS(16:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 115181 133843 TG(12:0/18:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 208227 18750 88689 1 (-)-abscisic aldehyde 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 192804 203034 171929 164660 "PI(13:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 394901 400623 431690 423648 "DG(20:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 305470 28422 9562845 9163172 1789548 2087203 9823328 1.08E+07 737298 3788699 1.73E+07 1.15E+07 2629883 6610849 1.22E+07 1.05E+07 1.16E+07 1 1.51E+07 1.66E+07 DG(18:1(9Z)/0:0/18:1(9Z)) (d5) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 131994 1 Dalbinol O-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16072 1 Cholesteryl 11-hydroperoxy-eicosatetraenoate 123777 14538 753958 6373534 10886 186803 202489 205499 5838208 1618713 1.20E+07 992307 90508 534351 76125 3382908 8565078 8842863 1.07E+07 1.29E+07 PI(12:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 110851 1 1507716 1742543 1463969 1674544 15:0 Cholesteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 89774 1 "(2E,5E)-Undecadienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 35524 1 6792 1 9137 9427 PC(21:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13228 1 diamino-pimelic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6848 1 14-nor-lanosta-5-en-3beta-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13825 1 "(11Z)-8,18-propano-retinal" 1 1 1 1 1 1 1 14118 1 1 1 1 1 1 1 1 1 1 8800 1 "DAT(16:0/23:0(2Me[S],4Me[S]))" 1 1 1 1 1 1 194701 1 1 1 64333 1 1 1 1 1 1 1 44069 1 guaiazulene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12703 1 "2,3-Dinor-TXB1" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7175 1 "PC(18:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 448599 1 PE(15:0/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 359923 1 350707 1267139 "1,6-Pentadecadiene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5321 1 12110 6617 "(23S,25R)-12alpha,17alpha,23-trihydroxyspirost-5-en-3beta-yl O-alpha-L-rhamnopyranosyl-(1-2)-beta-D-glucopyranoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1815692 1 formyl 7-oxo-11E-tetradecenoate 26110 17228 1 158083 1 75106 1 44645 29064 47482 153251 1 1 35848 1 101040 1 1 7231 6703 "TG(13:0/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 41875 1 Tetranor-PGE1 216242 199533 618231 730408 168618 177762 656676 657255 163622 145791 672878 633287 220195 219713 810301 785434 428246 1089086 703467 769961 Prephytoene diphosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 532556 1 498803 1 Scillirosidin 1 28635 506903 287776 20618 1 195847 77567 12392 22322 600106 342743 1 18719 334416 289613 11270 1 26828 34968 TG(12:0/20:0/22:0)[iso6] 1 1 149880 34591 1 1 50846 35839 1 1 78792 44134 1 1 68152 36270 1 25262 26448 50082 11Z-heptadecen-1-ol 130672 1 1.03E+07 122293 1 1 1 1 1 1 5809057 1 462352 61712 4134796 1 1 251107 91315 214473 N-(2'-(4-benzenesulfonamide)-ethyl) arachidonoyl amine 6369592 6369203 7414699 5383340 4025355 4059420 4664276 3876786 3323626 3263412 9185327 6466957 5705272 5856537 4707211 3018762 8863645 7231385 1.71E+07 1.39E+07 PI(22:1(11Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1355241 1494626 1284070 1516039 Cer(d18:0/15:0) 8680618 4355649 1.15E+07 138226 7183225 1200374 774651 75701 3700431 8381916 7351240 363107 1.03E+07 5361901 1.04E+07 45573 768354 906001 685291 796435 "31-hydroxy-32,35-anhydrobacteriohopanetetrol" 1 1 1 1 1 1 1 1 1 1 1 79434 1 1 1 1 19188 33793 29731 34109 PC(P-17:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 367272 338524 "(6E,8E,12E,14E)-hexadeca-6,8,12,14-tetraen-10-ynoic acid" 12145 1 1 64243 29646 1 1 23124 24500 1 122141 83358 30383 37911 1 40118 15143 21983 12652 17052 EB 1213 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17226 1 "26,27-diethyl-1?,25-dihydroxy-20,21-methano-23-oxavitamin D3 / 26,27-diethyl-1?,25-dihydroxy-20,21-methano-23-oxacholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17571 1 Linoleamide 28878 22820 1 1 56707 11186 1 1 81389 48188 1 1 1 78550 1 18282 7140 7125 6991 7735 "PC(18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 89788 29121 14230 64341 (-)-beta-thujone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8080 16561 1 "(5Z)-4,4-difluoro-1?--hydroxyvitamin D3 / (5Z)-4,4-difluoro-1?--hydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 27085 1 TG(15:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 35652 1 LysoPE(0:0/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 219034 163948 216959 254764 Cer(d18:0/17:0) 1.07E+07 371117 5298874 4300417 1.09E+07 79287 89975 4285489 1.08E+07 1.11E+07 5711436 1805867 9769794 7710846 346732 2203880 883930 1043898 724509 116574 "1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(3-methylbutyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 50273 13697 1 "PI(P-16:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 820036 942035 10-oxo-nonadecanoic acid 152800 1 102697 110215 230791 46331 51787 53028 71383 1 293869 114018 361195 306153 55004 77126 109202 126313 139175 137169 PS(12:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 107383 1 "(E)-3,7-Dimethyl-2,6-octadienyl nonanoate" 1 1 18723 24740 1 1 17302 30487 1 1 58531 35622 1 1 1 1 1 64460 12921 1 "(-)-1,2-campholide" 1 1 1 1 1 1 335330 1 1 35639 1156439 34391 1 1 1 1 1 5251 9211 6219 Heptadecanoyl Ethanolamide 1 1 11354 1 1 1 1 1 1 1 1 23578 1 1 1 1 149101 144248 128237 111580 "PA(19:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 237874 323489 PA(O-18:0/21:0) 1 1 569328 489335 1 1 524035 103664 1 1 896986 206003 1 1 134988 115289 520516 493301 769387 778011 TG(18:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15608 32005 (+)-geosmin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14368 31608 SM(d18:2/18:1) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 423199 375296 288605 300406 "(E)-3,7-Dimethyl-2,6-octadienyl dodecanoate" 103123 91942 1 198456 1 1 97837 165230 1 60835 1 1 100895 77932 115994 121776 63053 43024 161014 46678 "PA(O-16:0/22:2(13Z,16Z))" 1 1 619554 560760 1 1 623943 579315 1 1 1 104210 1 1 1 1 1 1 914617 927401 "(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl heptanoate" 127436 122284 338919 352232 75938 84024 233080 276880 63378 63674 444558 389707 96201 102060 338566 316254 401333 331242 462746 404856 "22:1(5Z)(9Me,13Me,17Me,21Me)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14003 1 "(4E,8E,d18:2) sphingosine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 50383 9619 1 PC(13:0/0:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 119595 144015 117935 166033 11-hydroxy-dodecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12850 1 PE(13:0/22:1(11Z)) 536709 690657 2893686 1044012 445368 742875 5205004 1 794734 1270355 2184821 1 1427890 1203015 733688 1 49814 640670 156292 720137 "(1R,2R)-3-oxo-2-pentyl-cyclopentaneoctanoic acid" 1 1 69209 1 1 1 88400 1 1 22908 1 1 1 1 61644 74665 1 14097 10514 9266 "2,4,6-undecatrienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8141 6791 8088 "PC(16:0/22:5(4E,7E,10E,13E,16E))[U]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 42753 21948 38517 77286 "(6RS)-22-oxo-23,24,25,26,27-pentanorvitamin D3 6,19-sulfur dioxide adduct / (6RS)-22-oxo-23,24,25,26,27-pentanorcholecalciferol 6,19-sulfurdioxide adduct" 1 1 1240217 1239747 1 1 942775 1047987 1 1 1362118 1226502 1 1 1273712 1171948 1 1541444 1638762 1 "PC(12:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 263337 1 1 1 1 1.59E+07 1.52E+07 1.66E+07 1.56E+07 "TG(17:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 24199 1 PA(20:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 97562 1 "1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(isobutyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 65539 92570 87057 PS(P-16:0/12:0) 777347 253661 248160 3631073 194467 381374 86050 4251096 273836 78681 1.09E+07 5544535 957815 1096755 295973 4430365 6028144 454388 8603307 697327 19-hydroxy-nonadecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 169023 318852 28271 245753 "DG(21:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 392860 450244 1 1 1 1 1 1 1 1 1 1 1 1 1 1 114429 129707 10Z-Pentacosene 39165 35573 78117 79601 29265 28415 55738 60115 23343 26375 96188 92683 37707 38631 74707 87432 68520 13809 6580 6003 PE(16:1(9Z)/P-18:1(11Z)) 1 1 1 1 1 25331 1 1 569252 150040 142226 1 1277853 54063 47104 1 1 1 140924 125013 PS(P-16:0/13:0) 1 1 1 1 1 1 1 1 31765 1 305294 248661 1 1 272619 213519 1177353 1298817 1410434 1544638 PS(O-16:0/14:1(9Z)) 2584588 1473967 900853 2241677 3778719 3777580 1383992 79080 1791402 1442932 1148860 808258 1862796 3221574 2174764 89222 179685 84217 151638 44126 11-trans-LTE4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 85689 22961 134239 24886 Etn-1-P-Cer(d14:1/18:0) 2629724 350518 2763883 2485329 1018704 132491 3960531 3494997 2850643 1212896 4866088 3324498 1014522 1025594 2582842 3001697 3702079 3841686 4643923 4538264 4-Tridecene 1 1 1 1 32755 1 1 1 1 1 1 1 1 65112 1 1 32327 10344 86317 15427 PA(P-20:0/19:1(9Z)) 1 1 1462037 2666248 28323 1 1045215 1757156 1 1 1366650 1450786 1 1 97899 3344892 1 1 38444 32727 PE(15:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 866205 1 PS(P-16:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5314 1 6607 6879 "PA(O-18:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 509027 431095 50840 1 1 1 40233 750766 548389 22314 "PA(20:2(11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 341447 1 LPA(0:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 117204 1 1 1 1 8366 5130 10883 24477 TG(16:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 35028 26369 49229 29641 "14,15-HxA3-D(11S)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 148981 528663 582790 514481 513331 N-(3S-hydroxydecanoyl)-L-serine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8172 1 12564 9453 "2,4,6,8-decatetraenal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8680 1 PC(O-12:0/O-1:0)[U] 1 193723 546662 621187 1 1 310945 388641 1 1 293533 390575 1 1 174290 191440 618949 200574 226587 3506559 DGTS(16:0/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 557438 810624 1 10-undecenal 30183 23213 32424 49083 1 1 1 20439 1 13232 36631 1 43348 32874 41756 43070 1 1 7390 1 11-amino-undecanoic acid 932215 907338 1068242 1146359 708538 771203 822775 780771 518649 535815 1367583 1406934 1020274 1064115 806215 782126 1845806 1846330 1301561 1326212 Brosimone H 1 1 1 1 1 1 1 1 1 1 1 1 77594 1 1 1 1 1 8023 1 Estrone 3-glucuronide 1 1 1 1 1 1 13672 31394 1 1 1 17651 1 1 1 1 63258 42220 62121 69027 3-Ethyltridecan-2-one 81750 973497 87392 2514184 4266457 3318586 8425192 1 3655172 4011445 1.21E+07 225039 2609876 812424 1.52E+07 5957817 419346 1661318 221163 226641 "DG(15:1(9Z)/18:3(9Z,12Z,15Z)/0:0)[iso2]" 1 67204 1 1 1 1 1 1 1 1 1 1 1 1 1 1 998288 1031547 865698 867290 (-)-14-Serratene 1 1 290345 326971 1 1 339534 302905 1 1 1 1 1 1 251155 287971 885027 956280 629190 627108 "(22E)-3alpha,12alpha-Dihydroxy-5beta-chol-22-en-24-oic Acid" 26004 1 87559 118762 72775 20838 229763 49187 14200 58283 117712 73432 1 82925 104824 103180 106998 135016 134861 141458 Palmitoleamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8973 1 1-methyl-1-(2-methyl-2-propenyl)-cyclopentane 506855 1106066 173788 1 2587293 50264 7618864 1 1 1 5279969 1 1 97503 573093 106459 37833 20882 19783 21990 CerP(d18:0/16:0) 1 1 1 1 1 78639 1 1 1 1 213395 225859 1 1 1 1 1 1 144582 1 "(E)-3,7-Dimethyl-6-octenyl 3,7-dimethyl-2,6-octadienoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 54300 1 1 1 1508944 1084964 1 "1,12E-Pentadecadiene" 18434 39216 1 1 1 25746 1 1 32388 1 79992 45061 1 1 116163 21934 1 13010 20576 13276 "(20S)-1?,25-dihydroxy-20-methoxy-26,27-dimethylvitamin D3 / (20S)-1?,25-dihydroxy-20-methoxy-26,27-dimethylcholecalciferol" 1 1 1 1 1 1 1 1 1 1 33989 1 1 1 1 1 1 1 41447 24998 Megalomicin C1 185483 170558 1 1 82458 88844 1 1 1 1 1 1 152394 144592 1 1 1 1 42584 1 Nitenin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6035 1 14-hydroxy-heneicosanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 107604 552027 68932 413014 "(20S)-1?,20,25-trihydroxyvitamin D3 / (20S)-1?,20,25-trihydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 71679 48810 67653 65141 TG(12:0/16:0/22:1(11Z))[iso6] 4128964 4481717 2414458 189031 247601 4535301 1361565 202562 1735934 4596818 1594066 584262 3858245 4563215 140652 1080521 125673 76405 177823 123262 oleanolic acid 3-O-beta-D-glucosiduronic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1448292 1585478 1357169 1665115 (+)-16-Methyl stearic acid 2568001 2416008 2437132 1 2298058 2354139 1134512 1 2753736 2926674 1044674 311241 2702640 2785651 2507772 988312 3.20E+07 3.46E+07 2.50E+07 2.71E+07 Sugeonyl acetate 61279 33443 376244 1 153667 59211 436098 1 101286 36084 119376 1 16417 12209 1255896 13608 19798 37196 27638 25607 "PG(12:0/18:3(6Z,9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 58666 1 48266 1 delta2-THA 92264 80998 1 1 1 1 1 1 43655 1 1 1 47597 1 92623 98254 200225 204212 129295 121537 1-tetradecanyl-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol) 455401 513165 847789 537814 609097 535493 613128 559058 697263 916501 948594 860868 682737 800467 786627 745873 1 405348 496812 537729 "DG(14:1(9Z)/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 87245 1 69647 1 Prebarbigerone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 56978 1 "(25R)-26,26,26-trifluoro-1?,25-dihydroxyvitamin D3 / (25R)-26,26,26-trifluoro-1?,25-dihydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 200439 149554 111082 1 503342 142901 132431 245922 124284 87579 PC(O-16:0/17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 142952 101791 1 PC(16:0/5:0(CHO)) 1 1 1111499 1123379 1 133636 875416 599173 1 1 500572 470331 1 1 567596 505163 2282154 157204 2433438 2741490 Emmotin A 19516 18990 24277 38582 15337 1 42872 28945 23023 19832 41555 36363 22869 20939 17616 1 8202 8379 9558 15759 13-amino-tridecanoic acid 1 1 156320 102172 1 1 122409 62862 1 1 187046 105051 1 1 190765 122074 369347 427633 268550 332659 22-iso-teinemine 181868 171040 351473 406807 148890 133767 385352 341695 127016 141127 1 1 140413 150783 312801 350442 1154314 1088385 925799 467256 Lamioside 405986 429814 506493 629361 286738 339641 570501 569588 360291 324167 472597 536926 188167 198534 395101 415268 1295066 1266338 1427464 1289224 "PS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 261843 1 "PE(P-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 81460 47317 1 "PA(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)" 24253 418308 1 1 105196 129251 1 99680 460878 59705 59848 1 242196 1 1 1 121375 167321 131678 125491 "1,2-dimethylcyclopentane" 3143569 2979948 6526932 124146 2439047 2507858 5233739 1 2637562 2822584 2151299 1772079 314264 963827 4134965 4896349 1 15581 10140 26027 "3E,6Z-Heneicosadien-11-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5997 1 "(20S)-1?,20,25-trihydroxy-24-norvitamin D3/(20S)-1?,20,25-trihydroxy-24-norcholecalciferol" 1 78325 82256 39675 34140 1 55053 22108 1 1 29013 1 1 1 1 1 964056 854731 401451 349154 N-methyl hexanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18221 1 Spisulosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 26671 64046 62102 PE(12:0/17:1(9Z)) 353968 290683 1222649 1207416 170328 273254 1301956 1937498 256943 265687 1 2463864 241228 276906 1888150 1596366 1 1406164 1701489 1934832 "TG(12:0/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 89142 176794 178783 Butyl 4'-O-butanoyl-6-O-hexadecanoyl-neohesperidoside 24053 1 120996 107928 1 1 97384 53351 1 1 87029 85356 1 1 64608 54109 1 512117 539013 1 "PC(17:2(9Z,12Z)/0:0)" 1 1 714732 790438 1 1 635866 423163 1 1 374656 330762 1 1 406848 376185 665436 755170 848348 912941 2-methyl-tridecanedioic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 23518 1 "26,26,26-trifluoro-25-hydroxy-27-norvitamin D3 / 26,26,26-trifluoro-25-hydroxy-27-norcholecalciferol" 1 1 35171 1 1 1 17838 1 1 1 1 1 1 1 1 1 244318 155124 1659612 236513 Docosanedioic acid 1 1 465000 426326 1 1 147478 109622 1 136205 48593 49344 1 1 98157 69552 1 1 631062 44636 "(24R)-1?,24,25-trihydroxy-22-oxavitamin D3 / (24R)-1?,24,25-trihydroxy-22-oxacholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 214940 123810 1 "PC(6:2(2E,4E)/6:2(2E,4E))" 1 1 1 1 1 1 1 31394 1 1 1 17651 1 1 1 1 59454 42220 60945 50719 Aplidiasphingosine 217015 219632 343629 1 1 138236 313587 376369 111989 77881 470493 454974 1 1 259740 318953 1400446 1144195 1343800 1101341 DG(19:0/22:0/0:0)[iso2] 74202 1 1 1 1 1 66870 1 1 1 1 1 1 1 1 1 1 43605 33221 43659 10E-nonadecenoic acid 20733 1 61784 55357 10973 1 35053 37942 1 1 168680 85738 11590 25979 42340 33144 130034 137694 121063 118687 Hippuristanolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 180119 172988 166947 182539 (E)-octadec-9-en-12-ynoic acid 1 1 1 1 1 1 1 1 1 1 112814 1 1 1 40584 1 1 1 11998 1 "PA(13:0/18:2(9Z,12Z))" 140975 181768 626240 621054 98932 127954 721912 1254476 140367 169311 1 1543024 124401 140984 1043812 866130 1 1 2157289 1 PI(P-18:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 231896 247650 195383 175796 "(6R)-vitamin D3 6,19-(4-phenyl-1,2,4-triazoline-3,5-dione) adduct / (6R)-cholecalciferol 6,19-(4-phenyl-1,2,4-triazoline-3,5-dione) adduct" 1 1 1 1 1 1 1 69451 1 1 1 1 1 1 1 1 1 104859 207425 194781 Cer(d18:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 87232 1 10-hydroxy-16-oxo-hexadecanoic acid 26616 1 1 1 1 1 11756 17141 24835 23488 1 1 25938 1 1 1 9461 30626 22170 12602 (Z)-7-Dodecenyl formate 1 26404 60260 75824 1 1 22642 50726 1 1 67125 96443 12438 1 90723 83800 56522 98147 53115 83720 PGP(16:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7072817 6692734 7555467 1 Aragusteroketal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 67178 1 "PS(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1094287 1 1 1 1 1 1 1 1 1 2577674 1 2734338 1 "TG(16:0/22:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 32343 1 TG(12:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 49626 34152 76980 1 PA(P-18:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 70628 1 Bis-[2-lyso-3-arachidonoyl-sn-glycerol]-1-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 256094 1 PGF2? dimethyl amine 231836 223836 1 352982 173600 182203 1 1 140971 1 485114 1 1 153403 310149 360582 580388 1 624202 518206 15-methyl-15R-PGD2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 42454 1 "PI(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 155899 113384 238182 103525 "13,14-dihydro-15-keto-PGD2-d4" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 802058 1 (-)-7-Fernen-3alpha-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 105499 1 11-Octadecen-1-ol 1 1 1 1 13904 1 1 1 1 1 1 1 1 1 1 1 1 1 1 104332 "11-Deoxy-16,16-dimethyl-PGE2" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11347 "2,4,7-tridecatrienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 29388 "PI(13:0/18:3(6Z,9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1032304 958284 1 864577 PA(O-16:0/15:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1433448 1 1 511557 PI(12:0/21:0) 1 1 1 162150 1 1 1 1 1 1 1 1 1 1 12624 1 1 1 1 412891 "PC(13:0/18:3(6Z,9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 308491 PS(22:1(11Z)/0:0) 1 54055 1 1 1 1 149911 1 1 1 107618 94371 1 1 1 1 1 473686 1 516773 PA(P-20:0/0:0) 1 1 1 88359 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8076 Amoritin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8222 "5,7-Diethyl-9-methyl-3E,5E,7E,9E-tridecatetraene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 34928 PC(16:1(9Z)/2:0) 62715 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 23202 "TG(12:0/20:0/22:3(10Z,13Z,16Z))[iso6]" 45753 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 86267 92965 1 106079 (E)-2-Octenyl 2-methyl-(E)-2-butenoate 57033 60138 1 1 45389 1 1 1 34570 28813 49615 1 51500 54518 1 1 1 44727 1 50730 LacCer(d18:1/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18958 PG(13:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 64342 "24:2(5Z,9Z)(11Me,15Me,19Me,23Me)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 24827 TG(12:0/20:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21473 1 1 25259 (-)-1-Silphinene 1 15231 10277 1 1 1 1 1 1 1 1 1 1 1 1 1 11659 14346 1 8812 "PG(18:4(6Z,9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1950868 1 1791292 "10-Undecenoic acid, 2-hydroxy-, (R)-" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 315140 "TG(12:0/18:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 139843 Kazinol H 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 32922 "(20S)-14?,20,25-trihydroxy-26,27-dimethylvitamin D3 / (20S)-1?,20,25-trihydroxy-26,27-dimethylcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 38617 1 11595 "TG(12:0/18:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 71456 1 16314 "(-)-11-hydroxy-9,10-dihydrojasmonic acid" 1 1 1 70417 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15877 "Nonanoic acid, 3-amino-, (R)-" 1 21608 101797 119863 1 14280 54129 51581 14537 1 123312 125025 14345 21885 78234 86523 7451 5437 1 25823 2-heptenedial 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13893 1 11876 LysoPE(0:0/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22870 PC(18:1(9E)/2:0) 1 1 1 205939 1 1 1 252640 1 1 1 1 1 1 1 1 1 1 1 9898 PI(14:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 23640 1 33273 1-Heptadecene 1 1 42880 52511 1 1 43624 22213 1 1 61624 73902 29365 39620 65291 57604 25411 31296 1 14694 10Z-Heneicosene 477119 1 17203 29171 1 1 1 29443 1 1 66237 36994 1 1 47603 29092 6782788 7483548 1 5809989 "methyl 12,13-epoxy-9,15-octadecadienoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22963 1 1 1 1 29087 2-arachidonoyl glycerol-d5 1 1 1 1 1 1 146415 1 1 1 1 1 1 1 1 1 81654 1 1 75673 "DG(17:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19663 1 1 19381 PI(16:0/0:0) 581316 583974 964751 1 705133 730792 1083850 1178022 688044 749248 2563311 1706307 1302740 1365113 1 1 1 5511 1 9752 "6,10-Dimethyl-5(E),9-undecadien-2-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 26218 63101 1 72148 11(12)-EpETrE-EA 1 1 1 1 1 1 75473 1 1 1 1 1 1 1 1 1 1 1 1 21457 15-HETE-GABA 1 1 1 1 1 1 209942 1 1 1 1 1 1 1 13866 1 27208 1 1 79866 "TG(18:0/22:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31045 1 45275 13-Methyl-1-tritriacontene 21339 1 83622 111561 1 1 53653 51476 14626 1 95926 113603 1 1 72322 76517 54643 72839 1 144630 "TG(12:0/13:0/18:3(6Z,9Z,12Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 62946 "TG(17:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 26377 1 1 21324 "3,3-dichloro-propionic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11126 (-)-Stolondiol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19772 1 1 1 12516 "PC(22:2(13Z,16Z)/21:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14768 1 20811 "TG(12:0/16:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 57674 "9-hydroxy-hexadecan-1,16-dioic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 99084 "DG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 76910 589005 1 1 1 1 1 1 1 66390 "PG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 148990 "PI(18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 900808 SM(d16:1/20:1) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 247676 "13,13-dimethyl-tetradecanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 217419 1 1 9260 "PE(22:5(4Z,7Z,10Z,13Z,16Z)/P-18:1(11Z))" 61175 646200 1060119 1 613322 98122 1399413 76083 222572 538459 43473 48126 138198 488438 1 1 1 1 1 62646 Sativic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 220541 "(24E)-24,26-dimethyldesmosterol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17879 26191 1 8947 "MGDG(18:5(3Z,6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1108218 1208167 1 1184271 PA(O-20:0/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 161915 Campesteryl glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1492618 "PE(18:0/22:6(4Z,7Z,10Z,12E,16Z,19Z)(14OH))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 106564 Isorhamnetin 3-(2'''-acetyl-alpha-arabinopyranosyl)-(1-6)-galactoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14345 11-dehydro TXB2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5298 "PI(14:0/22:4(7Z,10Z,13Z,16Z))" 2940151 2896680 1897550 1329696 2807238 2737517 1937274 1854423 2882061 2871587 4008385 2727303 2307562 2352287 582034 431537 1 1 1 1578693 "TG(21:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10894 MIPC(t18:0/24:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 107398 1 1 172873 4-O-alpha-Cadinylangolensin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 95908 Linoleyl stearate 1 1 154249 109627 1 1 1 126497 1 1 1 48150 1 1 147373 51911 1 1 1 20960 enantio-PAF C-16 1 1 111952 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 40895 "TG(12:0/20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19666 1 1 9665 "LysoPE(0:0/18:4(6Z,9Z,12Z,15Z))" 257406 33589 121784 1 252632 400368 1 133868 433803 121273 148236 1 234363 179694 1 1 152811 209277 1 142963 PS(O-16:0/17:1(9Z)) 1 1 1821847 1106314 1 1 1833152 941610 1 1 1690601 1146478 1 1 4696892 3108761 1 1 1 37122 "(5R,7S)-7-Methyl-1,6-dioxaspiro[4.5]decane" 1 1 86152 119831 1 16968 43993 49050 25071 1 144040 129652 15285 19835 68933 94008 17841 41129 1 21625 "PA(22:1(11Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 151959 PI(18:1(9Z)/0:0) 579690 628481 854806 520454 910881 921865 932249 913225 705463 678257 2257126 1454425 1051836 1124873 1 1 1 1 1 8266 Patuletin 3-(2''-feruloylglucosyl)-(1-6)-[apiosyl-(1-2)-glucoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6093 "PS(15:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 132026 makisterone B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 347702 SM(d18:1/24:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19178 Safflomin C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7808 Galbeta-Cer(d18:1/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 36981 1 1 18443 "1,9Z,16-heptadecatrien-4,6-diyn-3,8-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7286 PI(13:0/20:1(11Z)) 1 1 1 1 1 94635 1 1 1 1 1 1 1 1 1 1 1 1 1 404978 "Pelargonidin 3-(6'',2'''-diferulylsambubioside)-5-(6-malonylglucoside)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 26005 "(5Z,9E,14Z)-icosa-5,9,14-trienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7309 PE-Cer(d14:1(4E)/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 57290 "DG(22:0/22:4(7Z,10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 61339 1 128368 "PG(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 969138 1 910819 "octane-1,2-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8115 N-stearoyl histidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12429 "(2S,4R,6R,8S)-2,4,8-Trimethyl-1,7-dioxaspiro-[5.5]undecane" 1 1 49389 85129 1 1 1 47507 1 1 72108 72570 1 35702 25365 48496 32827 54494 1 27010 "(4E,8E,9Me-d19:2)sphingosine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 142688 "TG(18:0/22:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10532 PE(20:0/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 167070 10Z-Hexadecenyl acetate 1 1 1 1 1 1 1 1 1 1 1 50279 1 1 956445 1 1 1 1 420167 (S)-2-aceto-2-hydroxy-butanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7163 "(±)19,20-DiHDPA" 1 1 1 1 23483 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13381 GlcCer(d14:1(4E)/20:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 333825 1 1 424115 5-(1-hydroxybutan-2-yl)isolongifol-4-ene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22443 25-hydroxy-cholesterol(d3) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 94680 1 1 1 126804 (24R)-24-methylcycloart-25-en-3beta-ol 1 1 197229 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 71631 "(24R,25S)-25,26-epoxy-1?,24-dihydroxy-27-norvitamin D3 / (24R,25S)-25,26-epoxy-1?,24-dihydroxy-27-norcholecalciferol" 1 1 1 1 1 1 114182 1 1 1 167163 1 1 1 1 1 1 1 1 17968 TG(19:0/12:0/19:0) (d5) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7317 "DG(15:1(9Z)/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 30568 PE(12:0/22:1(11Z)) 222623 1 1 1 1 187876 1 517766 1 1 1 1 1 1 1 1 1 23232 1 37408 N-ethyl arachidonoyl amine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1270074 "PA(18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 384498 389805 1 1 1 306444 1 1 1 1 1 1 227365 1 1 1104419 1 1279545 Cer(d18:0/14:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 107269 1 190160 "TG(12:0/22:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 36759 "2',4'-Dihydroxy-3'-(1,1-dimethyl-2-propenyl)chalcone" 1 1 1 32462 1 1 1 33010 1 1 1 1 1 1 1 32124 1 1 1 47980 "11-acetoxy-3beta,6alpha-dihydroxy-9,11-seco-5alpha-cholest-7-en-9-one." 100331 1 1 1 1 1 1 1 1 1 1 1 1 1 32093 1 1 1 1 127284 "(9S,10S)-9,10-dihydroxyoctadecanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10542 (E)-2-nonen-1-al 54468 1 843179 165581 57055 1 1 28090 1 1 169369 163129 47679 48825 1347831 226591 1 1 1 39377 "PG(P-18:0/17:2(9Z,12Z))" 1 1 592973 608576 1 1 1 339294 1 1 1 554792 1 1 1 1 290440 1 1 680899 (-)-Cleistanthol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11968 PA(O-16:0/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 518837 1 740597 PE(14:1(9Z)/14:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1410304 PE-Cer(d16:1(4E)/22:0) 1 1 54735 1 1 1 1 1 1 1 1 1 1 1 1 1 1 298685 1 395711 "1?,25-dihydroxy-2?-(3-hydroxypropoxy)-19-norvitamin D3 / 1?,25-dihydroxy-2?-(3-hydroxypropoxy)-19-norcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 68217 PS(12:0/20:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 208832 "7E,9E,11-Dodecatrienyl acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12132 1 1 25620 "PA(15:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 77720 589005 1 1 1 1 1 1 1 889458 12alpha-Hydroxy-3-oxo-5beta-chol-9(11)-en-24-oic Acid 1 1 1 1 1 1 105873 1 1 1 1 1 1 1 1 1 50970 1 1 83069 PA(21:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18660 "PA(20:0/22:2(13Z,16Z))" 1 2007601 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(0:0/4:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Leucodelphinidin 3-O-(beta-D-glucopyranosyl-(1-4)-alpha-L-rhamnopyranoside) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6345 1 1 1 PG(O-18:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18:1 Campesteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 31070 1 1 267760 1 1 1 1 1 1 1 172592 1 1 1 1 1 936126 1 1 "9,15-dioxo-11R-hydroxy-2,3,4,5-tetranor-prostan-1,20-dioic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(22:1(11Z)/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:3(6Z,9Z,12Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 507287 1 1 1 1 1 1 1 1 1 Oleoyl Ethanolamide 1 1 1 1 1 1 1 1 13664 1 1 1 1 1 1 1 1 1 1 1 Hydroxyphthioceranic acid (C37) 1 1 1 1 1 1 1 1 1 1 1 62064 1 1 1 1 1 1 1 1 "TG(12:0/20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 176818 1 1 1 "PI(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11(R)-HEDE 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Anandamide (22:6, n-3)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(14:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(E)-3,7-Dimethyl-2,6-octadienyl decanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Grandiflorone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-HpOME 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 42043 1 1 1 1 "18:1(5Z)(9Me,13Me,17Me)" 29148 25936 160195 194458 1 1 96821 148214 1 1 280338 284978 1 11892 139312 171536 1 59282 1 1 PG(18:1(9E)/0:0)[U] 66532 48503 28065 1 109173 96204 65009 1 57289 61728 1 1 75936 70807 1 1 1 1 1 1 "1beta,3beta,5alpha,6beta-tetrahydroxyandrostan-17-one" 1 1 1 92432 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(17:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z))" 66386 1 1 207627 1 1 1 1 1 1 1 156821 1 1 1 1 1 733605 1 1 PI(12:0/22:0) 1 1 1 1 1 1 1 137094 1 1 1 1 1 1 1 1 1 1 1 1 Tetranor-PGF1alpha 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(16:0/22:2(13Z,16Z))" 296970 287881 282430 192637 303866 324539 605786 1 436768 277434 1 1 506797 616808 1 1 1 1 1 1 16-Methylheptadecyl isobutyrate 1 1 1 1 27156 1 1 1 24055 20586 1 1 29498 27875 1 1 27491 90710 1 1 PC(0:0/3:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19996 1 1 1 "PA(22:2(13Z,16Z)/0:0)" 387721 356196 1 1 839552 372120 1 1 350640 288993 1 1 445305 420297 1 1 1 1 1 1 PA(O-18:0/22:1(11Z)) 1 1 178472 432329 1 1 304073 142827 1 1 365206 1 1 1 62903 33963 1 1 1 1 5S-HETE di-endoperoxide 35345 1 1 1 1 17453 1 1 64347 59769 1 1 61914 55648 1 1 7188 1 1 1 Enigmol 1 1 1 22370 1 1 1 1 1 1 1 27042 1 1 1 1 1 1 1 1 2-dehydroecdysone 1 102361 1 1 1 74990 1 1 1 1 1 1 1 1 1 1 213048 337020 1 1 "36:5(18Z,21Z,24Z,27Z,30Z)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/12:0/13:0)[iso3] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 264603 1 1 "LysoPE(0:0/18:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(17:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 446842 1 1 "38:5(20Z,23Z,26Z,29Z,32Z)" 1 1 1 319694 1 1 1 1 1 1 1 1 1 1 1 1 460933 1 1 1 "PS(P-18:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 390943 363071 54073 1 1 1 1 151052 271517 253656 1 1 1 1 1 1 1 1 "TG(12:0/16:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "10,14-Dimethyl-1-octadecene" 48537 48515 75885 105394 40698 40707 61769 75918 52595 47760 104894 105090 58849 51157 70507 1 168746 1 1 1 "4,8,12-Trimethyl-1,3E,7E,11-tridecatetraene" 1 1 1 1 1 1 1 1 1 1 1 164469 1 1 1 1 1 1 1 1 "14-O-(alpha-D-glucopyranosyl)-7S,14S-dihydroxy-7,9,13,17-tetramethyl-2E,4E,8E,10E,12E,16E-octadecahexaenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(2:0/O-16:0)[U] 1073989 1054236 1 1 1 1 1 1 904820 851556 1 1 1378179 1405758 1 1 1 66932 1 1 "3,5,7-Trimethyl-2E,4E,6E,8E-decatetraene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE-Cer(d16:1(4E)/20:0(2OH)) 1 1 1 1 1 1 1 1 1 1 59123 1 1 1 1 1 1 1 1 1 Malvidin 3-O-[6-O-(4-O-(4-O-(6-O-(trans-caffeoyl)-beta-D-glucopyranosyl)-trans-p-coumaroyl)-alpha-L-rhamnopyranosyl)-beta-D-glucopyranoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(14:1(9Z)/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(t18:0/26:0(2-OH)) 102804 1 1 1 1 1 16175 1 1 1 1 1 1 1 1 1 1478689 2180116 1 1 Fucalpha1-2Galbeta1-4(Fucalpha1-3)GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(18:0/22:5(7Z,10Z,13Z,16Z,19Z))" 64974 1 1 266566 1 1 1 164008 1 1 162222 174449 1 1 1 124612 751446 897448 1 1 "PC(13:0/20:4(5Z,8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "13,14-dihydro-19(R)-hydroxyPGE1" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Epothilone A 1 1 1414588 1334185 1 1 1121558 1 1 1 1 1472269 1 1 1466957 1 1292554 1312070 1 1 PA(P-16:0/14:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/14:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 57302 1 1 "1,15-Hexadecadien-3-one" 1 1 1 1 13218 1 1 1 1 1 1 1 19521 1 24094 1 1 1 1 1 19'-Hexanoyloxyfucoxanthin 1 165053 1 1 82035 1 1 1 89659 1 238437 197237 1 1 1 185036 7813978 7575022 1 1 PS(12:0/12:0) 1 59582 184098 213073 1 1 1 1 1 1 1 1 1 1 170882 1 1 653907 1 1 "MGDG(18:3(9Z,12Z,15Z)/16:3(7Z,10Z,13Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1720901 12803 1 1 342961 41626 1 1 597448 1 94152 51625 785990 1 13073 14819 1 1 GalNAcbeta1-4Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(20:4(5Z,8Z,11Z,14Z)/0:0)" 1 1 564490 1 1 1 650115 753907 1 1 1647288 1111050 635922 1 1 1 1 1 1 1 1-Octadecene 194305 197895 123567 144127 203989 202148 92368 73444 206643 205172 115426 131336 291509 318729 78155 98810 1 1 1 1 (-)-cis-(R)-allethrin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C16 Sphinganine 1 1 19291 1 1 1 1 1 1 1 1 24843 1 1 1 1 1 170416 1 1 "3,7-Dimethyl-8,11-dioxo-2E,6E,9E-dodecatrienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-18-Methyl-eicosanoic acid 21969 1 1 1 11162 1 1 1 1 14733 1 1 1 1 1 1 37633 39696 1 1 Matricin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sorbaldehyde 29661 31462 1 24423 14127 1 1 1 1 1 16217 1 28136 27464 1 12141 1 1 1 1 PS(16:0/0:0) 1 1 1 1 1 98114 1 1 45534 1 336686 1 1 1 1 1 1 1 1 1 "PE(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 166578 1 1 1 1 1 1 1 1 1 1 1 1 65411 2044623 1 1 1 "TG(16:0/22:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(24:0/P-18:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(22:0/24:1(15Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/16:1(9Z)) 1 220711 1 1 153740 292267 1 121457 1 278086 1 1 132849 164959 1 1 1 1 1 1 "DG(16:0/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 29610 111220 115510 1 1 "Docosanediol-1,14-disulfate" 1 1 1 1 1 1 1 1 1 1 3193177 1 1 1 1 1 1 1 1 1 PI(14:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(5Z)-4,4-difluoro-1?,25-dihydroxyvitamin D3 / (5Z)-4,4-difluoro-1?,25-dihydroxycholecalciferol" 1 1 570899 1 1 1 1 223759 1 1 1 1 1 1 314929 1 1 1 1 1 Lipid A -disaccharide-1-P 3.75E+07 3.97E+07 4749504 1.03E+07 1301951 769161 9755997 162619 1.89E+07 4.05E+07 1710865 647340 3.92E+07 3.72E+07 2.52E+07 1.47E+07 1 1 1 1 N-hydroxy arachidonoyl amine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15-HETE-DA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(16:0/3:1(2E)) 1 1 956864 993083 1 1 778774 548481 1 1 441665 416708 1 1 491190 480377 1272050 1712049 1 1 "LysoPE(0:0/20:2(11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-16:0/18:2(9Z,12Z))" 608525 90237 923216 390634 63009 637666 442302 438863 551258 97168 801646 564705 1252933 82369 653203 523003 31411 50284 1 1 "DG(22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 403976 1 1 537814 1 1 764596 1 1 931039 1 867471 290585 801382 1 1 1 55891 1 1 10Z-Tricosene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2E,4E,6Z)-7-(7,7-Dimethyl-4,5,6,7-tetrahydro-1H-inden-2-yl)-3-methyl-octa-2,4,6-trienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C22 Sulfatide 1 1 13956 1 1 1 24958 1 1 1 15277 1 1 1 10020 16759 1 1 1 1 Sulfated Dihydromenaquinone-9 1 84421 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 741100 1 1 "PE(19:0/22:2(13Z,16Z))" 1 1 1 45881 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/22:0/22:0)[iso3] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(18:0/22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4-Dimethyl-2E,4E-hexadienal" 226900 177536 1 1 154273 112907 1 1 381348 18316 1 1 1 286392 1 1 30093 1 1 1 "PA(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 302436 1 1 1 1 1 1 1 "DG(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 628562 1 1 1 1 1 50053 1 1 LysoPE(0:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "7,8,7',8'-Tetradehydroastaxanthin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Anandamide (20:3, n-3)" 1 41274 1 1 1 1 115255 1 1 1 1 1 46363 1 1 1 60241 1 1 1 PA(12:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 42599 204979 1 1 1 1 1 1 829760 1 1 Avermectin B2b 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(12:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(d20:0/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 432877 321007 1 1 SM(d18:0/26:1(17Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Apigenin 5-rhamnosyl-(1-2)-(6''-acetylglucoside) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3E,4Z,7,11-Tetramethyl-6,10-tridecadienal" 1 1 291794 1 92707 1 154243 1 1 1 1284084 1 768440 1 3880628 1 1 1 1 1 "TG(12:0/21:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(18:3(9Z,12Z,15Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(O-16:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d14:1(4E)/18:1(9Z)(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(16:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:0/22:2(13Z,16Z))[iso6]" 287929 633479 100286 45914 246774 265362 227530 1 1 309896 151970 53861 134869 310648 16605 26001 1 1 1 1 gibberellin A2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/20:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 20345 1 1 1-Hexadecanoyl-2-(14-pentadecenoyl)-sn-glycero-3-phosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,5-(methanoxyethano)isolongifol-4-ene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(O-16:0/18:3(6Z,9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(3-(15-methyl-hexadecanoyloxy)-13-methyl-tetradecanoyl)-L-serine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3Z,6Z,9Z)-dodecatrienol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12751 19064 1 1 1 1 Heptadecyl oleate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 ZK 159222 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(14:0/22:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 29500 1 1 dolichyl diphosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 phorbol 13-acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(6:0/6:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "28:2(5Z,9Z)(6Br)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11Z-Heptacosene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-acetylsphingosine 1-phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(16:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+)-18-Hydroxy-7,16-sacculatadiene-11,12-dial" 1 1 1 111027 1 35951 1 86510 1 1 1 1 1 1 1 35944 26555 6610 1 1 "PE(12:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 pregnan-21-al 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(18:2(9Z,12Z)/0:0)" 1 1 1 1 1 1 24590 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22R)-22-hydroxy-24,25,26,27-tetranorvitamin D3 / (22R)-22-hydroxy-24,25,26,27-tetranorcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DAT(19:0/23:0(2Me[S],3OH[S],4Me[S],6Me[S]))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 182226 1 1 1 "PI(18:0/22:5(4Z,7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4-oxo-9Z,11Z,13E,15E-octadecatetraenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Palmitoyllysophosphatidylcholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Allylestrenol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(8Z,d18:1) sphingosine" 10526 1 1 1 1 1 1 1 1 529970 1 1 1 1 1 1 6863929 1 1 1 "11beta,17alpha,21-trihydroxypregnenolone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 319503 1 1 1 1 1 10-HpODE 1 1 1 1 1 1 123124 36153 1 1 1 1 1 1 1 1 1 1 1 1 "16:4(4Z,7Z,10Z,13Z)" 1 1 1 16297 1 1 1 1 1 534886 703410 1 1 543684 2059724 1 1 1 1 1 PI(17:0/22:0) 1 1 1 1 1 1 128956 1 1 1 1 1 1 1 1 1 212699 1 1 1 DG(P-14:0/18:1(9Z)) 1 298078 1 1 1 292942 1 1 373722 341997 1 1 225401 1 1 1 1 1 1 1 "PG(18:4(6Z,9Z,12Z,15Z)/0:0)" 1 1 1 1 1 1 69597 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/19:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Xeniasterol-a 1 88853 1 1 1 1 1 1 1 1 1 1 250292 1 1 1 1 1 1 1 "36:6(5Z,9Z,12Z,15Z,18Z,21Z)(34Me[S])" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-oxoglycyrrhetinic acid 341847 259799 78505 24103 215867 242721 1 1 171610 1 1 1 209292 214921 1 1 1 1 1 1 GlcN?1-6Ins-1-P-Cer(t18:0/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3Z-Undecene-5,7,10-triynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(13:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 15134 1 1 1 1 1 1 1 NeuAcalpha2-8NeuAcalpha2-3Galbeta1-4Glcbeta-Cer(d18:1/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16846 1 1 "PI(18:2(9Z,12Z)/0:0)" 1 1 245138 74415 1 606127 1 188600 1 407062 1286936 1 688184 733082 1 1 1 1 1 1 "TG(12:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "15-deoxy-?-12,14-PGJ2-d4" 1 53374 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16:0-Glc-Stigmasterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(17:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Sacculatal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-glyceryl-6-keto-PGF1? 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/18:0/22:0)[iso6] 1 1 1 19608 1 1 22739 1 1 1 45326 27157 1 1 1 24404 1 1 1 1 "GPA(18:0/20:4(5Z,8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-18:0/13:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Hydroxy-24-keto-octacosanolide 1 1 52724 63473 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Amurensisin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-12:0/0:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(13:0/16:0/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hexandraside C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(18:0/22:5(4Z,7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d14:1(4E)/26:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 162614 180334 1 1 1 1 "Cer(d14:2(4E,6E)/22:1(13Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 151342 1 1 "2',4'-Dihydroxy-6'-methoxy-3'-prenylchalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20S)-1?,20,25-trihydroxy-26,27-diethylvitamin D3 / (20S)-1?,20,25-trihydroxy-26,27-diethylcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 9767 10789 1 1 "10,12-hexadecadienal" 1 1 1 1 13279 1 36538 14723 1 1 436905 18997 1 1 1 11885 1 1 1 1 Caloxanthin sulfate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Solavetivone 1 1 1 1 1 1 1 1 12615 1 1 1 1 1 1 1 1 1 1 1 "PS(22:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-cis,6-cis-farnesyl diphosphate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(18:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acacetin 7-[2'''-(2-methylbutyryl)rutinoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Amphotericin B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Spruceanol 1 1 1 1 1 1 1 1 25231 1 1 1 1 1 1 1 1 1 1 1 Astaxanthin diglucoside/ Astaxanthin ?-D-diglucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(19:0/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10530 1 1 1 Ceriporic acid C 1 1 89963 139533 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(21:0/22:1(13Z)/0:0)[iso2] 332344 38022 1 1 607793 689142 1 1 1063956 989106 1 143679 490910 1224650 1 183259 1 1 1 1 "PA(P-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 33448 408005 383353 1 18427 386770 764784 1 1 1011183 777967 29778 1 1059783 827032 1 1 1 1 (R)-Stearoylcarnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15021 1 1 PA(12:0/15:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+)-2-Sterpurene-6,12,15-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(17:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(12:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/14:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-hexadecanyl-2-(8-[3]-ladderane-octanyl)-sn-glycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Enunicelline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "24a,24b-epoxy-23-tetradehydro-24a,24b-dihomo-1?,25-dihydroxyvitamin D3 / 24a,24b-epoxy-23-tetradehydro-24a,24b-dihomo-1?,25-dihydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(10R)-1?,19,25-trihydroxy-10,19-dihydrovitamin D3 / (10R)-1?,19,25-trihydroxy-10,19-dihydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Abieslactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "24,24-difluoro-1?,25-dihydroxy-24a-homovitamin D3 / 24,24-difluoro-1?,25-dihydroxy-24a-homocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(t20:0/24:0(2OH)) 516696 503889 1 1 365316 370953 1 1 247752 274829 1 1 406916 450481 1 1 1 1 1 1 "(9Z,12Z)-octadeca-9,12-dien-6-ynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Kaempferol 3-[2''',3''',4'''-triacetyl-alpha-L-arabinopyranosyl-(1-6)-glucoside]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GPSer(16:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(14:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22E)-(24R)-1?,24,25-trihydroxy-22,23-didehydrovitamin D3 / (22E)-(24R)-1?,24,25-trihydroxy-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-O-(Glcb)-6-O-(Glcb)-(25R)-5alpha-spirostan-3beta,6alpha,23S-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(20:0/22:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(20:4(5Z,8Z,11Z,14Z)/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(17:0/22:4(7Z,10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "15:6(2Z,4E,6Z,8E,12E,14)(6Me,8Me,10Me[S],13Me)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(19:0/22:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DGTA(18:1/22:4(10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(14:0/22:1(11Z)) 1 538961 371838 1 369748 361225 878281 1 486303 326119 1 1 1 346866 1 1 1 1 1 1 Butyryl-L-carnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "7,7-Difluoro-8Z-dodecenyl acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(4OH,8Z,t18:1) sphingosine" 115378 114361 458345 48602 152988 75598 54289 1 678912 482283 274788 116186 90556 459869 229056 22608 1 1 1 1 PGF2?-11-acetate methyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 203065 1 1 1 1 1 "24-Nor-5beta-chol-22-ene-3alpha,7alpha,12alpha-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(25S)-5alpha-cholestan-3beta,6beta,15alpha,16beta,26-pentol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "13,14-dihydro PGF2?" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(20:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17851 1 1 1 PG(15:0/0:0) 461396 467609 1 1 346774 339167 216925 155005 261131 313759 1 1 375845 423039 1 1 1 1 1 1 C-2 Ceramide 1 1 1 1 1 1 1 1 1 1 49207 1 1 1 1 1 1 1 1 1 "12-oxo-14,18-dihydroxy-9Z,13E,15Z-octadecatrienoic acid" 19879 1 1 1 1 1 12534 1 1 1 1 54341 1 13075 1 59783 1 1 1 1 "LysoPE(0:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Afzelechin 4'-O-beta-D-glucopyranosdie 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Formononetin 7-O-rutinoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4,6-trimethyl-2,15-tetracosadienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2E,4E)-nona-2,4,-dienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:1/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-(9R-(15Z-docosenoyloxy)-3-methyl-2Z-decenoyloxy)-ethanesulfonic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/20:1(11Z)) 291299 241018 13217 17828 250787 241882 50298 1 186706 190439 1 1 1 255353 1 1 1 1 1 1 PG(P-20:0/19:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-oleoyl threonine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPE(0:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 118035 1 1 1 "12,13-dihydroxy-11-methoxy-9-octadecenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d14:1(4E)/20:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galalpha1-3Galbeta1-4Glcbeta-Cer(d18:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11-methoxy-12,13-epoxy-9-octadecenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dehydroergosterol 256952 1 1 1 1 1 309378 1 178384 1 1 562400 182566 213944 401287 421923 1 1 1 1 CoA(18:0(3OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "CL(1'-[22:1(13Z)/22:1(13Z)],3'-[22:1(13Z)/14:1(9Z)])[rac]" 1 1 1 1 1 1 1 798247 1 1 1 1 1 1 1 1 1 1 1 1 11-deoxy-PGF1? 1 1 1 1 1 19319 1 1 1 1 1 68930 1 1 1 1 6748 1 1 1 PA(17:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11,12-dihydroxy arachidic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(17:0/0:0) 1 1 1 1 1 1 1 1 1 1 94655 1 1 1 1 1 1 1 1 1 "PS(17:2(9Z,12Z)/0:0)" 1 1 1 1 1 1 35894 1 1 1 1 1 1 1 1 1 1 89489 1 1 "LysoPC(20:4(5Z,8Z,11Z,14Z))" 1 1 1 87294 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arachidonoyl Ethanolamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-12:0/O-2:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-O-alpha-D-glucopyranosyl-(2-hexadecanoyloxy)-eicosan-1-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Palmitoylcarnitine 1 1 1 1 1 1 1 1 1 1 1 110188 1 1 1 95743 1 1 1 1 "PG(13:0/18:3(6Z,9Z,12Z))" 1 1 165879 195823 1 1 232114 1 1 1 1 1 1 1 293217 143601 1 1 1 1 "PA(21:4(6Z,9Z,12Z,15Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(O-16:0/13:0) 1 1 1 1 1 1 216210 1 1 1 1 1 1 1 57174 1 288627 267214 1 1 PI(O-18:0/19:1(9Z)) 1 1 1 104090 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2',4',6',3,4-Pentahydroxy- 3',5-diprenyldihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(1R,2R)-3-oxo-2-pentyl-cyclopentanehexanoic acid" 1 1 1 1 1 1 1 1 1 1 24529 1 1 1 1 1 19477 1 1 1 PC(10:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 54:3 SLBPA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Syriacin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(24RS)-28,28,28-trifluoro-25-hydroxyvitamin D2 / (24RS)-28,28,28-trifluoro-25-hydroxyergocalciferol" 1 1 1 1 1 1 302598 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:2/20:1) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Brosimacutin H 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(13:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hildgardtene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galalpha1-3(Galbeta1-4GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(12:0/17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1143027 1 1 1 Vitamin K2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "10-nitro,9Z,12Z-octadecadienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "cholest-5,24-dien-3beta-ol 3-O-beta-D-glucopyranoside" 1 1 70613 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CerP(d18:1/26:0) 1 1072609 1 1 3149404 481863 1 1 908849 19635 1 1 769257 830821 1 1 1 1 1 1 (R)-10-hydroxystearic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Isomyristic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2alpha,7beta,15beta,18-tetraacetoxy-cholest-5-en-3alpha-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-2,7-Dolabelladiene-6beta,10alpha,18-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(10:0/21:0) 1 1 1 1 1 1 1 1 1 1 32740 1 1 1 1 1 1 1 1 1 "TG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 53216 45251 1 1 1 1 1 1 1 1 1 1 1 14420 1 47445 1 1 PA(P-16:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Methyl-undecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (S)-3-hydroxyhexacosanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 24065 1 1 1 Lespedezaflavanone F 1 1 2454311 1 1 1 2819475 1 1 1 1 1 1 1 1 1 1 1 1 1 Kaempferol 3-(6''-malonylglucoside)-7-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/16:0/22:0)[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 geodisterol-O-sulfite 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (Z)-7-Dodecenyl butyrate 1 1 1 1 1 1 1 1 1 1 1 17961 1 1 1 1 15219 1 1 1 (+)-Isostearic acid 1 1 1 40133 1 1 1 1 1 1 1 56967 1 1 1 1 1 1 1 1 "(22R)-1?,22,25-trihydroxy-23,24-tetradehydro-24a,24b-dihomo-20-epivitamin D3 / (22R)-1?,22,25-trihydroxy-23,24-tetradehydro-24a,24b-dihomo-20-epicholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(17:1(9Z)/0:0) 666531 301421 294655 271805 57915 1 1 1 1 78798 1 1 404390 28648 216465 1 1 1 1 1 "TG(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 220874 1 1 1 1 1 1 1 1 1 1 1 1 1 43447 1 1 27-Norcholestanehexol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 45354 1 1 1 1 "(23S)-1?-hydroxy-25,27-didehydrovitamin D3 26,23-lactone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 OH-Demethylspheroidenone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-decene-4,6,8-triyn-1-al" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(14:0/0:0) 1 38887 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(19:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/20:1(11Z)) 1 1 1 1 1 1 79857 64134 1 1 1 1 1 1 1 1 1 1 1 1 antioside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9,11alpha-epoxypregn-4-ene-3,20-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(19:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 63987 1 1 1 "Hexadecanoic acid, 2,2-difluoro-" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Salvisyriacolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(P-16:0/15:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 hexadecanedioic acid mono-L-carnitine ester 1 1 24135 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5188 1 1 "DG(13:0/20:3(8Z,11Z,14Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25921 1 1 1 "4,4'-dihydroxy-3,5-dimethoxydihydrostilbene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Amijiol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 952329 1 1 1 1 1 "N-(1,1-dimethyl-propyl) arachidonoyl amine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Artocommunol CC 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Dysideapalaunic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5beta-Cholane-3alpha,7alpha,12alpha,24-tetrol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,6-Dimethyl-6-O-beta-D-quinovopyranosyl-7-octadecenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "26,26,26,27,27,27-hexafluoro-1?a-hydroxyvitamin D3 / 26,26,26,27,27,27-hexafluoro-1?a-hydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-20:0/20:3(8Z,11Z,14Z))" 1644527 3985938 2367000 2131338 4127901 3402522 1 717750 4051482 4346055 1130202 921662 4957265 4232323 834057 753480 1 1 1 1 "10,11-dihydro-Resolvin E1" 1 1 69338 1 11971 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(22:4(7Z,10Z,13Z,16Z)/24:1(15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(O-20:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-15:0/O-1:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(18:4(6Z,9Z,12Z,15Z)/P-18:1(11Z))" 1 29380 1 440429 1 48550 704428 1 51532 1 1349837 1 69944 1 1 1 1 1 1 1 PC(14:0/P-18:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(12:0/18:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(P-20:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-oleoyl isoleucine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Amino-3-methylbutanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Ceriferol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5825 1 1 1 Psychosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3S,6R)-9,10-seco-5(10),6,7-cholestatrien-3-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 24-methylene-cholesterol sulfate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-HETE-Gly 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-O-methyl PAF C-16 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-2?-(3-hydroxypropoxy)vitamin D3" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(19:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(P-16:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "26:6(8Z,11Z,14Z,17Z,20Z,23Z)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6-Hydroxycyanidin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl tryptophan 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(18:4(6Z,9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 53581 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuAcalpha2-3Galbeta-Cer(d18:1/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Farfugin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11b,21-Dihydroxy-3,20-oxo-5b-pregnan-18-al" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hydroxyphthioceranic acid (C33) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPC(26:1(5Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avermectin B1b 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(O-16:0/18:2(9Z,12Z))" 585611 293871 351603 1 256655 263325 1 1 506276 477896 1 798283 592244 616197 662328 1 1 1 1 1 NeuAcalpha2-3Galbeta-Cer(d18:1/26:1(17Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 149212 1 1 1 1 1 "(3alpha,5beta,7alpha)-23-Carboxy-7-hydroxy-24-norcholan-3-yl-beta-D-Glucopyranosiduronic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Minabeolide-7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "12,13-Dimethyl-5,14-dioxabicyclo[9.2.1]-tetradeca-1(13),11-dien-4-one" 84364 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CPA(18:1(11Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:2(9Z,12Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Leukotriene F4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NeuAcalpha2-3Galbeta-Cer(d18:1/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "27-nor-24S-methylcholestan-3beta,4beta,5alpha,6alpha,7beta,8beta,14alpha,15alpha,24-nonol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(18:4(6Z,9Z,12Z,15Z)/24:1(15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22:4 Cholesteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2',4'-Dihydroxy-6'-methoxy-3'-(2-hydroxybenzyl)-5'-(3 x 2-hydroxybenzyl)dihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Obscuraminol A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-hydroxy-tetradecanedioic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Ethylpentane 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14-F2-dihomo-IsoP 186898 1 1 1 1 1 1 1 1 1 242818 1 1 1 137938 1 1 1 1 1 (-)-8beta-Presilphiperfolanol 1 100059 1621686 1 429643 130455 1 1 72115 91403 4903794 1 1 33989 1325423 1 1 9618 1 1 "BPG(C20,C20,C20,C20)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 89076 79914 1 1 "PS(18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 96239 1 1 "PG(18:0/22:5(4Z,7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 121584 1 1 16-oxo-heptadecanoic acid 1 1 23692 1 1 1 1 1 1 1 1 1 1 1 31671 1 1 17124 1 1 nuatigenin 3-beta-D-glucopyranoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 884847 1 1 "PC(15:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 73651 1 1 Trillin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1798497 1 1 "(22E)-3alpha,6beta,7beta-Trihydroxy-5beta-chol-22-en-24-oic Acid" 81684 1 157548 1 89926 86381 1 1 1 1 177057 176021 85183 101725 1 1 1 31035 1 1 "PI(17:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 133250 1 1 "PI(O-18:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 525002 1 1 LysoPC(22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17441 1 1 "(16,16-dimethyldocosa-cis-5,8,11,14-tetraenoyl) ethanolamine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 154806 1 1 "PG(16:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 38363 1 1 1-Octacosene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6088 1 1 14-Methylpentadecyl isobutyrate 1 1 13893 1 1 1 1 1 1 1 1 1 1 1 1 1 1 32818 1 1 Rapamycin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13373 1 1 "PC(14:1(9Z)/20:2(11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 157883 1 1 "TG(15:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 66634 1 1 Alatanin 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6477 1 1 PI(O-20:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7702 1 1 "7-Octenoic acid, 5-oxo-" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8820 1 1 "PS(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8752054 1 1 "(22E)-26,26,26,27,27,27-hexafluoro-25-hydroxy-22,23-didehydrovitamin D3 / (22E)-26,26,26,27,27,27-hexafluoro-25-hydroxy-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6321 1 1 "(E)-3,7-Dimethyl-2,6-octadienyl hexanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14686 1 1 25-hydroxy-3-deoxy-2-oxavitamin D3 / 25-hydroxy-3-deoxy-2-oxacholecalciferol 1 1 1 1 1 1 1 1 1 1 300280 1 1 1 1 1 1 90370 1 1 Cer(d14:1(4E)/24:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 180998 118304 1 1 Falcarinol 1 1 1 30917 1 1 1 1 1 1 1 1 1 1 1 1 1 59320 1 1 Galalpha1-3Galalpha1-3Galalpha1-3Galalpha1-3Galalpha1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31635 1 1 "PG(18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 116324 1 1 PS(15:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10144 1 1 SM(d17:1/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 39607 1 1 "1?-hydroxy-24-(dimethylphosphoryl)-25,26,27-trinorvitamin D3 / 1?-hydroxy-24-(dimethylphosphoryl)-25,26,27-trinorcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 46456 1 26116 1 1 PG(14:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2848984 1 1 38319 1 1 "GPCho(18:2(2E,4E)/O-18:0)[U]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 490043 458875 1 1 20:0-Glc-Sitosterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21085 1 1 PC(0:0/5:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31577 23731 1 1 "DG(12:0/22:2(13Z,16Z)/0:0)[iso2]" 1 1 1 1 28758 1 1 1 1 1 1 1 1 1 1 1 150851 132597 1 1 MfGL-II 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 74934 1 1 PC(3:0/3:0) 1 1 92859 87085 1 1 1 78394 1 1 71978 73964 1 1 67005 65584 1 85387 1 1 "(9Me,4E,8E,10E-d19:3)sphingosine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 33247 1 1 1598420 1640167 1 1 24675 144612 1943046 1621899 511207 32727 1344532 1140012 1 1 1 1 (-)N-(1R-methyl-propyl) arachidonoyl amine 1 1 1 1 1 1 1 1 1 1 1 101240 1 1 1 140014 1 1 1 1 (±)N-(1-methyl-2-hydroxy-2-phenyl-ethyl) arachidonyl amine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(O-18:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(10:0/16:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-16:0/20:5(5Z,8Z,11Z,14Z,17Z))" 90615 1 566306 508578 1 1 55610 99770 1 1 858373 1 1 1 741544 61424 1 1 1 1 "PE(16:0/22:6(54Z,7Z,10Z,12E,16Z,19Z)(14OH))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22:1-Glc-Stigmasterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(12:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3'-O-methylbatatasin III 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,1 6,19-Docosahexaenoic acid" 1 1 1 1 14764 18142 1 1 1 1 1 1 1 1 1 1 20889 1 1 1 6-dehydrotestosterone 17-glucosiduronic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,2,4-Trimethyl-6-(1-oxo-3-phenylpropyl)-1,3,5-cyclohexanetrione" 1 1 1 1 1 1 1 1 1 1 1 1 22104 1 1 1 11926 1 1 1 PG(O-16:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hydrocortisone caproate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "13-tetradecen-2,4-diyn-1-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-2-Hexenyl 2-methyl-(E)-2-butenoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Amino-4-methylpentanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)7-epi Jasmonic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Tambulin 3,5-diacetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Catechin-4-ol 3-O-beta-D-galactopyranoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sphingofungin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-nonene-4,6,8-triynal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-O-methyl PAF C-18 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 cimicifoetiside A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 794180 1 1 1 PE(O-20:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(12:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 30-hydroxy-triacontanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,2-Dimethyl-3-butenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 33085 1 1 1 1 1 "6E-Octene-2,4-diynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arachidonoylmorpholine 1 1 1 1 1 1 568020 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,7-Dimethoxy-8-prenylflavan" 1 1 28420 1 1 1 50079 43672 1 1 76226 82597 1 1 1 81103 1 1 1 1 Avermectin A2a 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-O-[(6'-O-tetradecanoyl)-a-D-glucopyranosyl]-(2-tetradecanoyloxy)-eicosan-1-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 methyl 4-[2-(2-formyl-vinyl)-3-hydroxy-5-oxo-cyclopentyl]-butanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 9181 1 1 1 "(22E,24E)-1?,25-dihydroxy-22,23,24,24a-tetradehydro-24a-homovitamin D3 / (22E,24E)-1?,25-dihydroxy-22,23,24,24a-tetradehydro-24a-homocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-[5]-ladderane-dodecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MG(18:0/0:0/0:0)[rac] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(3-oxo-hexanoyl)-homoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(14:0/22:5(4Z,7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)-2-Methylbutyric acid 3.23E+07 3.22E+07 4.22E+07 2.91E+07 3.25E+07 5.41E+07 4.61E+07 2.73E+07 5.69E+07 4.98E+07 4.71E+07 2.55E+07 5.33E+07 5.45E+07 7.05E+07 5.66E+07 1 1 1 1 "24-ethyl-5alpha-cholest-25-en-3alpha,12alpha,16alpha-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Vitamin D3 butyrate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-hydroxyjasmonic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Neoquassin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/18:0/22:2(13Z,16Z))[iso6]" 5095372 4947322 963655 1541048 4361162 4805128 2744142 2148822 30338 4672260 490923 1666947 3480761 4695223 216705 1493105 1 1 1 1 Malonylmalvin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Methyl jasmonate 1 1 1 1 1 1 1 1 1 1 13301 1 1 1 1 1 1 1 1 1 "PE(20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,5,8,3'-Tetramethoxy-6,7:4',5'-bis(methylenedioxy)flavone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (3R)-3-isopropenyl-6-oxoheptanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,5,2'-Trihydroxy-7,8,4'-trimethoxyflavone 5-glucosyl-(1-2)-galactoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-amino-8-oxo-9,10-epoxy-decanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl nonanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18:1 Stigmasteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-HETE-G 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+/-)-2,16,16-trimethyl-5,8,11,14-all-cis-tricosatetraenoyl-2'-fluoroethylamine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 196741 1 1 1 1 3-O-(2-O-(2E-decenoyl)-alpha-L-rhamnopyranosyl)-3-hydroxydecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-2-Butenyl butyrate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-Tridecen-2-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPC(20:3(5Z,8Z,11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "16-Glutaryloxy-1?,25-dihydroxyvitamin D3" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Isoscoparin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22-epi-Hippurin-1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4'-Hydroxy-4-(4-hydroxystyryl)-5,7-dimethoxyflavan" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(20:3(8Z,11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22:1-Glc-Sitosterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 83806 1 1 1 Cholestanyl glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(13:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(18:1(11Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sphingosylphosphoryl choline 1 1 1 1 1 1 1 148019 1 1 1 1 1 1 322485 1 1 1 1 1 "PI(16:0/22:5(4Z,7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 28164 1 1 1 Tephrowatsin B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2E,4E,6E-Nonatrienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "N,N-dimethyl-Safingol" 1 143660 1 1 1 1 1 1 1 69779 1 1 1 1 1 1 1 1 1 1 "18-fluoro-9Z,12Z-octadecadienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-oleoyl glutamic acid 1 1 1 1 1 1 206800 1 1 1 1 1 1 1 1 1 1 1 1 1 N-stearoyl tyrosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(15:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(17E)-1?,25-dihydroxy-26,27-dimethyl-17,20,22,22,23,23-hexadehydro-24a-homovitamin D3 / (17E)-1?,25-dihydroxy-26,27-dimethyl-17,20,22,22,23,23-hexadehydro-24a-homocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 20:1 Campesteryl ester 1 1 23951 1 1 1 1 1 1 1 1 64968 1 1 1 1 1 1 1 1 Glycocholic Acid 585809 557393 1 345062 384526 1 346092 239568 326583 1 1 1 534920 588223 1 1 1 1 1 1 Pectolinarigenin 7-(4'''-acetylrutinoside) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(3-oxo-octanoyl)-homoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-dinor, 6-keto-PGF1?" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(t18:0/20:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,13-Dihydroxy-herbertene" 20670 1 22367 14374 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(12:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galalpha1-4Galbeta-Cer(d18:1/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "cis-5,8,11,14-eicosatetraynoyl ethanolamide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "15R-PGA2 methyl ester, 15-acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lithocholic acid glycine conjugate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(16:0e/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2',6'-Dimethoxy-3',4'-methylenedioxydihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Tetracosene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Hexadecanoic acid, 16-iodo-; omega-Iodohexadecanoic acid; 16-Iodohexadecanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Demissidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Brosimacutin C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(15:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(9R,13R)-10,11-dihydro-12-oxo-15-phytoenoic acid" 1 1 1 1 87588 1 1 169510 1 1 1 1 1 1 1 1 1 1 1 1 "PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9,10-dihydroxy-13-hydroperoxy-11-octadecenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-16:0/13:0) 1 1 1 1 1 1 1 1 1 1 1 98891 1 1 1 1 1 1 1 1 1-Dodecene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7-O-Methyllicoricidin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/16:1(9Z)) 1 1 3274206 1979825 1 1 1 3501675 1 1 5329118 3754947 1 1 4056866 3066948 1 1 1 1 PS(21:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 20527 1 1 1 PG(12:0/19:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl methionine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25243 1 1 1 1 1 "PI(P-20:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-6:0/0:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "32:4(17Z,20Z,23Z,26Z)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(2-fluro-ethyl) arachidonoyl amine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-deoxy-11-methylene-PGD2 1 1 1 1 1 1 1 1 1 1 1 1 91031 1 1 1 1 1 1 1 PI-Cer(d18:0/18:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(13:0/20:2(11Z,14Z)/0:0)[iso2]" 1 1 109965 21894 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Undecan-1-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avermectin B2a 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(14:0/0:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(6-aminohexanoyl)-6-aminohexanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CPA(18:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "12-oxo-5E,8E,10Z-heptadecatrienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Stigmastanyl glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,4'-Dimethoxyfurano[2,3:7,8]flavone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(22:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(9E-Hexadecenoyl)-sn-glycero-3-phosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DL-2-amino-octanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-hydroxy-tetradecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Cer(d14:2(4E,6E)/20:1(11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/20:0) 81112 1 1 1 1 1 1 1 1 1 1 1 1 73296 1 1 104248 1 1 1 11-dehydro-TXB3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6-Hydroxypelargonidin 3-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Doxycycline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-stearoyl tryptophan 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(25R)-5alpha,6alpha-epoxy-24R,26R-dimethyl-26,27-cyclo-cholestan-3beta-ol" 1 1 59567 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5-hydroperoxy-7-[3,5-epidioxy-2-(2-octenyl)-cyclopentyl]-6-heptenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-O-(beta-D-galactopyranosyl-(1-6)-beta-D-galactopyranosyl) 2S,3R-dihydroxyundecanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(21:0/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(10:0/10:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tricosanedioic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(6-[3]-ladderane-hexanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphoethanolamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,6Z,9Z-Heptadecatriene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/19:1(9Z)) 1860200 1 2383872 1851262 1 1 1 1 1 1 1 1687978 1 1 1 1 18427 1 1 1 Paclitaxel 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (5E)-isovitamin D2 / (5E)-isoergocalciferol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(12:0/12:0/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 18-acetoxy-1?-hydroxyvitamin D3 / 18-acetoxy-1?-hydroxycholecalciferol 1 1 1 1 1 1 1 1 1 42957 1 1 1 1 1 1 1 1 1 1 "TG(20:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydrocordoin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(P-18:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 fumagillin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(15:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Prosopinine 22947 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LPA(0:0/18:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7579 1 1 1 Catechin 5-O-beta-D-glucopyranoside-4'-Me 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Peonidin 3-galactoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(14:1(9Z)/24:1(15Z)) 1 1 1 1 1 1 1 182843 1 1 1 1 1 1 1 1 1 1 1 1 "(22E)-1?-hydroxy-24-oxo-26,27-cyclo-22,23-didehydrovitamin D3 / (22E)-1?-hydroxy-24-oxo-26,27-cyclo-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Euchrenone b3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Mucronulatol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Asbestinine 2 1 1 1 1 1 1 324664 1 1 1 1 1 1 1 1 1 1 1 1 1 Acacetin 7-(2''-acetylglucoside) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2',4'-Dihydroxy-5,6-methylenedioxy-2-phenylbenzofuran" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (1R)-25-hydroxy-1-(hydroxymethyl)vitamin D3 / (1R)-25-hydroxy-1-(hydroxymethyl)cholecalciferol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-14:1(1E)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11E-Eicosen-1-ol 1 1 1 1 1 1 1 1 1 1 1 41001 1 1 1 1 1 1 1 1 "PC(20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Clavepictine B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Salviadelphin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Artomunoxanthentrione 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(14:0/22:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "15-Octadecene-9,11,13-triynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "26,27-dinor-cholest-5-en-23-yn-3beta-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(24R)-1?,24,25-trihydroxyvitamin D2 / (24R)-1?,24,25-trihydroxyergocalciferol" 1 41649 1 1 58185 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(O-16:0/20:2(11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "CoA(20:2(8Z,11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "5,8,11,14-all-cis-docosatetraenoylethanolamine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 919315 1 1 1 PG(16:0/0:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9,11alpha-epoxy-6alpha-acetoxy-cholest-7-en-3beta,5alpha,19-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(19:3(10Z,13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DHA (d5) 1 1 1 1 1 1 1 1 1 1 1 1 30369 1 1 1 1 1 1 1 "5beta-Cholane-3alpha,12alpha,24-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(5:0/5:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8-Dimethylallyllisetin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d15:1/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Linoleyl palmitate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Methoxyphaseollidin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,13-Tetradecadien-3-one" 1 1 1 1 1 12800 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Halaminol A 1 1 1 1 1 30405 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(13:0/18:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Salinixanthin/ 1',2'-Dihydro-1',2'-dihydroxy-4-ketotorulene 1'-glucoside ester" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 all-trans-Nonaprenyl diphosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 alpha-curcumene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 20:2-Glc-Campesterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(O-20:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 pregnan-21-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(17E)-1?,25-dihydroxy-17,20-didehydro-21-norvitamin D3 / (17E)-1?,25-dihydroxy-17,20-didehydro-21-norcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Tetradecene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Limocitrol 3-[alpha-L-arabinopyranosyl-(1-3)[galactosyl-(1-6)]-galactoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "alpha,4,2'-Trihydroxy-4-O-geranyldihydrochalcone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(8-[3]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 335572 1 1 1 3beta-Acetoxy-4-oplopanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22:2-Glc-Stigmasterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Citraconic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11?-Hemiglutaryloxy-1,25-dihydroxyvitamin D3" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-dihydrostilbene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Theonellasterol B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LTB4-d4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(20:4(5Z,8Z,11Z,14Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Carvone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15-oxo-18Z-tetracosenoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 58233 1 1 1 1 1 "DAT(16:0/23:0(2Me[S],3OH[S],4Me[S],6Me[S]))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 49941 1 1 1 Cucurbitacin S 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 205850 1 1 1 PG(21:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 36660 1 1 1 TG(13:0/22:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 20380 1 1 1 1(3)-glyceryl-PGF2? 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6849 1 1 1 "PG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 7901066 1 1 1 2-hydroxy caproaldehyde 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14654 1 1 1 "3,4-Dimethoxylonchocarpin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15215 1 1 1 (20S)-3beta-Hydroxy-5alpha-cholan-24-oic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1270490 1 1 1 "TG(15:0/22:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31241 1 1 1 "PS(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13004 1 1 1 "TG(17:0/22:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 21433 1 1 1 Erucicoyl-EA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12727 1 1 1 "PC(18:2(9Z,12Z)/24:1(15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 120340 1 1 1 PS(16:0/22:1(11Z)) 1 1 1 209780 1 1 1 117136 1 1 1 1 1 1 1 1 33892 1 1 1 "TG(15:0/22:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31859 1 1 1 "1,1,2,3-tetramethylcyclohexane" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5914 1 1 1 "(22R)-1?,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-24a-homo-20-epivitamin D3 / (22R)-1?,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-24a-homo-20-epicholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 542619 1 1 1 6-Methylsalicylic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11405 1 1 1 "TG(12:0/22:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 24811 1 1 1 "(4E,8E,10E-d18:3)sphingosine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17785 1 1 1 PC(8:0/5:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 438717 1 1 1 "DG(16:0/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 228026 1 1 1 "1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(butyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Boviquinone 4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 decanamide 1 1 1 1 1 1 1 1 1 1 1 19723 1 1 1 1 1 1 1 1 11-Hydroxytephrosin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-O-Methylmelleolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 L-Gizzerosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Blumenol C O-[rhamnosyl-(1-6)-glucoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3R,7R)-1,3,7-Octanetriol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3'-N-Acetyl-4'-O-(10,12-octadecadienoyl)fusarochromanone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cadiamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Piperidinecarboxaldehyde 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Ile Ile 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Crocin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Eicosanol 1 1 1 1 1 1 1 1 1 1 22808 32536 1 1 1 1 1 1 1 1 "PS(P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(S)-(-)-N,alpha-Dimethylbenzylamine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 HA-1077 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Aminoacridone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Kestose 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Perlolyrine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3beta,9beta)-7-Drimene-3,11,12-triol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oxidized Cypridina luciferin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-alpha-D-Glucosyl-D-glucose 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(3-Oxododecanoyl)homoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Coniine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lupanyl Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 n-Pentadecylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Asn Gln 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Hygroline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Anastrozole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 His Phe Pro 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Irbesartan 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Miraxanthin-III 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ozagrel 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(2-Pyrimidyl)piperazine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,8 dimethylnonanoyl carnitine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dinitrosopentamethylenetetramine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-Acetoxy-3-geranylgeranyl-1,4-dihydroxybenzene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cys His Lys 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(8-[3]-ladderane-octanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Ser Ser 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PtdIns-(1-arachidonoyl, 2-arachidonoyl-d8)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 beta-Skytanthine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Diaminomethylpteroic acid (DAMPA) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(1S,2S,4R)-p-Menth-8-ene-1,2,10-triol 2-glucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+)-2,5-epi Goniothalesdiol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Zwittermicin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPC(22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(6-[5]-ladderane-hexanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol) 1 1566050 1 1 1 618119 1 1 1 1 1 1 1644010 1 1 1 1 1 1 1 17-phenyl trinor Prostaglandin E2 serinol amide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Chloro-4-(dichloromethyl)-5-hydroxy-2(5H)-furanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Stearyl citrate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Biliverdin IX 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(18:4(6Z,9Z,12Z,15Z)/13:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tecostanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "12-Methoxy-4,4-Bisnor-5?-8,11,13-Podocarpatrien-3-Ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 [6]-Dehydroshogaol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Chromafenozide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d18:0/20:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Asp Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Adenine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Dilauryl 3,3'-thiodipropionate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(5-Acetyl-2-hydroxyphenyl)-3-methyl-1-butanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tridodecylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glucosyl (2E,6E,10x)-10,11-dihydroxy-2,6-farnesadienoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Aldosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3R,8E)-3-Hydroxy-5,8-megastigmadien-7-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pirimicarb 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nb-Palmitoyltryptamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nandrolone phenpropionate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CerP(d18:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Methoxycinnamoyloleanolic acid methyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ipecac (Emetamine) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Thiocarlide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pleurostyline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(20:5(5Z,8Z,11Z,14Z,17Z)/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arjunolic acid 3-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Methyldioctylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-(9H-Pyrido[3,4-b]indol-1-yl)-1,4-butanediol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25-Cinnamoyl-vulgaroside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Clupanodonyl carnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fexaramine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acrifoline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Trilobolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Aminocyclobutane Carboxylic Acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,1'-[1,12-Dodecanediylbis(oxy)]bisbenzene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Aspidoalbine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Polidocanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(P-20:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Melatonin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Kifunensine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glyodin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CAY10568 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(1R,4R,5S)-5-Hydroxyfenchone glucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Arg Gln 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(1-Pyrrolidinyl)-2-propanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydroceramide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Eudesmin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-di-(9Z,12Z-octadecadienoate) 3-(9Z-octadecenoate)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn Ile Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Melilotoside B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gabapentin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(18:4(6Z,9Z,12Z,15Z)/24:1(15Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ethyl aconitate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydroceramide C2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TGX-221 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydroaceanthrylene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Prostaglandin F2?-biotin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Momordicoside D 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d18:2/15:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Hexadecylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 His Lys Met 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-16:0/20:2(11Z,14Z))" 6755765 1454563 2690199 4272366 7982422 6791961 1.01E+07 3441770 4286652 4874180 8375500 2314244 7474971 7236321 6850285 3342926 1 1 1 1 All trans decaprenyl diphosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12-HETE-GABA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Octylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Halstoctacosanolide A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Monopalmitin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/14:0/22:1(11Z))[iso6] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(10:0/16:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Palmitic amide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Digitoxigenin 3-[glucosyl-(1-6)-glucosyl-(1-4)-2,6-dideoxyribohexoside]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Palmitoyl-2-(5-hydroxy-8-oxo-6-octenoyl)-sn-glycero-3-phosphatidylcholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fluocinolone acetonide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Xestoaminol C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Amino-2-p-toluidinobenzenesulfonic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17a-Aza-D-homoandrost-5-en-3beta-ol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cloversaponin I 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9,11-methane-epoxy PGF1?" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Baliospermin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3,2',3'-Tetrakis(3-hydroxytetradecanoyl)-D-glucosaminyl-1,6-?- D-glucosamine 1-phosphate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Succinylcholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avermectin B1a monosaccharide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Di(2-pyridyl)ethylene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Isobutanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Carmamycin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 32120 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-dihexadecanoate 3-(9Z-octadecenoate)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 agavoside A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13E-Docosenamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydro Isorescinnamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nonoxynol-9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Austalide G 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Demethylcitalopram 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 alpha-Antiarin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PIP(16:1(9Z)/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dodecylphosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Butoctamide hydrogen succinate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2''-(6-Acetylglucosyl)astragalin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 2,3-di-(9Z-octadecenoate) 1-hexadecanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Methylchrysene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3beta,22R,23R,24S)-3,22,23-Trihydroxystigmastan-6-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 9-Aminoacridine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)-2-(2-Furanyl)pyrrolidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gln Gln Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ssioriside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn Asn Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 RO 40-5966 (Methylmibefradil Metabolite) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Drospirenone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d20:0/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPC(18:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fluconazole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-(2-Pyrazinylethenyl)phenol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Devazepide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5?-Deoxy-5?-(methylthio)adenosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pipericine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dropropizine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Citronellyl beta-sophoroside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ouabain 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Formyl-4-amino-5-aminomethyl-2-methylpyrimidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bis-(4-cyanophenyl)-methanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,2-Dimethyl-3,4-bis(4-methoxyphenyl)-2H-1-benzopyran-7-ol acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Isopentylideneisopentylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Purine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acetyl Tyrosine Ethyl Ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Antimycin A1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Thiopental 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glaucarubin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2?-Fluoro-19-nor-22-oxa-1?,25-dihydroxyvitamin D3" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Red chlorophyll catabolite 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(19:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,7,8,15-Scirpenetetrol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Norharman 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Evasterioside C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 14-Dihydroxycornestin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Uscharidin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(13:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3beta,22E,24R)-Ergosta-4,6,8(14),22-tetraen-3-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Polypropylene glycol (m w 1,200-3,000)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bifonazole 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-Hydroxy-6,8-dimethoxy-7(11)-eremophilen-12,8-olide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dimethylpentylamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cyclopamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Phe Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Trp Tyr Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gentamicin X2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (S)-5'-Deoxy-5'-(methylsulfinyl)adenosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Deoxyhypusine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Triciribine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ferimzone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glu His Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(d18:0/18:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Slaframine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,28-Dicaffeoyloctacosanediol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(t18:0/18:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cucurbitacin B 728336 767128 1009007 555454 1113187 1161533 976175 823116 792241 839379 2234057 1480810 1264141 1348185 1 1 1 1 1 1 (+)-Echinoisoflavanone 1 1 1 46278 1 1 30298 1 1 1 19178 28132 1 1 20541 29717 1 1 1 1 "DG(21:0/22:4(7Z,10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 179299 1 1 219089 1 1 1 410813 1 1 1 386744 1 1 1 1 1 "(20R)-17alpha,20-dihydroxycholesterol" 1 1 1 1 1 1 174963 243603 1 1 213842 73872 1 1 1 1 1 1 1 1 1-(8-[3]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphoethanolamine 5761196 1633937 3.11E+07 349741 2056857 4.20E+07 1277540 3386994 1.90E+07 383675 1.67E+07 9024337 6996304 2122567 4.37E+07 4183368 1 1 1 1 Cucurbitacin J 1136131 1034007 2185810 1585388 1077209 1173861 1904399 1824367 1034790 1024357 3659769 2802629 1930260 1962178 1 1 1 1 1 1 GlcCer(d18:0/20:0) 1 1 3246258 2453996 1 1 3308087 915143 1 1 34514 2413654 1 1 1 199209 1 1 1 1 NAGABA 256448 1 1 1 1 1 1 280280 1 1 291364 1 1 1 1 199457 1 1 1 1 "20:2(5Z,9Z)(11Me,15Me,19Me)" 1 1 280283 321304 33601 1 214985 224721 1 1 462589 402736 1 1 242263 226450 1 1 1 1 (+)-Desoxyscalarin 1 1 1 189700 1 1 1 1 1 1 22675 1 1 1 18378 1 1 1 1 1 "PA(O-20:0/17:2(9Z,12Z))" 1 1 1 1 1 1 4977551 2547739 1 1 2624282 605161 1 1 2014221 1888220 1 1 1 1 CPA(16:0) 1 1 1 1 1 1 1 1 1 1 77180 1 1 1 1 1 1 1 1 1 PI(12:0/22:1(11Z)) 4990865 4922621 1807424 1370079 4802624 4542839 2643196 2198720 4739636 4787343 5058255 3054205 3782724 3973480 265148 228521 1 1 1 1 C20 Sulfatide 1 1 1659705 1773924 1 1 20490 1893501 1 1 4451052 2983860 1 1 355524 25014 1 1 1 1 "(24R)-1?,24,25,26-tetrahydroxyvitamin D2 / (24R)-1?,24,25,26-tetrahydroxyergocalciferol" 1 1 100220 238631 1 1 65561 1 1 1 100457 1 1 1 1 219876 1 1 1 1 "PE(O-18:0/17:2(9Z,12Z))" 1 1 91307 104255 1 1 303945 1 1 1 384754 1 1 1 83846 1 1 1 1 1 (E)-2-Octenal 25456 1 1 1 1 1 1 1 1 1 14851 1 1 1 1 1 1 1 1 1 12-HETE-Ala 1 1 83284 149736 16131 144819 121494 158187 1 1 438493 132024 163726 165067 309988 116404 1 1 1 1 PA(O-16:0/21:0) 6989770 313073 751835 6396860 5985606 2013409 7384799 2017948 5838208 323524 1.21E+07 983554 7352204 5724702 3161937 1033016 1 1 1 1 N'-arachidonoyl-N''-diethyl ethylene diamine; N'-arachidonoyl-N''-diethylethylenediamine 1 1 1179339 1323540 1 1 908680 909936 1 1 1596915 1601571 1104016 1 1 870334 1 1 1 1 3-Deoxyvitamin D3 1 1 595831 1 1 1 1 1 1 1 786898 788748 1 1 499201 511931 1 1 1 1 1-(8-[5]-ladderane-octanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine 1 1403668 678631 1 2463497 1 17352 1 1562763 1 117941 1 26572 1 65357 1 1 1 1 1 PI-Cer(d18:0/16:0(2OH)) 1 1 957903 677499 1 1 942454 345392 1 1 745941 98340 1 1 155232 81505 1 1 1 1 PC(16:0/9:0(CHO)) 1 1 1 1 1 1 1 1 1 1 54742 1 1 1 1 1 1 1 1 1 "PG(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 11771 44842 35976 1 1 18697 1 1 1 189214 1 1 1 216463 24157 1 1 1 1 "(20S,22E)-3beta-Hydroxychola-5,16,22-trien-24-oic Acid" 1 1 1 1 1 1 1 1 1 1 18747 1 1 1 1 1 1 1 1 1 LTB4 ethanol amide 1 1 1 1 1 1 1 41348 1 1 24079 1 1 1 1 1 1 1 1 1 PC(20:0/P-18:1(11Z)) 1 1 440841 1492107 1 1 771163 390356 346613 1 749996 55003 1 516236 1909737 166281 1 1 1 1 alNAcbeta1-4(NeuGcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/18:0) 1 1 1 1 1 1 1 1 1 1 29241 1 1 1 44252 14334 1 1 1 1 "(22E)-12alpha-Hydroxy-3-oxochola-1,4,22-trien-24-oic Acid" 1 1 1 1 1 1 1 1 1 1 13737 1 1 1 1 1 1 1 1 1 Phytyl diphosphate 1 1 1 1 1 1 1 1 1 1 82049 1 1 1 1 1 1 1 1 1 N-oleoyl asparagine 1 1 1 1 1 1 1 1 1 1 108535 31010 1 1 1 1 1 1 1 1 PA(13:0/22:0) 1 1 1 1 1 1 1 1 1 1 159431 628562 1 1 1 1 1 1 1 1 10-Nonacosen-2-one 1 1 1 1 1 1 1 1 1 1 148428 1 1 1 1 1 1 1 1 1 "(-)-7-epi--9,10-dihydrojasmonic acid" 1 27378 1 39639 30467 11370 1 1 1 1 16939 1 1 1 31782 45171 1 1 1 1 "2,4-diamino-butyric acid" 1 1 1 1 1 1 1 1 1 1 19166 1 1 1 1 1 1 1 1 1 "6E,8E,14Z-Hexadecatriene-10,12-diynoic acid" 1 1 1 1 1 1 94826 1 22991 1 515664 1 1 19077 16235 1 1 1 1 1 "1?-hydroxy-24,25,26,27-tetranorvitamin D3 23-carboxylic acid / calcitroic acid" 1 10791 85230 163439 27229 14946 26794 167147 1 1 162858 158424 135870 110492 111835 274640 1 1 1 1 PI(12:0/20:1(11Z)) 518053 532996 155935 1 1 481062 97465 363958 497029 453992 596797 1 411529 1 1 1 1 1 1 1 N-stearoyl taurine 1 1 18496 1 1 1 130522 1 1 1 96647 155082 202907 208208 94831 137693 1 1 1 1 3E-Hexene-2-one 1 1287096 9434291 1 1 1 1.46E+07 1 236769 1 6.01E+07 545963 1 1 2.54E+07 3037957 1 1 1 1 "TG(12:0/15:0/22:3(10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 38851 1 1 1 1 1 1 1 1 1 1-(2E-phytaenyl)-2-(2E-phytaenyl)-sn-glycero-3-phosphocholine 1 1 1 1 1 1 1 1 1 1 38851 1 1 1 1 1 1 1 1 1 PS(O-16:0/15:1(9Z)) 1 1 4925000 595562 1 1 2004157 2557890 1 1 2525138 1724114 1 1 5888706 3455300 1 1 1 1 "bacteriohopane-31,32,33,34,35-pentol" 1 1 20452 1 1 1 1 28735 1 1 261588 1 1 1 20783 1 1 1 1 1 GalNAcbeta1-4Galbeta1-4Glcbeta-Cer(d18:1/16:0) 1 1 1 1 1 1 1 1 1 1 49504 1 1 1 1 108095 1 1 1 1 "TG(12:0/13:0/20:3(8Z,11Z,14Z))[iso6]" 1 1 1 650810 1 1 1 1 1 1 11548 262850 1 1 1 1 1 1 1 1 3-O-(Galb)-(25R)-12-oxo-5alpha-spirostan-3beta-ol 1 1 1 117422 1 1 99443 1 1 1 69871 1 1 1 1 1 1 1 1 1 "PS(13:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 333484 1 1 389313 1 1 1 1 1 1 1 1 1 GlcAbeta-Cer(d18:1/18:0) 1 1 2003630 19621 1 1 1 1 1 1 1600689 1 1 966418 1 807929 1 1 1 1 22:6 Cholesteryl ester 1 1 1 1 1 1 1 341474 1 1 368524 274557 1 1 1 1 1 1 1 1 N-arachidonoyl tyrosine 1 1 1 1 1 1 1 1 1 1 51634 1 1 1 1 1 1 1 1 1 Lignoceroyl-EA 1 1 1 1 1 1 1 1 1 1 202344 1 1 1 1 1 1 1 1 1 (-)-Euphomine 410009 482218 1 1 642373 638071 344407 513997 520118 548942 929781 776595 890028 861249 1 1 1 1 1 1 DG(19:0/22:1(13Z)/0:0)[iso2] 1 1 1 117989 1 1 120580 147971 1 1 197075 143531 1 1 173126 119760 1 1 1 1 Gangetinin 1 1 1 1 1 1 1 1 1 1 1818528 1 1 1 1 1 1 1 1 1 "PG(16:1(9Z)/22:2(13Z,16Z))" 1 1 1 684559 1 1 1 27446 1 1 538019 72627 1 1 608149 1 1 1 1 1 "PC(10:2(2E,4E)/10:2(2E,4E))[S]" 728336 769967 1064114 684021 1113187 1161533 955241 833299 792241 839379 2204278 1500884 1264141 1348185 1 1 1 1 1 1 "PI(12:0/22:4(7Z,10Z,13Z,16Z))" 1 1 525378 1 267695 256389 536394 366427 194263 27893 1258150 316300 1 226374 122724 1 1 1 1 1 "PG(17:1(9Z)/22:2(13Z,16Z))" 1 1 19165 1 1 1 17352 1 1 1 117941 1 1 1 1 1 1 1 1 1 "PG(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 30082 1 1 1 1 1 1 1 1 1 "PS(O-20:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 147718 1 1 1 1 1 1 1 1 1 "(20S)-3beta-Hydroxychola-5,16-dien-24-oic Acid" 164786 160782 1 1 1 1 1 220506 1 1 228904 1 1 1 1 1 1 1 1 1 "3Z,6Z,9Z,12Z,15Z-Tricosapentaene" 1 1 165227 164533 1 1 101855 81428 1 1 168105 183820 1 1 123778 122696 1 1 1 1 PG(12:0/20:0) 1 1 201266 1 1 1 1 352074 1 1 473412 357278 1 1 452545 383882 1 1 1 1 2-ethyl-hydracrylic acid 45960 1 44246 3487562 22408 15011 1 625515 1 117489 2710634 221833 26359 1 1 36726 1 1 1 1 "1?,25-dihydroxy-24-oxo-23-azavitamin D2 / 1?,25-dihydroxy-24-oxo-23-azaergocalciferol" 1 1 1 1 1 155673 1 1 1 1 211428 1 1 172535 1 1 1 1 1 1 PI(O-16:0/0:0) 719449 746002 735727 485604 1107804 1159706 763603 776579 789138 838557 1987202 1364620 1255462 1333146 1 1 1 1 1 1 16:0-Glc-Campesterol 1 1 72935 1431128 1 1 231104 390356 347492 1 1151917 54940 1 518358 438843 904269 1 1 1 1 "1,2-dihexadecanoyl-sn-glycero-3-phosphosulfocholine" 37251 550737 1 1 36752 686419 73689 1 469432 1158514 21329 1 843431 841386 523706 24801 1 1 1 1 PE(P-16:0/0:0) 1 1 194286 205530 1 1 166440 111236 1 1 130755 128730 1 1 125707 115163 1 1 1 1 PG(12:0/20:1(11Z)) 1 1 1.48E+07 138100 1 1 2327594 1 1 72467 1525620 1 1 1 8369565 5636949 1 1 1 1 6?-hydroxycholestanol(d7) 1 1 1 1 1 1 1 1 1 1 202344 1 1 1 1 1 1 1 1 1 "PG(O-18:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 4084196 1 1 1 7682093 1 1 5350925 1887328 1 1 1 1 1 1 1 1 PC(O-18:1(9E)/O-18:1(9E))[U] 1 1 1 644737 1 1 1 1 1 1 11548 262850 1 1 1 1 1 1 1 1 N-arachidonoyl alanine 345749 345849 374143 527382 301810 290922 445566 413682 1 226523 512354 497516 64754 265827 234618 308761 1 1 1 1 SM(d16:1/23:0) 1 1 1 1 1 1 1 19316 1 1 62513 1 1 1 1 1 1 1 1 1 "(1S)-1-hydroxy-23-oxo-24,25,26,27-tetranorcalciol" 315197 257058 175574 309957 251139 204958 317882 289225 1 87835 423689 33468 250363 239110 270523 218348 1 1 1 1 1-(6-[5]-ladderane-hexanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine 1 1 1 1 1 1 1 1 1 1 19705 1 1 1 1 1 1 1 1 1 "(3R,4S)-(6S,7R)-Diepoxy-9Z-heneicosene" 1 1 1 94004 1 1 38443 75831 1 1 125805 104468 1 1 62106 1 1 1 1 1 "PI(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 48929 24248 1 165738 1 1 1 1 16804 1 125201 115275 1 1 112481 1 1 1 1 1 N-stearoyl valine 1 1 1 1 15974 1 1 1 58214 1 106421 1 13927 1 1 67983 1 1 1 1 "PG(O-16:0/20:2(11Z,14Z))" 1.72E+07 1.69E+07 1.13E+07 3847664 1.02E+07 1.82E+07 1.72E+07 5241242 1.86E+07 1.85E+07 7918775 3696319 1.87E+07 1694513 2.17E+07 4098561 1 1 1 1 PE(20:1(11Z)/24:1(15Z)) 1 1 1 1 1 1 100758 1 1 1 26770 1 1 1 1 1 1 1 1 1 ajugalactone 1 1 1 1 1 1 219677 1 1 1 212825 199467 1 1 71913 66328 1 1 1 1 PA(18:0/22:0) 1 1 1901332 1347805 1 1 1974822 1177022 1 1 1954512 1345437 1 1 1 1 1 1 1 1 PAC-1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Quinolone-3-Carboxamide Furan CB2 Agonist 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "7',8'-Dihydro-8'-hydroxycitraniaxanthin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 cis-5-Tetradecenoylcarnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Melilotussaponin O1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 W140 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17-O-Acetylnorajmaline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hydroxyzine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Benzyl O-[arabinofuranosyl-(1-6)-glucoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Linustatin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Scillaren A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Donepezil 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22S)-Acetoxy-3alpha,15alpha-dihydroxylanosta-7,9(11),24-trien-26-oic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(8:0/8:0/8:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(7R*,8R*)-3-Methoxy-3',4,7,9,9'-pentahydroxy-8,4'-oxyneolignan" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPC(22:5(7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8-Pentanoylneosolaniol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lauroyl diethanolamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sorbitan oleate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8-hydroxy Guanosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 22:3 Stigmasteryl ester 1 1 74228 1 1 1 127310 47793 1 1 1 1 1 1 19794 1 1 1 1 1 Docosanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gly Pro Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Cys Ser 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Met Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "17,21-Dihydroxypregn-4-ene-3,11,20-trione 21-(hydrogensuccinate)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3R-aminononanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Echinasteroside C 15-O-sulfate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Mefexamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-Dehydrodexamethasone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Medroxyprogesterone glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Lys Thr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "9-Fluoro-16alpha-hydroxyandrost-4-ene-3,11,17-trione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ivermectin B1b 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "17-?, 21-Dihydroxy-11,20-dioxo-5-?-pregnan-3-?-yl-?-d-glucuronide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "CL(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:2(11Z,14Z)/18:2(9Z,12Z)/18:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (S)-Nerolidol 3-O-[a-L-Rhamnopyranosyl-(1-4)-a-L-rhamnopyranosyl-(1-2)-b-D-glucopyranoside] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Isometheptene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Valnemulin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Elaeokanine C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Nitrosofolic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pravadoline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Ethylenediamine-N,N'-di-a-butyric acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-Diphenyl-1-indanone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-(2,3-Dihydro-1H-pyrrolizin-5-yl)-2-propen-1-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3beta,6beta)-Furanoeremophilane-3,6-diol 6-acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(14:1(9Z)/17:2(9Z,12Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Saccharopine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(t20:0/18:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(12:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/16:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-20:0/19:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(13:0/20:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (Ac)2-L-Lys-D-Ala 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (R)-Humulone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dierucoyl-SN-Glycero-3-Phosphoethanolamine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(12:0/17:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 trans-Hexadec-2-enoyl carnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hovenidulcigenin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2alpha-(Hydroxymethyl)-17-methyl-5alpha-androstane-3beta,17beta-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Aminoquinoline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Tyr Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Aspergillic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2R,3R,4R)-2-Amino-4-hydroxy-3-methylpentanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "10,12-Hexacosanedione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lepidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(22:2(13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(15a,20R)-Dihydroxypregn-4-en-3-one 20-[glucosyl-(1-4)-6-acetyl-glucoside]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N(6)-[(Indol-3-yl)acetyl]-L-lysine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(d18:0/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fucalpha1-2Galbeta1-3(Fucalpha1-4)GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Formyl-norleucyl-leucyl-phenylalanyl-methylester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Trospium 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Hexadecanoylpyrrolidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Diketopiperazine derivative of Quinapril 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(1alpha,3beta,20S,22R,24S,25S)-Pubescenin" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tomatoside A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (3-Phenylpropionyl)glycine methyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(O-20:0/20:3(8Z,11Z,14Z))" 1 1 231325 65846 1 1 1502805 1 1 1 1 1 1 1 408450 38086 1 1 1 1 Callytriol C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(9:0/9:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,3-ditetradecanoate 2-(9Z-octadecenoate)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PPA(16:0/18:1(9Z)) 83287 61139 1 286232 51780 1 200817 183332 26384 27535 1 1 29092 1 138075 168455 1 1 1 1 PE(10:0/11:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 91647 1 1 1 1 1 N-stearoyl phenylalanine 1 1 1 1 1 1 1 1 1 1 1 1 1 176540 10537 1 1 1 1 1 "2,4-heptadienal" 14013 941080 1 1 39937 132277 1 1 457570 113855 1 1 1139856 22944 51715 1 1 1 1 1 "TG(12:0/17:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10868 1 1 1 1 1 PC(O-18:0/13:0) 622831 644109 1 1 1 430518 1 14922 1 1 1 435028 618444 797238 621940 486458 1 1 1 1 "26:2(5Z,9Z)(13Me,17Me,21Me,25Me)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 72451 1 1 1 1 1 16:3-Glc-Stigmasterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 64190 1 1 1 1 1 Cerotic acid(d3) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 73292 1 1 1 1 1 pentanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31811 1 1 1 1 1 "5-Ethyl-3-methyl-2E,4E,6E-nonatriene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 102436 32162 1 1 1 1 5a-Androst-3-en-17-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 13265 1 1 1 1 1 PI(O-16:0/16:1(9Z)) 1 1 270878 1 1 1 159730 1 1 1 1 1 1 1 99939 1 1 1 1 1 "3R,7R-Dimethyltridecan-2S-ol" 1 1 1 14035 1 1 1 1 1 68624 1 1 1 1 290372 1 1 1 1 1 "(22E)-(24R,25R)-25,26-epoxy-1?,24-dihydroxy-22,23-didehydrovitamin D3 / (22E)-(24R,25R)-25,26-epoxy-1?,24-dihydroxy-22,23-didehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 66117 57795 1 1 1 1 1 17-phenyl trinor PGF2? 1 1 1 1 1 1 1 1 1 1 1 1 1 1 221590 1 1 1 1 1 Dolichoic acid-[18-20] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 434685 1 1 1 1 1 DG(12:0/22:0/0:0)[iso2] 1 1 1 1 1 1 1 1 1 1 1 261945 1 1 276889 1 1 1 1 1 "25-hydroxy-16,17,23,23,24,24-hexadehydrovitamin D3 / 25-hydroxy-16,17,23,23,24,24-hexadehydrocholecalciferol" 1 202043 1 1 1 221242 1 1 171522 1 1 1 1 1 375605 316186 1 1 1 1 (-)-Dilophol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17180 1 1 1 1 1 2'-Hydroxy-4'-methoxy-3-phenylpropiophenone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 427500 1 1 1 1 1 8-Epiiridodial glucoside tetraacetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12812 1 1 1 1 1 "(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl butyrate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 324399 21146 1 1 1 1 (+)-Vulgraon B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 29160 1 1 1 1 1 "PS(O-16:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 33970 563502 1 1 1 1 "(-)-1(10),11-Eremophiladien-9beta-ol" 1 1 18228 1 68002 85098 1 1 1 1 1 1 63808 1 53709 1 1 1 1 1 PE(O-16:0/22:0) 1 1 755322 1 1 1 1446639 1 1 1 1 1 1 1 345342 1 1 1 1 1 "PE(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 69066 1 1 1 1 1 192635 182612 1 1 1 1 1 1 149947 1 1 1 1 1 "TG(13:0/22:0/22:4(7Z,10Z,13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31854 1 1 1 1 1 PC(14:1(9Z)/20:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1585773 1 1 1 1 1 "PS(P-18:0/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 72453 1 1 1 1 1 "1?,25-dihydroxy-19-norprevitamin D3 / 1?,25-dihydroxy-19-norprecholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 989595 1 1 1 1 1 PI-Cer(t18:0/18:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 38607 1 1 1 1 1 Minabeolide-8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 541368 1 1 1 1 1 Type IV cyanolipid eicosanoyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16192 56241 1 1 1 1 Crasseride 2a 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1.82E+07 1 1 1 1 1 PE(24:1(15Z)/P-18:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 169134 1 1 1 1 1 Formononetin 7-O-(6''-acetylglcoside) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 70412 1 1 1 1 1 N-palmitoyl threonine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 24783 1 1 1 1 1 p-Aminobenzamidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hebevinoside III 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 KDdiA-PC 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-Benzyl-1,2,3,4-tetrahydroisoquinoline" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 FK-866 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acetyltryptophanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gly Met Pro 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ethyl 3-(N-butylacetamido)propionate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(21:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-trans-C75 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,6-Diethylaniline" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Thiobinupharidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Mabioside E 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Valyl-Valine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-Ketorockogenin acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sucrose acetate isobutyrate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D-erythro-Sphingosine C-20 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4,12-Octadecatrienoic acid isobutylamide" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Rilmenidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,8-Diazabicyclo[5.4.0]undec-7-ene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dodemorph 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-[2-(1H-Indol-3-yl)ethyl]docosanamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Triterpenoid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Butroxydim 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(17:2(9Z,12Z)/0:0)" 1 1 1 1 1 1 1 41562 1 1 1 1 1 1 1 1 1 1 1 1 Cys Pro Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Gln Gln 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Doxacurium chloride 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Feruloylagmatine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(P-16:0/0:0) 1 482218 276983 1 1 637170 343475 513997 518397 548942 1 776595 890028 861249 1 1 1 1 1 1 "(2S,4S,6S)-2-[2-(4-Hydroxy-3-meyhoxyphenyl)ethyl]tetrahydro-6-(4,5-dihydroxy-3-methoxyphenyl)-2H-pyran-4-yl 4-acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(12:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ivermectin B1a 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,7,10,13-Docosatetraynoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Penbutolol glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tegaserod 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lys Phe Pro 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bikhaconitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 G-418 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Butyl 4'-O-hexadecanoyl-neohesperidoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Stearoyl-2-Docosahexaenoyl-sn-Glycero-3-[Phospho-rac-(1-glycerol)] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Acetylprocainamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 NBD-Stearoyl-2-Arachidonoyl-sn-glycerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-O-Desmethyldonepezil 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bakkenolide D 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Hydroxymonoethylglycylxylidide (3-Hydroxy-MEGX) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Myxalamid C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MG(0:0/24:1(15Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(17:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nomilinic acid 17-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Dioleoyl PC" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Desglucocoroloside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(19:0/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3S,5R,6S,7E,9x)-7-Megastigmene-3,6,9-triol 9-glucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Usambarensine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Prostaglandin E2-biotin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-stearoyl proline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Methoxy-1-vinyl-beta-carboline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (S)-gamma-Calacorene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-(4-Methylphenyl)propanal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "26,26,26,27,27,27-hexafluoro-25-hydroxyvitamin D3 / 26,26,26,27,27,27-hexafluoro-25-hydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d16:1(4E)/24:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(beta-D-Glucopyranosyloxy)-3-octanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-iodo-octadecanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-Diethyl-5,6-dimethylpyrazine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cholesterol glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11,13-dimethoxy-12-hydroxy-9-octadecenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 p-Hydroxypropoxyphene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydrozeatin riboside monophosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Ile Lys 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-nitrohexane 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hericene B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ginsenoside A1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "bacteriohopane-,32,33,34-triol-35-cyclitolguanine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 JWH 073-d7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tokoronin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Solacaproine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cytochalasin Ppho 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Diphenylurea 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (20R)-24-Hydroxygeminivitamin D3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DAT(16:0/24:0(2Me[S],4Me[S]))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Alloxydim 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glu Glu Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "CL(1'-[15:0/15:0],3'-[15:0/16:1(9Z)])[rac]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(20:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(12:0/16:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Verbasoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Capsianoside V 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Spinoside A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(14:0/22:4(7Z,10Z,13Z,16Z))" 493164 712399 1 1 785857 763640 1 1 856828 897129 1 1 878796 1 1 1 1 1 1 1 Prothiocarb 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Muricin D 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Jasmolone glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydropteroic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 alpha-Methylstyrene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 a-L-Arabinofuranosyl-(1-2)-[a-D-mannopyranosyl-(1-6)]-D-mannose 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(20:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "13-ethyl-16,17-dihydroxy-18,19-Dinorpregna-4,9,11-trien-20-yn-3-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-Ethyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2H-benzo[a]quinolizin-2-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)N-(1R-methyl-2-hydroxy-ethyl) ?,?-dimethylarachidonoyl amine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Polyethylene, oxidized" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Icacine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nostopeptolide A2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Lys Ser 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Mephobarbital 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Methoxyindoleacetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Melongoside O 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Unoprostone isopropyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Hydroxy-7-methoxy-2-tritriacontyl-4H-1-benzopyran-4-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(10E-Undecenyl)-2-acetyl-sn-glycero-3-phosphocholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Phe Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 cis-and-trans-Inophyllolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "16beta-16-Hydroxy-3-oxo-1,12-oleanadien-28-oic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 ZK118182 isopropyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hebevinoside I 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-(4-Amino-2-methylpyrimid-5-ylmethyl)-3-(beta-hydroxyethyl)-2-methylpyridinium 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(13:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 60308 1 1 1 1 20:3 Stigmasteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hypoxanthine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Biperiden 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(25R)-1beta,3alpha,7alpha-trihydroxy-5beta-cholestan-26-oic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lumichrome 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE-Cer(d16:2(4E,6E)/20:1(11Z)(2OH))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cohibin C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn Gln Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16-Feruloyloxypalmitate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-octadecanoyl-L-Homoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "alpha,alpha'-diethyl-4,4'-bis(2-propynyloxy)stilbene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Met Pro Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Feruloylcholine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Demecarium 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Virginiamycin M1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dihydrogeranylgeranyl diphosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 C-6 NBD-dihydro-Ceramide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glycerol 1-(9Z-octadecenoate) 2-hexadecanoate 3-octadecanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Methylcytidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,6,7-trimethylnaphthalene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Heptyl-3-hydroxy-quinolone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acutifolane A 1 1 1 1 1 1 10442 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(19:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 15647 1 210545 190847 1 1 1 1 1 1 1 1 1 1 1 1 "2',4',6',3-Tetrahydroxy-3'-geranyl-6'',6''-dimethylpyrano[2'',3'':4,5]dihydrochalcone" 1 1 1 1041968 1 1 901303 1026502 1 1 1 1 1 1 1 988253 1 1 1 1 NeuAcalpha2-3Galbeta1-4Glcbeta-Cer(d18:1/20:0) 1 1 1 1 1 1 58512 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(12:0/22:2(13Z,16Z))" 1 389212 1 1 1 1 149500 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Scalarin 1 55944 1 1 1 66215 113520 1 1 1 1 1 1 1 1 1 1 1 1 1 "GlcCer(d15:2(4E,6E)/22:0(2OH))" 1 1153016 1 1 1 1 923355 762903 1 1 1 1 1981390 2181031 1 1 1 1 1 1 "11beta,12beta-Dihydroxy-5beta-cholan-24-oic Acid" 1 1 145293 162627 1 1 61213 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 47285 1 1 1 1 30042 1 1 1 1 1 1 1 1 "24R-methylcholest-22E-en-3beta,4beta,5alpha,6alpha,8beta,14alpha,15alpha,25R,26-nonol" 1 1 1 1 1 1 986632 1 1 1 1 1 1 1 1 1 1 1 1 1 "3Z,6Z,9Z,12Z,15Z-Pentacosapentaene" 1 1 80202 1 1 1 63951 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(O-16:0/22:2(13Z,16Z))" 1 1 1 1 1 1 91464 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(22:0/22:0) 1 1 1 1 1 1 30144 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(12:0/20:1(11Z)) 1 1 1 1 1 1 1790051 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-20:0/22:2(13Z,16Z))" 1 1 1 1 1 1 146052 1 1 1 1 1 1 1 1 1 1 1 1 1 N-docosanoyl taurine 1 1 1 1 1 1 200476 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d18:2/15:0) 96631 595056 1 1 28325 6630961 8432677 1 18844 83298 1 1 7076710 5861739 1 1 1 1 1 1 "PA(13:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 97497 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(O-16:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 151799 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl tyrosine 1 115785 1 1 1 89732 97055 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 34039 23425 1 1 28931 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20R)-17,20-dihydroxypregn-4-en-3-one" 1 1 1 1 1 1 15782 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(P-20:0/0:0) 1 1 91394 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(18:1(9Z)/22:2(13Z,16Z))" 1 53069 167958 192030 1 1 1 1 1 44626 1 1 1 1 1 1 1 1 1 1 28:7(n-6) 1 1 76400 1 1 1 1 1 1 1 1 1 123023 1 1 72904 1 1 1 1 PE(12:0/20:0) 1 369619 315834 1 1 1 1 1 259354 1 1 1 1 1 1 1 1 1 1 1 (22Alpha)-hydroxy-5alpha-campestan-3-one 1 1 196568 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Borneol 1 28114 29699 1 1 1 1 1 20304 1 1 1 1 31751 1 1 1 1 1 1 "PI(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 57449 160359 1 1 1 1 1 57301 50681 1 86965 1 1 1 1 1 1 1 1 "PE-Cer(d14:2(4E,6E)/18:1(9Z))" 1 1 48348 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-stearoyl glutamic acid 1 1 87778 101674 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(13:0/0:0) 12640 1 32094 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/0:0) 1 1 414075 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22R)-22,25-dihydroxyvitamin D3 / (22R)-22,25-dihydroxycholecalciferol" 1 1 192575 1 1 1 1 1 1 1 1 1 116311 1 1 1 1 1 1 1 alNAcbeta1-4(NeuGcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/16:0) 1 1 77763 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-O-Hexadecyl-2-O-docosahexenoyl-sn-glycero-3-phosphorylcholine 1 1 46714 1 11009 1 1 1 1 29296 1 1 1 1 1 1 1 1 1 1 PS(19:1(9Z)/0:0) 1 842508 1 1 896261 1 1 1 875409 1 1 1847280 1 1 1 1 1 1 1 1 "1?-hydroxy-18-[m-(1-hydroxy-1-ethylpropyl)-benzyloxy]-23,24,25,26,27-pentanorvitamin D3 / 1?-hydroxy-18-[m-(1-hydroxy-1-ethylpropyl)-benzyloxy]-23,24,25,26,27-pentanorcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 134072 1 1 1 1 1 1 1 1 (-)-Linderatin 1 1 1 1 1 1 1 1 1 1 1 70441 1 1 1 1 1 1 1 1 "PC(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 76878 1 1 1 1 1 1 1 1 PE(16:0/24:1(15Z)) 38474 1 1 1 1 1 1 1 1 1 1 59707 1 1 1 1 1 1 1 1 TG(12:0/12:0/19:0)[iso3] 1 1 1 1 1 1 1 1 54006 1 1 22302 1 1 1 1 1 1 1 1 18:0 Stigmasteryl ester 1 1 1 1 1 1 1 1 1 1 1 61895 1 1 1 1 1 1 1 1 "DG(22:5(7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 95638 1 1 1 1 1 1 1 1 1-Octadecanol 1 1 1 32180 1 1 1 15789 1 1 1 40072 1 1 1 1 1 1 1 1 GlcCer(d15:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 23397 1 1 1 1 1 1 1 1 methyl 8-[2-(2-formyl-vinyl)-3-hydroxy-5-oxo-cyclopentyl]-octanoate 1 1 1 1 1 1 1 1 1 1 1 11812 1 1 1 1 1 1 1 1 "PC(12:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1998022 1 1 1 1 1 1 1 1 "DG(14:0/22:3(10Z,13Z,16Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 30044 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-3-deoxy-19-norvitamin D3 / 1?,25-dihydroxy-3-deoxy-19-norcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 30306 1 1 1 42070 1 1 1 1 Carisoprodol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Asn Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(23R)-1?-hydroxy-25,27-didehydrovitamin D3 26,23-lactone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Calamin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(17:2(9Z,12Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avocadynone Acetate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4-Keto-4'-hydroxyalloxanthin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lys Pro Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glu Lys Met 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-11-nor-9-carboxy-?9-THC 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11?-(chloromethyl)-1?,25-dihydroxyvitamin D3 / 11?-(chloromethyl)-1?,25-dihydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Arg Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 23-Acetoxysoladulcidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Stearidonyl carnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Ala Thr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-(3,4-Dihydroxyphenyl)-1-decene-3,5-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gravolenic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Himbacine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn His Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11,13-Dihydrotaraxinic acid glucosyl ester" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Aryl beta-D-glucoside 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ipecac (Psychotrine) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8-Propyloxycaffeine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oseltamivir 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(Z)-6-Tetradecene-1,3-diyne-5,8-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,4'-Diaminostilbene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5'-O-Methylmelledonal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,4-Diaminotoluene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dicyclohexylcarbodiimide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Alnustone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Amino-2-methylbutanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,2-Dimethyl-3-(4-methoxyphenyl)-4-ethyl-6-(1-pyrrolidinylmethyl)-2H-1-benzopyran-7-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "16alpha,17alpha-Epoxy-20-oxopregn-5-en-3beta-yl acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gamma Glutamylglutamic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "17-Propylestra-1,3,5(10)-triene-3,17beta-diol diacetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-Deoxyguanosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Farnesyl Thiosalicylic Acid Amide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Gly Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Metominostrobin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Sanguisorbin E 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ampeloside Bf2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Americine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,3-Butanediol glucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-hexadecanoyl-L-Homoserine lactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 [6]-Shogaol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Celiprolol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D-Apiitol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Pro Ser 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Enniatin B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 AS 1-2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-16alpha,17-Dihydroxy-atisan-3-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Benzethonium 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,6-Epoxy-5,5',6,6'-tetrahydro-b,b-carotene-3',5,5',6'-tetrol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asiminenin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-di-(9Z-octadecenoate) 3-tetradecanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 alhpa-tocopheronolactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)13-HpODE 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala-Lys-OH 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gestrinone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)10-Gingerol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Flunitrazepam 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-(2,4-Cyclopentadien-1-ylidene)-5alpha-androstan-17beta-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Leukotriene D4 methyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(all-Z)-7,10,13-Docosatrienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Propenyl 2-aminobenzoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Erythrodiol 3-decanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glycerol 1-eicosanoate 2-(9Z-octadecenoate) 3-octadecanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tridihexethyl 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Ile Lys 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(20S)-20-cyclopropyl-1?,25-dihydroxy-16,17-didehydro-21-norvitamin D3 / (20S)-20-cyclopropyl-1?,25-dihydroxy-16,17-didehydro-21-norcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Myxalamid B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Alizapride 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Uracil 5-carbaldehyde 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Heptadecanoyl carnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cytochalasin Opho 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pentahomomethionine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Lys Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "18-Nor-4(19),8,11,13-abietatetraene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Furmecyclox 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Diketopiperazine derivative of Quinaprilat 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4-Hydroxy-16,18-tritriacontanedione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tranylcypromine glucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3-Hydroxy-N-glycyl-2,6-xylidine (3-Hydroxyglycinexylidide)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(9E,11E)-13-oxooctadeca-9,11-dienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 AS 1-5 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Leucettamol A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ganglioside GM3 (d18:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Stearoyl-D-sphingomyelin 1 1 1 672701 1 1 1 1 1 1 1 1 1 1 1 507475 1 1 1 1 PA(14:0/22:0) 1 1 1 8965847 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1 1 182269 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lipid X 1 1 1 399253 1 1 1 178895 1 1 1 1 1 1 1 1 1 1 1 1 "PE(P-16:0/17:2(9Z,12Z))" 1 1 1 27665 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(18:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 95965 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-hydroxy palmitic acid 1 1 1 22999 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3,4-Methylenedioxybenzoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dextrothyroxine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Jurubine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Vinorine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(12:0/15:0/22:2(13Z,16Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 beta-nicotinamide D-ribonucleotide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(P-16:0/18:4(6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 237353 1 1 1 1 1 1 1 1 1 1 1 1 "(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl hexanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "21-Fluoro-11beta-hydroxypregn-4-ene-3,20-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Ser Thr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,6-Dihydroxy-3,7-dimethoxy-2-(3-methyl-2-butenyl)-8-(2-oxo-3-methyl-3-butenyl)-xanthone" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oxytetracycline 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 20?-Dihydroprednisone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Hydroxyprolyl-Tryptophan 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Pro Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dolichyl b-D-glucosyl phosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(t20:0/22:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1-(O-alpha-D-mannopyranosyl)-(1,3R,25S,27R)-octacosanetetraol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gln Gln His 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Paromamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CAY10621 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16alpha-Hydroxyestrone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (-)-Tortuosamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Ser Ser 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-Hydroxyyohimbine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DL-erythronic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Arg His 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,3-Dibenzyltetramethyldisiloxane" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-trans-p-Coumaroylrotundic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(20:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d17:1/26:1) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Met Pro Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE-Cer(d14:2(4E,6E)/19:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Plerixafor 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "17,21-Epoxy-9-fluoro-11beta-hydroxypregn-4-ene-3,20-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(14:0/22:1(11Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 HC Toxin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Met Pro 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11?-Prostaglandin F1? 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-Ketoetiocholanolone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Galbeta-Cer(d18:1/16:0) 1 1 1 1 1 9473752 1 1 1.04E+07 1 1 1 1 1.02E+07 1 1 1 1 1 1 "PC(16:1(7Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 1189959 1 1 1 1 1 1 1 122238 1 1 1 1 1 1 1 1 1 1 PE(O-18:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 54101 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pinosylvin 65613 81917 1 1 37243 48872 1 1 74084 77877 1 1 68936 64099 1 1 1 1 1 1 1-(10-methyl-hexadecanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphoethanolamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Oxo-ETE-d7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "GlcCer(d14:2(4E,6E)/18:0(2OH))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(19:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1542166 1 1 1 1 1 1 1 PI(19:0/22:0) 379348 387510 1 1 272537 338421 1 1 200420 212553 1 1 347953 345051 1 1 1 1 1 1 LBPA(16:0/18:1(9Z)) 408927 382717 1 1 387574 434988 1 1 349113 278156 1 1 321633 315040 1 1 1 1 1 1 PS(16:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(20:0/0:0) 1 1 1 1 1 50190 1 1 48308 39341 1 1 58184 73023 1 1 1 1 1 1 PC(12:0/18:1(9Z)) 1 1 1 1 2015143 2108378 1 1 1 2337169 1 1 1 2284742 1 1 1 1 1 1 Man-b1-2-Ins-1-P-Cer(t18:0/2-OH-26:0) 1196020 1218342 1 1 1429924 1468107 1 1 947575 1100817 1 1 1 1 1 1 1 1 1 1 PA(20:0/0:0) 1 32120 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(d20:0/22:0) 43815 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(21:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(14:0/22:4(7Z,10Z,13Z,16Z))" 1 231002 1 1 192014 166959 1 1 181483 178118 1 1 86792 1 1 1 1 1 1 1 (2S)-2-hydroxyphytanic acid 92634 94266 1 1 91430 88606 1 1 71844 70309 1 1 121271 135166 1 1 1 1 1 1 "PI(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 30443 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GPA(16:0/18:1(9Z)) 1 557176 1 1 1 522421 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-oleoyl tryptophan 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 54715 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(14:0/22:2(13Z,16Z))" 1 1 1 1 13550 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 743518 874276 1 1 691615 1 1 1 381393 132289 1 1 554736 101464 1 1 1 1 1 1 PS(12:0/16:0) 349290 276492 1 1 18526 180442 1 1 251133 268607 1 1 299970 1 1 1 1 1 1 1 4-Prenyldihydropinosylvin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 87001 1 1 1 1 "16,17-epoxy-DHA" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 45823 1 1 1 1 "1?,21-dihydroxy-20-oxo-22,23,24,25,26,27-hexanorvitamin D3 / 1?,21-dihydroxy-20-oxo-22,23,24,25,26,27-hexanorcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 57514 1 1 1 1 PC(O-18:0/O-2:1(1E)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 131951 1 1 1 1 ?-Santonin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 32568 1 1 1 1 17-phenyl trinor PGF2? isopropyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 24081 1 1 1 1 "TG(12:0/12:0/20:3(8Z,11Z,14Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 87427 1 1 1 1 "11-acetoxy-3beta,6alpha-dihydroxy-24-methyl-27-nor-9,11-seco-5alpha-cholesta-7,22E-dien-9-one." 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 36072 1 1 1 1 PG(P-16:0/16:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 841123 1 1 1 1 Pregnenolone sulfate 1 1 1 1 1 1 1 1 329681 1 1 1 1 1 1 847941 1 1 1 1 "1,2-Dihydro-3,4-dehydrolycopene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 125489 1 1 1 1 "5alpha-androstane-3,17-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 31439 1 1 1 1 PA(13:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15637 1 1 1 1 "TG(12:0/12:0/18:4(6Z,9Z,12Z,15Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 685418 1 1 1 1 "PA(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/19:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 758266 1 1 1 1 "PE(17:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 698033 1 1 1 1 4-[5]-ladderane-butanoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 27747 1 1 1 1 all-trans-phytofluene 1 1 1 1 1 1 1 87152 1 1 1 1 1 1 1 69426 1 1 1 1 PC(10:0/16:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Goyaglycoside a 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Methyl 3b-hydroxy-13(18)-oleanen-28-oate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 piritramide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 CAY10433 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(13:0/20:2(11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Thioetheramide-PC 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Antibiotic X 14889C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Palmatine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2'-Aminobiphenyl-2,3-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Fluenetil 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oxidized Oplophorus luciferin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ile Ile Ser 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MAM2201 N-(4-hydroxypentyl) metabolite 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Europine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(15:0/24:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2,2',3,3',4',5,6'-Heptabromodiphenyl ether" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,10-Phenanthroline" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tilmicosin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Penbutolol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(10:0/10:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11-Oxo-beta-amyrin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 BW A868C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Anguidol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pinidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arctolide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Nicofetamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Arachidonyl Maleimide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(O-20:0/19:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(17:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 20573 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Neolinderatone 837783 1 1 1 1 1 1 1 1 1 1 1 707501 689176 1 1 1 1 1 1 Pubescenol 1 1 1 1 33305 32722 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arachidonoyl-EA(d8) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(12:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "24,24-Difluoro-1,25,26-trihydroxyvitamin D3" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(15:0/22:3(10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 249494 411870 1 1 471121 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "C25:3 6,7-Epoxy highly branched isoprenoid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22E,24E,26E)-1?,26b-dihydroxy-22,23,24,25,26,26a-hexadehydro-26a,26b-dihomo-27-norvitamin D3 / (22E,24E,26E)-1?,26b-dihydroxy-22,23,24,25,26,26a-hexadehydro-26a,26b-dihomo-27-norcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(11Z))" 1 1 1 1 402161 1 1 1 1 308394 1 1 1 1 1 1 1 1 1 1 "1?,22-dihydroxy-23,24,25,26,27-pentanorvitamin D3 / 1?,22-dihydroxy-23,24,25,26,27-pentanorcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPE(0:0/22:2(13Z,16Z))" 1 284759 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "LysoPE(0:0/20:4(5Z,8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(20:5(5Z,8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-Deoxymethymycin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 53882 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 11Z-Eicosenal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 testolic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(O-20:0/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-2-Octenyl hexanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Oleoyl-EA(d2) 1 1 1 1 1 1 1 51235 1 1 1 1 1 1 1 1 1 1 1 1 7-O-Methylisolupalbigenin 1 1 1 1 1 1 1 697658 1 1 1 1 1 1 1 1 1 1 1 1 "PA(18:3(9Z,12Z,15Z)/0:0)" 1 1 1 1 1 1 1 304235 1 1 1 1 1 1 1 1 1 1 1 1 Cer(t18:0/24:0(2-OH)) 1 1 1 1 1 1 1 79537 1 1 1 1 1 1 1 1 1 1 1 1 2-Aminohexadecanoic acid 1 1 1 1 1 13166 1 16638 1 1 1 1 1 1 1 1 1 1 1 1 "16,17-Epiestriol" 1 1 1 1 1 1 1 23752 1 1 1 1 1 1 1 1 1 1 1 1 "PA(21:0/22:2(13Z,16Z))" 1 1 1 1 1 1 1 33872 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(d20:0/16:0) 1 1 1 1 1 1 1 228487 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-2?-(4-hydroxybutoxy)vitamin D3 / 1?,25-dihydroxy-2?-(4-hydroxybutoxy)cholecalciferol" 1 1 1 1 1 1 1 133699 1 1 1 1 1 1 1 1 1 1 1 1 "PA(18:4(6Z,9Z,12Z,15Z)/0:0)" 1 1 1 1 1 1 1 69676 1 1 1 1 1 1 1 1 1 1 1 1 "(17S,20R)-1?,25-dihydroxy-17,20-methano-21-norvitamin D3 / (17S,20R)-1?,25-dihydroxy-17,20-methano-21-norcholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3alpha,7alpha,12alpha-trihydroxy-27a,27b-dihomo-5beta-cholestane-26,27b-dioic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PC(18:4(6Z,9Z,12Z,15Z)/P-18:1(11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(17:1(9Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GalCer(d18:2/21:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(±)11,12-DHET" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,11-Undecanedicarboxylic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(14:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Tephrowatsin A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(-)-20-Acetoy-9-hydroxy-1,6,14-rhamnofolane-triene-3,13-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(d20:0/26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10-hydroxy-11-dodecenoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11,12,13-TriHOME" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 L-Octanoylcarnitine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Behenyl alcohol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI(12:0/18:0) 1 1 1 1 1 1 1 1 718954 1 1 1 1 1 1 1 1 1 1 1 "(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl dodecanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "10,12-Tetradecadienal" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Stearic acid(d3) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 SM(d16:1/22:1) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Penazetidine A 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(18:1(9Z)/22:2(13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(O-9:0/O-1:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Linolenyl myristate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PGH2-EA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(O-16:0/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11,12-DiHETrE-EA" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "C25:2 6,7-Epoxy highly branched isoprenoid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "13,17-Octadecadiene-9,11-diynoic acid, (Z)-" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-(3S-hydroxy-butanoyl)-homoserine lactone 15477 1 1 1 1 93545 1 1 20405 1 1 1 1 1 1 1 1 1 1 1 Anthenoside A 11851 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(d18:0/26:0) 74140 57086 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(10E)-19-fluoro-1?,25-dihydroxyvitamin D3 / (10E)-19-fluoro-1?,25-dihydroxycholecalciferol" 23707 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gibberellin A44 diacid 12108 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-arachidonoyl glutamic acid 69851 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]" 1095180 1098383 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Manoalide 41874 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 92966 121216 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,3,7-Trioxo-5beta-cholan-24-oic Acid" 55692 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "20:3(5Z,9Z,17Z)(11Me,15Me,19Me)" 47301 1 1 1 27602 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(13:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" 1 370468 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 25-iso-etioline 1 44556 1 1 84747 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-oleoyl phenylalanine 1 66989 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(P-20:0/22:0) 1 98380 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(22E)-(24R)-1?,24-dihydroxy-26,27-cyclo-22,23-didehydro-20-epivitamin D3 / (22E)-(24R)-1?,24-dihydroxy-26,27-cyclo-22,23-didehydro-20-epicholecalciferol" 1 88160 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Coenzyme Q6 1 56467 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(12:0/20:0/0:0)[iso2] 1 16080 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Verazine 1 55068 1 1 1 1 1 1 42655 62236 1 1 1 1 1 1 1 1 1 1 "PS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/17:1(9Z))" 1 159295 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(14:0/22:0) 1 798167 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/20:0) 1 696897 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(P-16:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(12:0/14:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "methyl 10,12-dihydroperoxy-8E,13E,15Z-octadecatrienoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (Z)-3-Hexenyl hexadecanoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4Z,7Z,10Z,13Z,16Z,19Z,22Z,25Z-octacosaoctaenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2E,4E-Hexadienyl acetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Hexadecanoic acid, 2-fluoro-; 2-Fluoropalmitic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "4,5-(methanoxy-2-methylethano)isolongifol-4-ene" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPC(17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(13:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Eicosanoyl-EA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(0:0/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 GlcCer(d14:1(4E)/24:1(15Z)(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(12:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(P-16:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)-Mevalonolactone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(15:0/20:3(8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(O-16:0/18:3(6Z,9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(O-18:0/17:2(9Z,12Z))" 1 1 1 1 1856697 1 1 1 1 1 1 1 1 2992041 1 1 1 1 1 1 "PE(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Minabeolide-5 1 1 1 1 1 68854 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ins-1-P-Cer(d18:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PI-Cer(t20:0/22:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Glepidotin C 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19-norcholestenone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cholest-5-ene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "12-hydroxy-8E,10E-heptadecadienoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-24-oxo-22-oxavitamin D3 / 1?,25-dihydroxy-24-oxo-22-oxacholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(23R)-1?,23,25-trihydroxy-24-oxovitamin D3 / (23R)-1?,23,25-trihydroxy-24-oxocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PS(14:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/17:2(9Z,12Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "26,26,26,27,27,27-hexafluoro-1?,25-dihydroxy-16,17,23,23,24,24-hexadehydrovitamin D3 / 26,26,26,27,27,27-hexafluoro-1?,25-dihydroxy-16,17,23,23,24,24-hexadehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 39560 16236 1 1 1 1 1 1 Taurochenodeoxycholic acid 1 1 1 1 462368 1 1 1 1 1 1 1 731875 1 1 1 1 1 1 1 "MGDG(18:5(3Z,6Z,9Z,12Z,15Z)/18:5(3Z,6Z,9Z,12Z,15Z))" 1 1 1 1 1 1 1 1 1 1 1 1 45998 1 1 1 1 1 1 1 "17,18-Epoxy-8,10,13(15)-lobatriene" 1 1 1 1 1 1 1 1 1 1 1 1 12588 1 1 1 1 1 1 1 "1-Fluoro-25-hydroxy-16-ene-23-yne-26,27-hexadeuterovitamin-D3" 1 1 1 1 1 1 1 1 1 1 1 1 124759 1 1 1 1 1 1 1 "TG(16:0/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d18:1/17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,2-Di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Palmitoyl N-Isopropylamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-di-(9Z,12Z-octadecadienoate) 3-hexadecanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d15:1/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arbekacin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Heterophylliin F 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)12(13)-EpOME 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 10E-Octadecenoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Acetylpyrazine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Solacapine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Melleolide M 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 HoPhe-His-OH 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(1'x,2S)-2-(1,2-Dihydroxy-1-methylethyl)-2,3-dihydro-7H-furo[3,2-g][1]benzopyran-7-one 2'-glucoside" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(13:0/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(14:0/22:4(7Z,10Z,13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2-Aminoethylphosphocholate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arachisprenol 12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Capsi-amide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3beta,22E,24R)-3-Hydroxyergosta-5,8,22-trien-7-one" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 U-73122 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Bilirubin diglucuronide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Dolastatin 10 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asn Gly Tyr 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DG(14:1(9Z)/24:1(15Z)/0:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)11-HEDE 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 MIPC(d18:0/22:0(2OH)) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Istamycin AO 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(±)N-(2-fluro-ethyl)-2,16,16-trimethyl-5Z,8Z,11Z,14Z-tricosatetraenoyl amine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Actinidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cer(d18:0/h17:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DAT(18:0/24:0(2Me[S],3OH[S],4Me[S],6Me[S]))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 JP104 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (+)-Syringaresinol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "2-Octanoyl-1,3,-Diolein" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Ala Arg Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-palmitoyl glutamic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 66195 1 1 1 1 1 1 "6-Bromo-5E,9Z,13Z,24Z-octacosatetraenoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 67831 1 1 1 1 1 1 "3,5,8,3',4',5'-Hexahydroxyflavone" 1 1 1 1 1 1 1 1 1 1 1 1 1 15723 1 1 1 1 1 1 OH-Spheroidenone 1 1 1 1 1 1 1 1 1 1 1 1 1 66663 1 1 1 1 1 1 PE-Cer(d14:1(4E)/18:1(9Z)) 1 1 1 1 1 1 1 1 1 1 1 1 1 43692 1 1 1 1 1 1 PA(19:1(9Z)/0:0) 1 1 1 1 1 135237 1 1 1 1 1 1 1 149316 1 1 1 1 1 1 "4,4'-Diapophytoene/ Dehydrosqualene" 1 1 1 1 32236 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Pentadecyl oleate 1 1 1 1 61293 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1,25-dihydroxy-2-nor-1,2-secovitamin D3 / 1,25-dihydroxy-2-nor-1,2-secocholecalciferol" 1 1 1 1 245573 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(15:0/22:0) 1 1 1 1 11009 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPE(0:0/15:0) 1 1 1 1 18231 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(17:1(9Z)/0:0) 1 1 1 1 26588 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 LysoPC(26:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (±)14(15)-EET Ethanolamide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Adlupone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-didodecanoate 3-tetradecanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "GPIns(17:0/20:4(5Z,8Z,11Z,14Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(22:1(11Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Perindoprilat 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Arachidonoyl-L-Alanine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avermectin A1a monosaccharide 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(±)-CP 47,497-d11" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 N-Histidyl-2-Aminonaphthalene (?NA) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Olomoucine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Agelasine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5-Hydroxydopamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Gly Trp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Lys Phe 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Capsaicin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 9-Octadecenoic acid 1-[[(1-oxohexadecyl)oxy]methyl]-2-(phosphonoxy)ethyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TG(12:0/12:0/12:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PC(10:0/13:0)[U] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (E)-8-Tetradecenyl formate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(13:0/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Samandarine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 trans-2-Enoyl-OPC6-CoA 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Chenodeoxycholic acid glycine conjugate 1 1 1 1 1 109035 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PE(10:0/13:0)[U] 1 1 1 1 1 31377 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "6beta-acetoxy-24-methylcholestan-3beta,5alpha,22R,24-tetrol" 1 1 1 1 1 1 1 1 1 112436 1 1 1 1 1 1 1 1 1 1 "3Z,6Z,9Z-Pentacosatriene" 1 1 1 1 1 1 1 1 1 61150 1 1 1 1 1 1 1 1 1 1 "1?,2?,25-trihydroxy-19-norvitamin D3 / 1?,2?,25-trihydroxy-19-norcholecalciferolcholecalciferol" 1 1 1 1 1 1 1 1 1 66548 1 1 1 1 1 1 1 1 1 1 1-(8-[5]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine 1 1 1 1 1 1 1 1 1 175763 1 1 1 1 1 1 1 1 1 1 "1,25-Dihydroxy-20S-21-(3-hydroxy-3-methylbutyl)-23-yne-26,27-hexafluorovitamin D3" 1 1 1 1 1 1 1 1 1 12840 1 1 1 1 1 1 1 1 1 1 Cyanidin 3-(6''-ferulyl-2'''-sinapylsophoroside)-5-glucoside 1 1 1 1 1 1 1 1 13471 12857 1 1 1 1 1 1 1 1 1 1 PC(O-10:1(9E)/0:0) 1 1 1 1 1 1 1 1 1 38765 1 1 1 1 1 1 1 1 1 1 "PS(17:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 27405 1 1 1 1 1 1 1 1 1 1 1 JP83 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "3a,7b,12a-Trihydroxyoxocholanyl-Glycine" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(20:3(5Z,8Z,11Z)/24:1(15Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(3R,3'R,13-cis)-b,b-Carotene-3,3'-diol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 thio-Miltefosine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Gymnodimine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Palmitoyl dopamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2'-Apo-beta-carotenal 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "Glycerol 1,2-di-(9Z-octadecenoate) 3-octadecanoate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Octadecyl fumarate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Asp Ile Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(15:0/22:4(7Z,10Z,13Z,16Z)/0:0)" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PM-toxin B 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 DMPP 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-dihydroxy-26,27-dimethyl-20,21,22,22,23,23-hexadehydrovitamin D3 / 1?,25-dihydroxy-26,27-dimethyl-20,21,22,22,23,23-hexadehydrocholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 JWH 210-d9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 trans-Anhydrotephrostachin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Linolenyl behenate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PI(14:1(9Z)/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(12:0/15:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15:1 Cholesteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Geranylfarnesyl diphosphate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PA(22:0/22:4(7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "TG(14:0/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 His Ile Val 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(14:0/20:5(5Z,8Z,11Z,14Z,17Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PA(17:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Cyclohexyl-11-heneicosanone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 (24R)-24-hydroxycholesterol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6-Deoxoteasterone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Santene 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Leukotriene D4-d5 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Beauvericin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+)-14,15-Epoxy-thapsan-14-ol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PS(O-16:0/18:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Acetylbrowniine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2'-Norberbamunine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 19-norcholestanol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Mycobactin S 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 PG(13:0/22:0) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Avermectin A2a aglycone 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Arg Arg Asp 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 XLR11 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "21-Fluoro-11beta,17-dihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "1?,25-Dihydroxy-2-[3'-(methoxymethoxy)propylidene]-19-norvitamin D3" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Lumula 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Isorenieratene/ (Leprotene) 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "PG(16:0/22:5(4Z,7Z,10Z,13Z,16Z))" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Prostaglandin E2 p-acetamidophenyl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Cassaidine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 AM3102 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 16:0 Sitosteryl ester 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1-Octadecanamine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 Solanocapsine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "DG(17:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(+)-threo-2-Amino-3,4-dihydroxybutanoic acid" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "(2xi,3xi)-2,3-Dihydroxy-12,18-ursadien-28-oic acid diacetate" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 "11?-(4-dimethylaminophenyl)-1?,25-dihydroxyvitamin D3 / 11?-(4-dimethylaminophenyl)-1?,25-dihydroxycholecalciferol" 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1