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raw data collected using MassLynx v4.2 is processed by Progenesis QI software for peak extraction, peak alignment and other data processing operations, based on the Progenesis QI software online METLIN database and Biomark’s self-built library for identification, and at the same time, theoretical fragment identification and mass deviation All are within 100 ppm.</p>MetaboLightsPublicLiquid Chromatography MS - negative - reverse phaseLiquid Chromatography MS - positive - reverse phase<p>The LC-MS system for metabolomics analysis is composed of Waters Acquity I-Class PLUS ultra-high performance liquid tandem Waters Xevo G2-XS QTof high resolution mass spectrometer. The column used is purchased from Waters Acquity UPLC HSS T3 column (1.8 um 2.1 x 100 mm)</p><p>Positive ion mode: mobile phase A: 0.1% formic acid aqueous solution; mobile phase B: 0.1% formic acid acetonitrile</p><p>Negative ion mode: mobile phase A: 0.1% formic acid aqueous solution; mobile phase B: 0.1% formic acid acetonitrile</p><p>Injection volume: 1 μL</p>Multi-omics and physiological analysis reveal the involvement of secondary metabolism and carbohydrate in drought regulation in alfalfa.Gansu Agricultural UniversityFenqi Chenrootmass spectrometry<p>Metabolites were extracted from 1-3 mg of lyophilized plant material in 1 mL of 30% methanol (v/v) supplemented with 0.01% formic acid (v/v). Samples were homogenized with glass beads in a mixer mill for 3 min at 30 Hz and centrifuged at 14,000 rpm for 20 min. Supernatants were filtered through 0.22-mm regenerated cellulose (Phenomenex, Torrance, USA) and frozen at -80 °C.</p>Medicago sativahttps://www.ebi.ac.uk/metabolights/MTBLS9934Chen Fenqi. 18893115958@163.com.Fenqi Chen. Gansu Agricultural University. Yingmencun, Anning District, Lanzhou, Gansu province. 18893115958@163.com.<p>The raw data collected using MassLynx v4.2 is processed by Progenesis QI software for peak extraction, peak alignment and other data processing operations, based on the Progenesis QI software online METLIN database and Biomark’s self-built library for identification, and at the same time, theoretical fragment identification and mass deviation All are within 100 ppm.</p><p><br></p><p>After normalizing the original peak area information with the total peak area, the follow-up analysis was performed. Principal component analysis and Spearman correlation analysis were used to judge the repeatability of the samples within group and the quality control samples. The identified compounds are searched for classification and pathway information in KEGG, HMDB and lipidmaps databases. According to the grouping information, calculate and compare the difference multiples, T test was used to calculate the difference significance p-value of each compound. The R language package ropls was used to perform OPLS-DA modeling, and 200 times permutation tests was performed to verify the reliability of the model.</p>Group18893115958@163.com<p>We used drought-resistant alfalfa WL 168 and drought-sensitive alfalfa Ganon 3 as test materials. In the artificial climate chamber, two materials were cultivated with a mixture of field soil / vermiculite (2:1 v / v), planting 5 basins (diameter: height = 130 cm: 120 cm, and 10 plants per basin). Growth environmental conditions were 16 h during daytime, with temperature maintained at 25 ± 2 °C and 8 h overnight at 22 ± 2 °C. After the emergence of alfalfa seedlings, they were watered every 3 days. The water content of each basin was kept at 70-80%, and treated after 30 days of growth. As CK, the soil relative water content was 7080%, and the soil relative water content of seedlings 7 d after drought stress treatment (DS) was 1215%. For another 1 d (r1) and 5 d (r2) of watering after drought stress, the relative soil water content was maintained at 7080%. The roots of alfalfa seedlings were sampled under each treatment, immediately frozen in liquid nitrogen and stored at -80 °C for further analysis.</p>Metabolomicsultra-performance liquid chromatography-mass spectrometryMetabolomicsdroughtultra-performance liquid chromatography-mass spectrometryMetabolomicsdrought<p>Waters Xevo G2-XS QTOF high resolution mass spectrometer can collect primary and secondary mass spectrometry data in MSe mode under the control of the acquisition software (MassLynx v4.2, Waters). In each data acquisition cycle, dual-channel data acquisition can be performed on both low collision energy and high collision energy at the same time. The low collision energy is 2 V, the high collision energy range is 10-40 V, and the scanning frequency is 0.2 s for a mass spectrum. The parameters of the ESI ion source are as follows: Capillary voltage, 2000 V (positive ion mode) or -1500 V (negative ion mode); cone voltage, 30 V; ion source temperature, 150 °C; desolvent gas temperature, 500 °C; backflush gas flow rate, 50 L/h; Desolventizing gas flow rate, 800 L/h.</p>pos_4550CorticosteroneProstaglandin G2pos_634pos_4558pos_3227pos_4557pos_636pos_4556pos_3225pos_637pos_4555pos_3224pos_630pos_4554pos_3223pos_3221pos_633pos_4551pos_3220Thiamin diphosphateEctoinepos_3229pos_4559pos_3228Pantothenol1-α-Linolenoyl-glycerol5-Oxoavermectin ''1b'' aglycone1-(5-Phospho-D-ribosyl)-5-amino-4-imidazolecarboxylatepos_4547pos_3216pos_625pos_4545pos_3214pos_3213pos_4543pos_3212pos_3211pos_621pos_3210pos_6224,11,17-Trihydroxy-5,7,9,13,15,19-docosahexaenoic acidpos_627pos_629pos_4549pos_3218Cnidilidepos_4548pos_3217Cimiracemoside DNaringenin chalconepos_656pos_4536pos_3205pos_4535pos_3204pos_4534pos_3203pos_4533pos_3202pos_4532pos_3201pos_3200pos_4530pos_3209pos_4539pos_3208pos_4538pos_3207Soyasaponin Bbpos_32067-Dehydrodesmosterolpos_14906-Methylquinoline6-Deoxyerythronolide Bpos_645pos_4525pos_1499pos_4524Lupan-3beta,20-diolpos_4521pos_642Novamethymycinpos_1493pos_1494pos_4529pos_4528L-Valyl-L-Leucinepos_4527pos_4526GentioflavosideHis His Ilepos_14813',4'-DihydrorhodovibrinEudesminpos_4514pos_45134-Hydroxycinnamyl alcohol 4-D-glucosidepos_1489pos_4512pos_1486pos_4511pos_1487cis-1,2-Dihydro-3-ethylcatecholpos_1482pos_1483pos_4519pos_4518D-UrobilinEstradiol-17betaN-Hydroxy-L-isoleucinepos_14702-ButylfuranSoyasaponin IVent-Sandaracopimaradien-3beta-olpos_4501pos_1475(-)-Carvone6-Acetamido-2-oxohexanoatepos_4509pos_4506pos_4505pos_4504FluvoxamineN-Acetylpuromycinpos_2790IndoleFusidic acidpos_612pos_2797pos_2798pos_614pos_2795pos_1464pos_2796pos_2793pos_2794pos_1460pos_611pos_2792Coniinepos_616pos_2799pos_1468pos_619Medicarpin 3-O-glucoside-6'-malonatepos_1469Tylosintrans-9(S),10(S)-DihydrodiolphenanthreneDihydroactinidiolidepos_2787pos_2784pos_2780pos_6093-Hydroxy-3-methylglutaric acidpos_605pos_606Campesterolpos_2788pos_14585-Methylcytosinepos_2775pos_2776pos_1445pos_2773pos_2774pos_1440pos_1441MorphinoneOleanolic acidpos_2779pos_27771-Deoxypentalenate4-FluorocatecholGibberellin A84-Hydroxybutanoic acidGibberellin A4UDP-2,3-bis(3-hydroxytetradecanoyl)glucosaminepos_1433pos_2765pos_1434pos_2762pos_1431pos_1432pos_2760pos_1430pos_1439pos_1437trans-Cinnamic acidpos_2767pos_1436Val IleMG(22:0/0:0/0:0)Biphenyl-2,3-diol2-Indanonepos_2753pos_2754pos_1423pos_2750DihydrokalafunginAminomalonic acid3-Phenylpropyl hexanoatepos_2759pos_14281-Methylnicotinamidepos_2757pos_2758pos_1424pos_2756pos_1425Tyrosyl-ValineCimidahurinineTryptophyl-LysineUrate-3-ribonucleosideBetulafolienetriolTaurolithocholic acidPetroselinic acidpos_2742pos_2743DESMETHYLDIHYDROCAPSAICINpos_2740Ala Cys Gln Alapos_1419pos_2749pos_1418pos_2747pos_1416pos_2744pos_1413pos_2745pos_14142-Undecanonepos_672pos_678pos_2732Nadolol14-DemethyllanosterolOctadecanoic acidpos_677pos_2739pos_1409pos_1406L-Urobilinogen7-HYDROXY-2'-METHOXYISOFLAVONEpos_1407pos_273510-OPDAMethyl salicylate-2-O-glucosideIridotrialPS(18:1/0:0)pos_661pos_662pos_664pos_666Carnitinepos_2729pos_2722pos_2723Ganoderol Apos_692pos_693pos_695pos_690pos_691pos_2710Sibiricose A5pos_698pos_699pos_2717Rumenic acidpos_2718pos_27155-Hydroxymethyldeoxycytidylatepos_2716pos_2713pos_2714pos_2711pos_27122-Amino-4,5-dihydro-1H-imidazole-4-acetic acidLysoPE 18:2(2n isomer)pos_2719pos_681pos_682pos_683pos_689pos_686pos_687pos_688pos_2707pos_2704pos_2705pos_2702pos_27033-Hydroxyechinenone(+)-dehydrovomifoliol1-(3,4-Dihydroxyphenyl)-5-hydroxy-3-decanone9alpha-Hydroxyandrosta-1,4-diene-3,17-dionePraeruptorin AMegestrol acetateTridecanedioic acid2-Hexaprenyl-6-methoxyphenolBonafousineEnantio-7(11)eudesmen-4-ol7-Methylguanosine3-Hydroxydodecanoic acidBroussonetine BN-FormiminoglycineColumbamine3-(4-Isopropylphenyl)propanal3,6-Dioxo-16-hydroxylanosta-7,24-diene-21-oic acid γ-lactone (Sendanolactone)Lipid XMonacolin L acidIcariside ICarlactoneTangeritin3',4'-Anhydrovinblastine5,11-Dodecadiynoic acidpos_16pos_17pos_18pos_19(R)-3-((R)-3-Hydroxybutanoyloxy)butanoateIsoandrocymbineArteannuin LN-heptanoyl-homoserine lactonepos_11pos_13pos_145-Chloro-2-hydroxy-p-benzoquinoneXanthoxin6,8a-Seco-6,8a-deoxy-5-oxoavermectin ''1b'' aglyconeGentamicin C1a9(S)-HODEMethymycinAdipic acidSemialactoneDesmosterol20-O-Methyl-19-chloroproansamitocinGDP-L-fucose2,19-Dihydroxy-3-oxoursa-1,12-dien-28-oic acid (Fupenzic acid)Salviol3,5,7-Trimethyl-2E,4E,6E,8E-decatetraenepos_3194pos_3192Dubione B3-Hydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dionepos_319022-Oxodocosanoate4,4-Dimethylcholesta-8,14,24-trienol16,16-dimethyl-PGA1Arteannuin APlastoquinol-1DoxycyclinePalmitoyl-EA3-NOR-3-OXOPANASINSAN-6-OLpos_3186pos_3185pos_3184pos_31835-O-beta-D-Mycaminosyltylactonepos_3182pos_3181Citpressine Ipos_3189pos_31872-hexadecenalpos_3175Tyraminepos_3174Berberine[6]-Shogaolpos_3173pos_317212-Hydroxydodecanoic acidpos_3179DeoxyadenosineIridotectoral ADecanoyl-L-carnitinepos_3164pos_3163pos_4492pos_3161pos_31601-Aminocyclopropane-1-carboxylate(E)-2-Butenyl-4-methyl-threonine5'-Phosphoribosyl-N-formylglycinamidepos_3169pos_4499pos_3168pos_4498pos_4497pos_3166pos_3165RutaretinDemethyldecarbamoylnovobiocinLucyoside Qpos_3153pos_4483pos_3151pos_3150N-Feruloylagmatinepos_3159pos_3158pos_3157pos_3156pos_4486Medicarpin 3-O-glucoside5-Hydroxypseudobaptigeninpos_4485pos_3154Pyridoxal-5'-phosphatebryotoxin B2-Methylquinolin-4-olpos_31423-O-Mycarosylerythronolide B2-Oxo-4-hydroxy-5-aminovalerateCapsidiolpos_44711-O-Feruloyl-D-Glucose(4Z,7Z,10Z,13Z,16Z,19Z)-Docosahexaenoic acidpos_3149pos_4479pos_3148pos_4478pos_3147pos_31465'-Phosphoribosylglycinamidepos_3145pos_3144L-Isoleucinepos_4474pos_3143N-CarbamoylsarcosineC20911Prohydrojasmon (racemate)C20915(S)-Chiral alcohol2-Ethyl-4-hydroxy-5-methyl-3(2H)-furanoneSoyasaponin A3Phenylpropionylglycinepos_3131pos_3130pos_4460AcacetinCinchonain 1apos_4469pos_3138pos_4467pos_4466pos_3134pos_4464pos_3133pos_3132Blumenol CFormylisoglutaminepos_4451pos_4450Gemcitabinepos_4459Narbomycinpos_4458pos_31277-Deoxyloganatepos_4457pos_3126pos_3125pos_4455pos_3124pos_4454pos_3123pos_3122pos_3121pos_3129(13S,14R)-1,13-Dihydroxy-N-methylcanadineCinerin IHomomethionineLysoPG 18:1 (2n isomer)pos_4446Stemmadeninepos_4445pos_3114pos_4444pos_3113pos_3112pos_4442pos_3111pos_4441pos_3110LysoPE(20_3(8Z,11Z,14Z)_0_0)pos_4449Hydroxy-α-Sanshoolpos_3340pos_750pos_755pos_3348pos_2016pos_756pos_3347(3E)-3-[(1R,5R,6S)-5-Hydroxy-7-oxabicyclo[4.1.0]heptan-2-ylidene]-2-oxopropanoatepos_2017pos_757pos_3346pos_2014pos_758pos_4676pos_3345pos_2015pos_751pos_3344pos_752pos_3343pos_753pos_3342pos_2010pos_754pos_4672pos_3341Coniferyl alcoholpos_759pos_33492-Methylbenzoic acidpos_466028-Glucosylarjunolate 3-[rhamnosyl-(1->3)-glucuronide]pos_4668pos_3337pos_4667pos_33364alpha-Methylzymosterolpos_4666pos_3335pos_2003pos_747pos_4665pos_740pos_3333pos_2001pos_4663pos_3332pos_742pos_4662Arecolinepos_743pos_4661Pentalenatepos_3330pos_2000pos_748pos_749HYDROXYCITRIC ACIDpos_4669pos_3338pos_2008Abu-Phe4Cl-OHpos_770L-Aspartyl-L-phenylalaninepos_771pos_772Kanamycin Bpos_777pos_4657pos_778pos_4656pos_4655pos_3324pos_4654pos_3323pos_3322Estrone 3-glucuronidepos_33216'-Oxokanamycin Xpos_775pos_4651pos_776pos_4650L-AsparagineCOTARNINE(-)-Momordenol;Momordenolpos_4659pos_3328pos_4658pos_3327pos_761Teasteronepos_766pos_4646pos_3315pos_767pos_4645pos_3314pos_3313pos_769pos_4643pos_3312pos_4642pos_3311pos_3310pos_764pos_4640pos_765pos_4648pos_3317triptriolidepos_4647pos_3316Trypanothione disulfideValyl-HistidineNeopikromycin5,6-Dihydroxyindole1H-Indole-3-propanoic acidGuanosinepos_4635Dichotosinpos_712pos_4634pos_3303pos_4633pos_4631pos_4630Dihydropteroatepos_710pos_3309pos_715pos_3308pos_716pos_4638pos_717pos_4637pos_718pos_33056-HydroxynicotineHaematopodinSpisulosinepos_1598pos_1599pos_4622pos_703pos_4621pos_462015R-PGE2 methyl esterpos_1592pos_709pos_4629PisatinKuguaglycoside Cpos_4627pos_706pos_707pos_4625C16 Sphingosinepos_733pos_1587pos_734pos_735pos_4611pos_1585pos_736pos_46109E-Octadecen-12-ynoic acidpos_731α-Linolenoyl Ethanolamidepos_1581pos_732Persicogenin4-HydroxydihydrocinnamaldehydeNigaichigoside F1pos_4619pos_4618pos_737pos_4617pos_738pos_739pos_4615pos_1589pos_4614CeruleninLysoPE 18:1(2n isomer)pos_722pos_723pos_4601pos_1577pos_1574pos_725pos_1572pos_720pos_7212-Heptyl-3-hydroxy-quinolonepos_1571pos_4609Cycloheximidepos_4608pos_4607pos_726pos_4606pos_727pos_4605pos_728pos_4604pos_7292-Amino-4-oxo-6-(1,2-dioxoprolyl)-7,8-dihydroxypteridineGlucocerebrosidesLysoPE 16:37-Ethyl-3,6-dihydro-1,4-dimethylazulenepos_2896pos_2897pos_1566Biotin sulfoxidepos_2895pos_2892pos_2893D-erythro-1-(Imidazol-4-yl)glycerol 3-phosphatepos_2891pos_1560Ophthalmatepos_2899Icosatrienoic acidThiourocanic acidFeruloylspermidineAmbolic acidpos_2885Glu Ile Leupos_2886pos_2883pos_28842,4,6,8-decatetraenalpos_2882pos_1551UDP-2-acetamido-4-(D-alanylamino)-2,4,6-trideoxy-alpha-D-glucosepos_2889pos_2887pos_2888Scopolinpos_2875pos_1544pos_2872pos_1541pos_2873(2'S)-Deoxymyxol 2'-(2,4-di-O-methyl-alpha-L-fucoside)pos_1549pos_2878pos_1547pos_2879pos_1545pos_287730-Norhederageninpos_2864pos_1533AMINOHYDROXYBUTYRIC ACIDpos_2862Polyethylene, oxidizedPaspalininepos_2869pos_15392-Undecylpyrrolepos_2868pos_2865pos_1535(3S,4R)-3,4-Dihydroxycyclohexa-1,5-diene-1,4-dicarboxylatepos_792pos_793pos_7942-Hydroxy-6-oxoocta-2,4,7-trienoatepos_7904-Methylumbelliferyl beta-D-glucuronidepos_799pos_2852pos_2853Rabdosia acid Apos_2851pos_797Zeinoxanthinpos_2858pos_1527pos_2856Betainepos_2857pos_1526pos_28543,4-Dihydroxyphenyl ethanolpos_28559-Hydroxygeraniolpos_780pos_7812-Deoxy-D-ribose 1-phosphatepos_783Ginsenoside Rh2pos_2841pos_2840pos_784pos_786AphidicolinHeneicosanoic acidCytidinepos_7873-O-trans-Feruloyleuscaphic acidpos_1519pos_2847pos_2848pos_2845pos_2846pos_15151,2,3,4-Tetrahydro-1-phenyl-4-(2-phenylethyl)naphthalenepos_2830pos_2831pos_2838pos_28393-Nitrotoluenepos_1508pos_2837pos_1504pos_2832pos_1501pos_2833pos_1502LysoPC 18:3(2n isomer)pos_1509N-oleoyl tryptophanN-Acetyl-alpha-D-glucosamine 1-phosphateTriphenylphosphine oxidepos_5093Docosatetraenoyl EthanolamideDesmethylfluoxetinepos_5094pos_50961-Palmitoylglycerolpos_5098pos_2827pos_2828pos_2825pos_2826pos_2823pos_2824pos_2821pos_2822Priverogenin AL-Anticapsinpos_5082pos_5084pos_5086pos_5088pos_5089L-Homoserinepos_2817pos_2814pos_2812pos_5090pos_50912-Deoxy-scyllo-inosaminepos_5092Xylometazolinepos_2818pos_2819pos_50795-Hydroxy-1-(4-hydroxyphenyl)-3-decanonegamma-Glutamyl-beta-aminopropiononitrilepos_5071pos_5073Lysyl-Aspartatepos_5075pos_5076pos_5077pos_5078Isoleucyl-IsoleucineIsopropyl myristatepos_2806pos_2801pos_2802Styrenepos_2800Antibiotic JI-20BSoyasaponin VIPterolactamAntibiotic JI-20Apos_2809pos_2808pos_5069pos_5060pos_5061pos_5062DehydrocommersonineCinncassiol Apos_5066Canusesnol JSyringaresinol-4'-O-glucosideJasminoside CZingibroside R1(1R,10aS)-1,4,10,10a-Tetrahydrophenazine-1-carboxylatepos_5057pos_5058pos_5059Inundatinepos_5050Isoleucyl-Alaninepos_5051pos_5052pos_5054pos_5055pos_5056Agarotetrol1α,25-dihydroxy-26,27-ethanovitamin D3 / 1α,25-dihydroxy-26,27-ethanocholecalciferol3-(Carboxymethylamino)propanoic acidpos_5047pos_5048pos_5049pos_5040pos_5042pos_5043pos_5044o-Xylenepos_504521,22-Diprenylpaxillinepos_5035pos_5036Hydroxyamobarbitalpos_5039Arachidonoyl SerinolLovastatin acidUndecylic Acidpos_5030Dihydrozeatin-O-glucosidepos_5032Tetradecanoic acidpos_5033Megalomicin C2HypoxanthineN6-methyladenosinepos_50251-(5'-Phosphoribosyl)-5-amino-4-imidazolecarboxamidepos_5026pos_5029pos_5020pos_5021pos_5022Goshuyic acidN-Isopropylammelide(-)-BetonicinePinfaensic acidgamma-L-GlutamylputrescineRetinol / Retinol skeletonpos_5013Ethyl (2E,4Z,7Z)-Decatrienoate2-Pyrrolidone-5-carboxylic acid, methyl esterpos_5015Deacetylbowdensinepos_5016pos_5018AcetamideLeu Leu8-Methylthiooctanaldoxime7-Aminomethyl-7-carbaguaninepos_5012(1R,6S)-1,6-Dihydroxycyclohexa-2,4-diene-1-carboxylateCannabielsoic acid BCurloneAnofinic acidNG,NG-dimethyl-L-arginine (ADMA)pos_5007pos_5008pos_5009Riesling acetalCholic acidthesiusideALPRENOLOLAbscisic aldehyde9,12,15-Octadecatrien-1-olRhodinyl phenylacetatepos_3294pos_32926'-O-Glucosylaucubinpos_3291pos_3290CiliatocholateErythronolide BCucurbitacin DArbutinpos_3297tert-butyl p-ToluateNorepinephrine (noradrenaline)Nicotinamidepos_3285pos_3284pos_3283pos_3282pos_3281pos_3280Cyclooctat-9-ene-5,7-diolpos_8101β-Hydroxy-2-oxopomolic acidpos_812PhthalateCys Ile Tyrpos_813pos_3288pos_3287pos_3286pos_818Salidrosidepos_819pos_814pos_815delta-Tomatinepos_816pos_8173''-Oxoribostamycinpos_3273pos_3272pos_3271Biochanin Apos_3270pos_801Histidinyl-Histidinepos_32793-O-alpha-Mycarosylerythronolide Bpos_3278pos_3277pos_807pos_808Deoxyguanosinepos_803pos_805Campestanol(±)7-epi Jasmonic Acid2,3-Dehydro-gibberellin A9(S)-2,3,4,5-Tetrahydropyridine-2-carboxylatepos_4594pos_4593pos_3262pos_3261pos_4591pos_459024-Hydroxy-beta-amyrinpos_3269pos_4599pos_32686-Keto-prostaglandin F1alphapos_45985-Carboxymethyl-2-hydroxymuconatepos_4596pos_3265pos_4595pos_4583pos_3252pos_3251Salsolinepos_4581pos_3250pos_4580Secologaninpos_4589pos_3258pos_4588pos_3257pos_4587pos_3256pos_4586pos_3255pos_3254Geranyl-hydroxybenzoatepos_3253Pseudaminic acidpos_3241pos_3240pos_4570Butanoic acid2-Deoxy-scyllo-inososepos_3249pos_4579pos_3248pos_4578pos_4577pos_4575pos_32449,10-Epoxyoctadecanoic Acidpos_4574pos_4573pos_3242Tridecanoic acid (Tridecylic acid)C20819LysoPE 20:5LysoPE 20:2pos_4561pos_3230pos_4560pos_4569pos_3238pos_3237pos_4567pos_3236pos_4566pos_3234pos_3233pos_4563pos_4562pos_3231N1-Acetylsperminepos_3239CaloxanthinN-Nitrosodiethylaminepos_1282S-Adenosylmethioninaminepos_1283pos_5642pos_1280pos_1281cis-Abienol9,10-DHOMEpos_5645pos_5646pos_56472,3-Dihydrothienamycinpos_4313pos_1289pos_4312pos_1286pos_1287pos_128413(S)-HOTrEpos_1285pos_4318L-Histidinepos_1271pos_1272pos_5631pos_5632Tetracosanoic acidpos_1270pos_563324-Norursa-3,12-dien-11-onepos_5634pos_5635D-SphingosineHopane-29-acetatepos_1279δ-Tridecalactone(-)-Medicarpinpos_1277pos_4302pos_1278pos_1275pos_4300pos_1276pos_1273pos_4306pos_5637Methylimidazole acetaldehydeIndigopos_1260pos_1261pos_5620pos_5621pos_5622pos_5623pos_5624pos_414pos_2599pos_1268pos_415Avermectin A1b monosaccharidepos_1266pos_417pos_2598pos_1267pos_410pos_2595pos_2596pos_1265pos_412pos_2593pos_2594pos_1263IsoelemicinN6-(L-1,3-Dicarboxypropyl)-L-lysine5'-S-Methyl-5'-thioinosinepos_418pos_419pos_5626pos_5627pos_56286-DeoxocastasteroneGlutathione12,13-DHOMEpos_2580pos_2581pos_5610pos_5611pos_5612pos_1257pos_404pos_1258pos_2586pos_1255pos_1256pos_2584pos_1253pos_400pos_2585pos_125413-DeoxycarminomycinBryononic acidpos_2582pos_1251pos_402pos_2583S-(Hercyn-2-yl)-L-cysteine S-oxidepos_407pos_409pos_5616Dioscinpos_5619Valyl-Isoleucinepos_5600pos_5601pos_5602pos_5603pos_2577pos_1246pos_2578pos_1247Erucic acidpos_2575pos_1244pos_1245pos_2573pos_1242pos_2574pos_2571pos_2579pos_1248Piperideinepos_56068-Amino-7-oxononanoatepos_5607pos_5608pos_5609pos_38902-Amino-5-epi-valiolone24-p-Coumaroyloxy-2,3-dihydroxyurs-12-en-28-oic acid (Guavacoumaric acid)pos_3898pos_2566pos_1235pos_3897pos_2567pos_1236pos_2564pos_1233Benzyl alcoholpos_1234pos_3894pos_2562pos_1231LysoPC 140pos_1232pos_3892pos_2560pos_3891pos_1230pos_1238Clavaminic acidNebramineAzukisaponin IVpos_1224pos_3886pos_2556pos_1225pos_3885pos_2554pos_1223pos_2551pos_2552pos_1221pos_2550pos_1228pos_2557pos_1226pos_3888pos_2558pos_1227PalmitoleamideTricycloekasantal(S)-NorlaudanineCyclopentolatepos_2544pos_12133-Methoxy-4-hydroxyphenol-1-O-β-D-glucoside (Tachioside)pos_2545pos_1214pos_3874pos_2542pos_1211pos_2543pos_1212pos_3872pos_3871pos_1210pos_3870pos_1219pos_2548pos_1217pos_2549pos_1218pos_2546pos_12162-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate5S,8R-DiHODE; (5S,8R,9Z,12Z)-5,8-Dihydroxyoctadeca-9,12-dienoatedTDP-4-acetamido-4,6-dideoxy-D-glucose9,12,13-Trihydroxy-10,15-octadecadienoic acidIsomaltotrioseLysoPC 190pos_474pos_4755-Amino-5-deoxy-3-dehydroshikimatepos_1202pos_2534pos_1203pos_2531pos_1200Tetradecanedioic acidpos_3862pos_1201Phoenicoxanthinpos_477pos_478pos_479Durupcoside Bpos_2539pos_1208pos_1209pos_3869pos_2537pos_1206pos_2538pos_1207pos_2535pos_1204pos_25369,10,18-Trihydroxystearic acidLysoPA 18:0 (2n isomer)pos_461pos_462pos_463pos_464pos_469pos_2522pos_2523pos_385210-Deoxygeniposidic acidpos_4659-HOTEpos_466pos_3859pos_3858pos_3857pos_25275-DehydroavenasterolSapindoside Bpos_252510-DeoxymethymycinSclareolideLysoPE 15:0LysoPE 15:1pos_495pos_496LysoPC 170pos_497N,N-Dimethylethanolamine N-oxidepos_491pos_493pos_2512pos_2510pos_498N-Lauryldiethanolaminepos_4994-HydroxyphenylacetateGuaninepos_25171-Benzyloxy-1-(2-methoxyethoxy)ethanepos_3848pos_2518pos_2515pos_2516pos_2513pos_2514pos_483Tetrahydrozolinepos_484pos_480pos_482pos_2500pos_2501Norsolorinic acid anthronepos_4872,4,6-undecatrienalpos_489Citric acidpos_2506pos_3837pos_2507pos_2504pos_2505pos_250222alpha-Hydroxy-campest-4-en-3-onepos_3833pos_2503Novobiocin6'''-Deamino-6'''-hydroxyparomomycin IIpos_431pos_3821Tylactone2-Deoxystreptaminepos_438pos_433pos_435VolicitinN6-(Delta2-Isopentenyl)-adeninepos_3824p-Hydroxynorpseudoephedrinepos_38227-DehydrocholesterolDL-Pipecolic Acidpos_420Squalenepos_427pos_428pos_421pos_422pos_423pos_3817pos_3816pos_429pos_3814pos_3813ML-236Cpos_45111-cis-Retinolpos_458Echinenonepos_457Tyrosyl-Glutaminepos_380411-Keto-.beta.-boswellic acidpos_441pos_442pos_448pos_4493,16-Dihydroxylanosta-7,24-dien-21-oic acid Gamma-lactone (Kulolactone)pos_445pos_446CalcidiolSpirilloxanthin[8]-Gingerdione5,6-EpoxytetraeneGlu Val Tyr2-HydroxynicotineDidymin(E)-4,8-Dimethyl-1,3,7-nonatriene2,6-DihydroxypseudooxynicotineHexadecanoic acid, 2-amino-, (R)-; (R)-2-Aminohexadecanoic acidVinblastineNortrachelogenin-4-O-glucosidecyclo-Dopa-glucuronylglucosidePseudobaptigenin2''',3'''-EpoxylupinifolinL-Tryptophan(22S)-1α,22,25-trihydroxy-26,27-dimethyl-23,23,24,24-tetradehydrovitamin D3 / (22S)-1α,22,25-trihydroxy-26,27-dimethyl-23,23,24,24-tetradehydrocholecalciferol25-hydroxy-23-oxavitamin D3 / 25-hydroxy-23-oxacholecalciferol2(3H)-BenzothiazoloneMaglifloenoneDemethylmacrocin3'-DemethylstaurosporineDehydroascorbaten-Octanamide3beta-Hydroxyergosta-7,24(24(1))-dien-4alpha-carboxylateDeoxyguanidinoproclavaminic acid3,4-Dihydrocadalene6-DeoxydihydrokalafunginJujubogeninpos_4296pos_4291pos_4290N-(beta-D-Glucosyl)nicotinatepos_4298(ent-15beta)-15-Hydroxy-19-trachylobanoic acidRhipocephalin1,1-Dimethylbiguanide(4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,1 6,19-Docosahexaenoic acidpos_4286pos_42846-pentadecyl Salicylic Acidpos_4283pos_4281pos_4280pos_4288pos_4287alpha-TocotrienolOleandolidepos_4275pos_4274pos_4273pos_4271pos_427016-Feruloyloxypalmitatepos_4278pos_4277pos_4276pos_4264pos_4263pos_5598pos_4260pos_5591pos_42692,5-dimethyl-7-hydroxy-chromonepos_4268pos_5593pos_4267pos_4266pos_5595pos_4265N,N-dimethyl-SafingolLys Lys Met Ilepos_5585pos_4253pos_5586pos_4252pos_4251pos_5588Toxyl angelatepos_4250ApiforolNG,NG-Dimethyl-L-argininepos_4259pos_4258pos_4257Aclacinomycin Apos_5582I-Urobilinogenpos_5583pos_5584pos_5574pos_4242pos_4241pos_42406,8,10,12-pentadecatetraenalpos_5577Cuneatin methyl etherpos_5579pos_4249pos_4248Ergosta-5,7,22,24(28)-tetraen-3beta-olpos_5572pos_4243Maslinic AcidLycofawcineStreptomycin 6-phosphateArginyl-Arginine6alpha-Hydroxy-castasteronepos_5563Histidinyl-Asparaginepos_5567pos_5568pos_4238pos_4237pos_5560pos_5562Histamine (phosphate)pos_4220pos_1194pos_5553pos_1192pos_5555pos_1193pos_5556pos_1190pos_5557pos_1191pos_5558pos_5559pos_4228pos_4227pos_4225pos_1198pos_4223pos_1199alpha-Santalyl acetatepos_4221pos_1197(1R,5aS,6R)-4a-Hydroxy-1,4,4a,5,5a,6,9,10a-octahydrophenazine-1,6-dicarboxylatepos_4229pos_1184pos_5543pos_1182pos_55452-Amino-5-formylamino-6-(5-phospho-D-ribosylamino)pyrimidin-4(3H)-onepos_5546pos_1180pos_5548pos_4217pos_4216Thromboxane B2pos_4215pos_1189pos_1187pos_1188pos_1185pos_5540pos_4210Loganic Acidp-Cresolpos_4219pos_421810-Deacetylbaccatin IIIpos_5530pos_1172pos_5531pos_1173pos_5532pos_1170pos_5533pos_1171pos_5534pos_5535pos_5536pos_5537pos_4205pos_1178pos_1179Fumiquinazoline Apos_1176pos_4201pos_1177pos_1175Pyridoxal phosphatepos_4209Isopentenyladenine-9-N-glucosidepos_4208Avermectin A1apos_5538pos_513pos_4437pos_3106pos_514pos_3105pos_515pos_4435pos_3104pos_516pos_4434pos_3103pos_4433L-Pipecolatepos_4432pos_3101pos_512Deoxyinosinepos_518pos_3109pos_519L-2,4-Diaminobutanoatepos_4438pos_3107Rifamycin W-hemiacetalpos_1392pos_1391pos_44264-methoxy DMTpos_4424pos_1398pos_505pos_4423pos_4422pos_500pos_4420pos_506pos_508pos_4428pos_4427pos_1381pos_1382Glucosamine1-Hexadecanolpos_1380ProtopanaxtriolElwesine5-Aminoimidazole ribonucleotideIsolindleyinpos_535pos_4415pos_4413pos_538pos_4412pos_1388alpha-Methylstyrene3-beta-D-Galactosyl-sn-glycerolpos_4410pos_1386pos_4419pos_4417pos_4416pos_1370DemissineGly Val Leu ThrCathasterone(9Z)-Octadecenoic acidpos_13784'-Hydroxy-3,4,5-trimethoxystilbenepos_1379pos_4402Astringinpos_1376pos_4401pos_520pos_1374pos_521pos_1375pos_1372pos_1373N-Acetylcadaverinepos_4409Isoacteosidepos_528pos_4408Dihydrocapsaicintrans-Crocetin (beta-D-glucosyl) (beta-D-gentibiosyl) esterpos_4405Vitamin D3pos_1360Tridecanoic Acidpos_2698pos_13674-Isopropylphenylacetaldehydepos_1368pos_1366pos_1363pos_2695Delta-12-Prostaglandin J2pos_1364pos_2692pos_1361Pseudouridine 5'-phosphatepos_1362Phenylalanyl-Glutaminepos_1369Prostaglandin F2alphapos_2680pos_2687pos_1356pos_1357pos_2685Loganinpos_2686pos_1355pos_2683pos_1352pos_2684pos_1353pos_1350pos_2682pos_1351pos_1358pos_1359GarbanzolAvermectin B1b aglyconeNomilinic acidpos_5700pos_5701pos_2676pos_1345pos_1346Monopalmitinpos_2675pos_1344pos_2673pos_2670Halaminol Apos_2671pos_1340pos_2678pos_1347pos_2679pos_1348pos_5703pos_5704LysoPC 18:3pos_5705Swainsoninepos_57092,3,23-Trihydroxyolean-12-en-28-oic acid methyl esterpos_1334pos_3996pos_2666pos_1335pos_2663pos_1332pos_1333pos_2661pos_1330pos_3992pos_2662pos_1331pos_3991pos_2669pos_1338pos_1339pos_3999pos_2667pos_1336pos_3998pos_2668pos_1337GW 7647pos_5958,9-EETpos_5925-Hydroxymethylcytidinepos_3986pos_1323pos_3985pos_2655pos_1324pos_3984pos_1321pos_1322pos_597pos_2650pos_59818-Hydroxyoleatepos_13201,2,3,4,5,6-Hexahydro-7H-cyclopenta[b]pyridin-7-onepos_599Actinidinepos_1329pos_2658pos_1327pos_2659pos_1328pos_50pos_1325pos_51pos_3987pos_2657pos_1326N-methylundec-10-enamidepos_52pos_53pos_54pos_55pos_56pos_57pos_58pos_59pos_49pos_583pos_584pos_585Cycloeucalenonepos_1312pos_3974pos_2644pos_1313pos_1310pos_3972pos_2642pos_1311pos_587pos_3970pos_588pos_589Byzantionoside Apos_2649pos_1318pos_1319Hexacosanoyl carnitinepos_2647pos_3978pos_3977pos_2645pos_1314pos_3976pos_40pos_2646pos_1315pos_41pos_429,10-12,13-Diepoxyoctadecanoatepos_44pos_45pos_46pos_47pos_48Anhydrorhodovibrinpos_38pos_39gamma-Tomatinepos_3964pos_2632pos_1301Arg Val Arg Alapos_3963pos_1302pos_3962pos_2630pos_1300pos_3960pos_2638pos_1307pos_3969pos_1308pos_3968pos_2636pos_3967pos_2637pos_3965pos_2635pos_30pos_31pos_32pos_33pos_34pos_35pos_36pos_37pos_27pos_28pos_294-Vinylcyclohexenepos_3953pos_2621pos_3952pos_2622pos_3951pos_2629pos_3959pos_3958pos_3956pos_2626pos_3955pos_3954pos_20Cyanidin 3-O-(2-O-beta-D-glucuronosyl)-beta-D-glucosidepos_21pos_22pos_23pos_24pos_25pos_26pos_550pos_552pos_3942pos_2610pos_559pos_553pos_554Propamocarbpos_556Arg Ser Arg Valpos_2619pos_90pos_91pos_2617pos_3946pos_93pos_3945pos_945-O-beta-D-Mycaminosyltylonolidepos_96pos_97pos_98pos_99Jasmonic acidPerillyl aldehydeTrimethyllysinepos_546pos_3931pos_3930pos_2600pos_549pos_544pos_545pos_2607pos_3938pos_2608pos_3937pos_2605pos_80pos_81pos_3935N-Methylserotonin(R)-(+)-2-Pyrrolidone-5-carboxylic acidpos_82pos_3934pos_83pos_3933pos_2601pos_84pos_3932pos_2602pos_85pos_86pos_87L-Lysinepos_88pos_89PterosupinDemethyllactenocinKadcoccinic acid Ipos_570pos_3920(9Z,12Z,15Z)-Octadecatrienoic acidpos_575pos_576Dodecanoic acid3,7-Dimethyl-2E,6E-decadien-1,10-dioic acidpos_577pos_578pos_3928pos_3926Artemisinin Bpos_70pos_71pos_3923pos_72pos_3922pos_73pos_74L-Arabinono-1,4-lactonepos_75pos_76pos_77pos_78Tomentosolic acidpos_79pos_560pos_561pos_562pos_5635-Oxo-delta-bilirubinpos_569Deacetylvindolinepos_5643,4,5-Trimethoxybenzoic acid methyl esterpos_565Tigogeninpos_566pos_567Cis-Zeatin-7-N-glucosidepos_3915pos_3914Toluene-cis-dihydrodiolpos_60pos_3912pos_61pos_3911pos_62pos_3910Farnesyl acetonepos_63pos_64pos_65pos_66Sulfatepos_67pos_68pos_69Isonicotinic acidpos_3918pos_3906pos_3905Bacilysinpos_3902pos_39014'-Oxonebramine1-(4-Hydroxyphenyl)-1-decene-3,5-dionepos_3909Androsinpos_3908pos_3907Lisinopril(Ethoxymethyl)benzeneMomordicin IV;Momordicine IV9-hydroxy-5Z-nonenoic acid19-Hydroxyandrost-4-ene-3,17-dioneDocosatrienoic AcidClavulanic acidTarasaponin VICocamidopropyl betaineShikimate(7Z,10Z,13Z,16Z,19Z)-Docosapentaenoic acidAvermitilol1'-Hydroxy-gamma-carotene7-HYDROXY-8,4'-DIMETHOXYISOFLAVONEGln Ala Phe4-Allylcatecholpos_3097pos_3096pos_3095pos_3094pos_3093N-Desmethylselegilinepos_3099Dehydroepiandrosteronepos_3087pos_3086pos_3085Colforsinpos_3084pos_3083alpha-Linolenic acidpos_3082Benzothiazolepos_3081Ascorbic acid 6-palmitateAdoxosidic acidalpha-D-Glucosamine 1-phosphate3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestanoatepos_3090Lycoperoside Hpos_3076pos_3075pos_3074pos_3073pos_3072pos_3071pos_30702-Ethyltoluenepos_30791-Oleoyl-sn-glycero-3-phosphocholinepos_3078Elatoside Gpos_3077Maohuoside A6-Phenyl-3-hexen-2-oneVeatchineBufexamacGanoderiol Fpos_4396pos_3065pos_4395pos_3064pos_4394pos_3063pos_4393pos_3062pos_4392pos_3061pos_4391pos_4390Phylloquinone (Vitamin K1)pos_4398pos_4397pos_306613S-Hydroperoxy-6Z,9Z,11E-octadecatrienoic acid3,5,7-Trimethyl-2E,4E,6E,8E-undecatetraeneMeliasenin EPS(18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))Caffeinepos_3054pos_4384pos_3053pos_3052pos_3051pos_3050pos_4380dTDP-3-N,N-dimethylamino-2,3,6-trideoxy-4-keto-D-glucoseO-beta-D-Glucosylzeatinpos_4389pos_3058pos_4387pos_3055beta-Sitosterol7-METHOXYCHROMONEpos_3043pos_4373pos_3042pos_30412-Amino-1,3-eicosanediolpos_4370Obscuraminol A(+)-Vulgraon Bpos_3048pos_4378pos_30471-Hydroxybisabola-2,10-dien-4-onepos_3046pos_437622(R)-Hydroxycholesterolpos_4375Ala Phe Asn AlaSarcaglaboside BDeoxytubulosinepos_5695pos_4363pos_3032pos_5696pos_5697pos_4361pos_3030pos_5698pos_4360pos_56993-Dimethylallyl-4-hydroxybenzoateα-Linolenic acidpos_4369pos_5690pos_3037pos_5691pos_3036pos_5692pos_56934alpha-Methyl-5alpha-ergosta-8,14,24(28)-trien-3beta-olpos_5694pos_4364pos_3033α-Spinasterol2',4',6',3,4-Pentahydroxy-3'-geranyl-5-prenyldihydrochalcone1-Hydro-1,1a-dihydroxy-9-fluorenonepos_56841-Eicosanolpos_4352pos_3021pos_3020pos_4350pos_4358Thymidinepos_4357pos_3026pos_4356pos_3025pos_5681pos_4355pos_3024pos_5682pos_4354pos_3023pos_5683Eicosanoyl-EApos_435311-Keto-ursolic acidCostunolide16-Hydroxy-3-oxolanosta-7,24-diene-21-oic acid Gamma-lactone (Kulactone)18α-GLYCYRRHETINIC ACIDTuberonic AcidOleandomycin4-hydroxyestradiolDihomo-gamma-linolenatepos_4341pos_3010pos_5674pos_4340pos_5675pos_5676Cyclo(Tyr-Ala)pos_5678pos_56795,6-DiHETrE [(±)5,6-dihydroxy-8Z,11Z,14Z-eicosatrienoic acid]pos_3018pos_3017pos_4347pos_30165-methoxytryptophanpos_4346pos_3015pos_3014pos_5670pos_43432,3-Dinor-11b-PGF2a34a-Deoxy-rifamycin WOvalitenin BMabioside Apos_5662pos_56631'-Hydroxyversicoloronepos_5664N-Acetyl-L-2-amino-6-oxopimelatePG(18_2(9Z,12Z)_18_0)pos_56684-Hydroxysphinganinepos_5669pos_4338pos_3007pos_4337pos_3006pos_4336pos_3005pos_4334pos_4333pos_3002pos_4332pos_3001pos_5661pos_3000Gluconapinpos_3009pos_30083-Amino-2,3-dideoxy-scyllo-inososeEpinephrinepos_1294pos_5653pos_129213Z-DocosenamideAndrosta-1,4-diene-3,17-dionepos_1290(9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoic acidpos_5657pos_5658pos_4326pos_1299pos_4323BayogeninDeoxycytidineDocosahexaenoic Acid ethyl esterpos_43291-Methyl-4-phenyl-1,2,3,6-tetrahydropyridineQuercetin-3-O-methyl etherpos_2371Saikosaponin Epos_1040Saikosaponin Fpos_2372pos_1041pos_5400pos_5401Norsolorinic acidSaikosaponin Apos_5404Schirubrisin Bpos_2379pos_1048pos_1049pos_2377pos_1046pos_2378pos_1047pos_2375pos_1045Diethyl decanedioatepos_1042pos_1043Saikosaponin RMG(18:2(9Z,12Z)/0:0/0:0)[rac]pos_5406pos_5407pos_5408pos_5409pos_3692pos_2360pos_3691pos_23616-[5]-ladderane-1-hexanol2H-Indol-2-one, 1,3-dihydro-7-hydroxy-4-[2-(propylamino)ethyl]-Auxin bProlyl-Asparaginepos_2368pos_1038pos_3698pos_2366pos_1035pos_3697pos_1036pos_3696pos_2364pos_1033pos_3695pos_2365pos_3694pos_2362pos_1031pos_3693pos_1032Momordin Ic7-Aminocephalosporanic acidpos_1039Ser Phe6,8-Dimethyl-6,7-didehydroergoline20alpha-Hydroxycholesterolpos_3681pos_2350BetaninPhyllodulcinpos_2357pos_1026pos_3688pos_235824-Ethylidenelophenolpos_2355pos_1024pos_3686pos_1025pos_3685Saikosaponin B3pos_2353pos_1022pos_3684pos_2354pos_1023pos_3683pos_2351pos_1020pos_3682pos_2352pos_1021N6-Acetyl-L-lysineHordenineMelilotussaponin O1Pinocembrinpos_2359pos_1028pos_10293'-Amino-3'-deoxy-AMPpos_3670NorthienamycinAlismoxidepos_3678pos_2346pos_1015pos_3677pos_1016pos_1013pos_3675pos_2345pos_1014pos_2342pos_1011pos_2343pos_1012pos_3672pos_2340pos_3671pos_2341pos_1010pos_1019pos_3679pos_1018(1R,6R)-6-Hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate6''-O-Carbamoylkanamycin Apos_4990PGD2PGD3Methyl (2E,6Z)-dodecadienoatepos_4998pos_3667pos_2335pos_1004pos_3666pos_2336pos_1005pos_4996pos_3665pos_2333pos_1002pos_4995pos_3664pos_2334pos_3663pos_1000pos_4993pos_3662pos_1001pos_3661pos_36601,3-Diisopropylbenzenepos_1008pos_1009pos_3669pos_2337pos_1006pos_4999pos_3668pos_10075,10-Methenyltetrahydromethanopterin7,10-Hexadecadiynoic acidpos_2324pos_4986pos_3655pos_2325Gentamicin Apos_4985pos_3654pos_2322pos_4984pos_3653pos_2323pos_4983pos_3652pos_2320pos_4982pos_3651pos_2321pos_4981pos_3650pos_4980pos_2328pos_3659pos_2329pos_4989pos_3658pos_3657pos_232712-Methyltetradecanoic Acidcannflavin B1α,25-dihydroxy-26,27-dimethylvitamin D3 / 1α,25-dihydroxy-26,27-dimethylcholecalciferolpos_2313pos_3644pos_2314pos_4974pos_36431-Tetradecanolpos_2311pos_2312AminoDHQ16-Methyl-epi-nigakihemiacetal B2-Octaprenyl-6-methoxy-1,4-benzoquinonepos_3649pos_2317pos_4979pos_2318pos_49783-Dehydro-6-deoxoteasteronepos_2315pos_4977pos_3646Pseudopelletierine(3S)-3-Hydroxy-N6,N6,N6-trimethyl-L-lysine13-OxoODE(1E,4S,5E,7R)-Germacra-1(10),5-dien-11-ol(1R)-α-Pinene9-OxoODEpos_4965pos_2302pos_3633pos_3632pos_2300pos_3631pos_2301pos_3630pos_4960cis-3-Hexenyl hexanoatepos_2308Tacrolimuspos_3638pos_4968pos_3637pos_2307pos_4967alpha-Hydroxylinoleic acidpos_3636pos_2304pos_4966pos_3635pos_2305L-Leucyl-L-Leucinepos_230pos_231pos_232pos_233pos_3623pos_238pos_3622pos_239pos_4952pos_3621pos_3620pos_4950pos_234pos_235pos_236pos_237pos_3629pos_3628pos_4958pos_3627pos_3626pos_4956pos_3624Sphingosinepos_220pos_221pos_2229,12,13-TriHOMEpos_3612pos_227pos_4942pos_3611pos_228pos_3610pos_229pos_49406(1H)-Azulenone, 2,3-dihydro-1,4-dimethylpos_223pos_22420alpha,22beta-Dihydroxycholesterolpos_225pos_226pos_3619pos_4949pos_3618pos_4948Psychosinepos_3617pos_4947pos_3616Buprenorphinepos_4946pos_3615pos_4945pos_4944pos_3613Reduced FMNEicosenoic acidMelibiitolN(omega)-Hydroxyargininepos_252pos_253pos_254pos_255pos_250pos_251pos_4932pos_4931pos_4930pos_256pos_258pos_259pos_3609pos_49391,14-Tetradecanedioic Acidpos_3608pos_4938pos_3607N,N-Dihydroxy-L-isoleucinepos_4937pos_3606pos_3605pos_3604pos_3603pos_3602Tyrosyl-Alaninepos_241pos_242pos_243pos_244C16 Sphinganinepos_240pos_249pos_245pos_246pos_1892pos_247pos_248Hydroxypyruvate7-Methylguaninepos_4928pos_4926pos_4925pos_1899pos_4924pos_4923pos_4922pos_1898Oleoyl EthanolamideNovobiocic acidPikromycinpos_4910Medicagenic acidpos_1885pos_1882pos_1883Pentadecanoic Acidpos_4917pos_4915pos_1888pos_18872'-Deoxyuridine3D-3,5/4-Trihydroxycyclohexane-1,2-dione11a-Hydroxy-7-chlortetracyclineNeurosporaxanthinpos_1873pos_1871Germacrene A acidpos_4907Mannopinepos_4905pos_4903pos_4902pos_4901Gynosid AIsoceanothic acidpos_4909pos_4908Abscisic acid glucose ester(6beta,22E)-6-Hydroxystigmasta-4,22-dien-3-oneceanothetric acidpos_211GenisteinDihydrogranaticinpos_1862pos_217pos_218pos_219pos_213Medicagenic acid-3-O-glucosyl-(1,6)-glucosyl-(1,3)-glucosideLysoPG 18:1pos_215Undecaprenyl phosphate alpha-L-Ara4NCholine hydroxide solutionpos_1867pos_200Acetyl tributyl citratepos_1852pos_206pos_201pos_203pos_2049-Hydroperoxy-10E,12,15Z-octadecatrienoic acidpos_1859pos_1858pos_1855Alisol Cpos_1854Camelliagenin BArachidic acid3'-HydroxyropivacaineAla-Trp-OHpos_1848pos_1849pos_1846pos_1842pos_1843Demethylphylloquinol(3beta,15alpha,22S,24E)-3,15,22-Trihydroxylanosta-7,9(11),24-trien-26-oic acidL-LeucineDi-N-pentyl phthalatepos_18301-(4-Methoxyphenyl)allyl acetatepos_1837Dihydroshikonofuran1'-Hydroxytorulenepos_1833pos_1834pos_1831pos_1839BUDDLEOFLAVONOLOSIDEpos_4099pos_4098pos_4097pos_4096pos_4095pos_4094pos_4092Calcitriol20,21-Diprenylterpendole Cpos_1826pos_1827pos_1822Methyl 2-aminobenzoatepos_1828pos_1829pos_4088N5-Citryl-D-ornithinepos_4087pos_4086pos_4085pos_4084pos_4082pos_4081Pisumsaponin IBiotin sulfone12-oxo-5E,8E,10Z-dodecatrienoic acidpos_4089Patchoula-2,4-dienepos_1816Soyasapogenol Bpos_1813Soyasapogenol Cpos_1814Ser Val Thr Valpos_4090Geranyl phosphatepos_1817pos_4077pos_274pos_275(3R,2'S)-Myxol 2'-alpha-L-fucosidepos_276LysoPC 22:4pos_277pos_270pos_4072pos_271pos_4071pos_272pos_4070pos_273pos_278pos_279pos_4079pos_4078pos_1803pos_1800pos_1801pos_280pos_5398pos_263pos_5399pos_264pos_4064pos_265pos_4063pos_266pos_4062pos_260pos_4060pos_261Azukisaponin IIIpos_262pos_5390pos_5393Erythromycinpos_5394pos_267pos_5395pos_4069pos_268pos_5396pos_4068pos_269pos_5397pos_4067pos_53873,5-Dihydroxy-4',7-dimethoxyflavonepos_4055pos_296pos_5388Tetralinpos_4054pos_297pos_4053pos_298pos_40525-Hydroxyisouratepos_299pos_4051pos_292pos_4050pos_293Isonardosinonepos_295pos_53829(10)-EpOMEpos_538320-Oxo-5-O-beta-mycaminosyltylactonepos_4058pos_5386pos_4056(S)-Cheilanthifoline16b-Hydroxyestradiol1-Stearoyl-2-arachidonoyl-sn-glycerolpos_4044pos_285pos_5377pos_286pos_4042pos_287Crepenynatepos_288Dihydrocumambrin Apos_4040pos_281pos_282pos_283pos_284pos_5370pos_5371pos_289pos_5374pos_4046dAMPpos_5375pos_40451-Stearidonoyl-Glycerolpos_290PG(O-18:0/0:0)pos_291pos_5365pos_4032pos_5367pos_4030N-Acetyl-L-phenylalanineNeoxalinetrans-Zeatin-7-beta-D-glucosidepos_4039pos_5360pos_4038pos_5361pos_4037pos_5362pos_4036pos_4035pos_5364pos_4034Tetrahydrobiopterin3alpha,7alpha,12alpha,26-Tetrahydroxy-5beta-cholestaneHomoeriodictyolStearamidepos_5354pos_4021pos_5356pos_5357pos_5358pos_53591,2-Dihydro-1,1,6-trimethylnaphthalenepos_4029pos_4028Sedanolidepos_5351LysoPC 18-2pos_4025pos_40242,5-Dihydro-2,4-dimethyloxazoleCis-L-3-hydroxyprolineProsaikogenin Gpos_5343pos_4011p-Tolualdehydepos_4010pos_5345pos_5346pos_5348pos_5349pos_4018pos_5340pos_4014pos_5341pos_4013pos_4012LysoPE 20:3(2n isomer)Avermectin B1a aglyconeDiethylcarbamazineAcadesine (Drug)pos_5332pos_5333pos_5334pos_5335pos_5336pos_5337pos_5338pos_5339Tragopogonsaponin Apos_4008BisnorbiotinSalbostatinpos_4005pos_4004pos_5330pos_4002pos_4001N-(L-Arginino)succinateTyrosyl-Threoninepos_40092R-Hydroxyoctadecanoic Acidpos_5321pos_2294pos_5323pos_2292pos_5324pos_2293pos_5325pos_2290pos_5326pos_2291Kadcoccitone ATabersoninepos_2298Kadcoccitone C2,3,19-trihydroxyurs-12-en-28-oic acid (Euscaphic acid)pos_5320pos_5329Prosapogenin2-(Acetamidomethylene)succinate7-Methylthioheptyl glucosinolatepos_2284pos_5312pos_5313pos_5314pos_5315pos_5316pos_2289N1-Methyl-2-pyridone-5-carboxamidepos_2287beta-D-Glucosyl crocetinpos_2288dTDP-3-acetamido-3,6-dideoxy-alpha-D-galactopyranosepos_2285pos_2286APGPR Enterostatinpos_5318pos_5319Fumiquinazoline F-indoline-2',3'-diolpos_5302pos_5303pos_5305pos_5306pos_2278pos_2279pos_2276pos_22776-Deoxyfagominepos_5307pos_5308pos_530917,29-Didehydroiridalpos_3593pos_2261pos_35923beta-Hydroxy-4beta,14alpha-dimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-4alpha-carboxylatepos_2260pos_2269pos_3599pos_2267pos_2268pos_3597pos_2265pos_3596pos_2266pos_3595pos_2263pos_3594pos_226418alpha.-Glycyrrhetinic acidpos_2492pos_1161pos_5520pos_2493alpha-hydroxy myristic acidpos_5522pos_2491pos_1160pos_5524pos_1169Nebramycin factor 4pos_2498pos_1167pos_1168pos_2497pos_1166pos_1163pos_249520-Hydroxyleukotriene E4pos_1164pos_5528Mesendanin Q5-Amino-4-imidazole carboxylatepos_2481pos_2482pos_1151pos_5511pos_2480pos_5512Gibberellin A51-catabolitepos_5513pos_2489pos_1158pos_1159pos_1157pos_2485pos_1154pos_1155pos_2483pos_1152pos_2484pos_1153Isoleucyl-GlutamineAmpicillinpos_5518pos_5519L-Fucitolpos_2470pos_2471pos_55002-Dodecenedioic acidpos_5503pos_5504pos_2478pos_1147pos_2479pos_1148pos_2476pos_11454alpha-Carboxy-stigmasta-7,24(24(1))-dien-3beta-olpos_2477pos_1146pos_2474pos_1143pos_2475pos_1144pos_2472pos_1142Multicaulisinpos_1149pos_5505Estriolpos_55084-MethylaminobutyrateIsoquinoline N-oxidepos_3791pos_3790pos_2460N,N'-Diferuloylputrescinegamma-Linolenoyl-CoApos_3799pos_2467pos_1136pos_3798pos_2468pos_1137pos_3797pos_2465pos_1134pos_3796pos_2466pos_11351,2-Dihydroxy-6-methylcyclohexa-3,5-dienecarboxylatepos_1132pos_3794pos_2464pos_1133pos_2461pos_1130pos_3792pos_2462pos_11312-Amino-2-deoxyisochorismatepos_2469pos_1138pos_1139Trimethoprimpos_1125pos_2457pos_1126pos_2454pos_1123pos_3785pos_2455pos_3784pos_1121pos_1122pos_3782pos_2450pos_2451pos_112026-Hydroxybrassinolidepos_1129pos_2458pos_1127pos_3789pos_2459pos_1128Benzyl glucosideEuscaphic acidAmphibine Bpos_2445pos_1114pos_2446pos_1115trans-Zeatinpos_2443pos_1112pos_1113pos_2441Deoxyshikoninpos_2442pos_1111Oroselone2-epi-5-epi-ValioloneCarboxynorspermidinepos_2449Fulvanine Apos_1118pos_1119pos_2447pos_1116pos_2448pos_1117Soyasapogenol B 3-O-D-glucuronideLoganetinGlu-Phepos_2434pos_1103Dihydroceramide C2pos_2435pos_1104pos_3764pos_1101pos_3763pos_3762pos_2430pos_3761pos_2431pos_11007alpha-Hydroxycholest-4-en-3-onepos_3760pos_1109Stigmasterolpos_2438pos_1107pos_2439pos_1108pos_2436pos_1106Tryptophyl-TryptophanObacunoneAcarboseCoumaryl acetatepos_37555-Amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracilpos_2423pos_3754pos_2424pos_3753pos_3752pos_2422pos_3751Galanthaminepos_3750Tetrahomomethioninepos_2427pos_3758pos_2428pos_3757pos_2425Dehydrocostuslactonepos_3756pos_2412Trihexyphenidylpos_2413pos_2410pos_3740pos_2418pos_3749pos_2419pos_3748pos_2416pos_3747pos_2417pos_37462,5-Dihydroxybenzaldehydepos_348Senkyunolide Fpos_3731Emindole SBpos_3730pos_24006-prenylapigeninpos_344pos_345Tubulosine7-Oxoheptanoic acidSenkyunolide Mpos_2409Senkyunolide ANorlinolenic acidpos_2408pos_2405pos_240617-(Furan-3-yl)-7-hydroxy-4,4,8-trimethylandrosta-1,14-diene-3,16-dione (Nimbocinol)pos_2403pos_2404pos_374pos_370pos_371pos_379SylpinLoganateLysoPC 16:42,3-Dihydroxyurs-12-en-28-oic acid methyl ester (Corosolic acid methyl ester)pos_360pos_37113-ketosphingosinepos_3710Dipropyl sulfidepos_368pos_369pos_37199-(Dimethylallyl)-5,10-dihydrophenazine-1-carboxylateOxethazainepos_3714L-Normetanephrine2-Phenylacetamidepos_3713pos_310Capsaicinpos_315pos_316pos_317pos_318pos_311pos_3125-Methyltetrahydrofolatepos_313pos_3708pos_3706pos_319pos_3709Pterinpos_304pos_1994pos_305Retinoatepos_3064(3H)-Quinazolinonepos_307pos_1993pos_300pos_1990O-Methylandrocymbinepos_301pos_1991pos_302pos_303N2-Malonyl-D-tryptophanpos_308pos_309pos_1996pos_1997pos_330(R)-AcetoinCer(d14:2(4E,6E)/18:0(2OH))pos_332Santene(2E,6E)-Farnesolpos_337pos_1983pos_338pos_1982Hydrocortisone(S)-gamma-Calacorenepos_334pos_335(3alpha,20R,24Z)-3-Hydroxy-21-oxoeupha-8,24-dien-26-oic acidpos_1988Strychninepentyl-Benzene1-Pyrrolidinecarboxaldehydepos_320pos_321KAPApos_326N1-Methyl-4-pyridone-5-carboxamidepos_328pos_329pos_1971pos_322pos_323pos_324pos_325Erythromycin BErythromycin CErythromycin Dpos_1979Erythromycin Epos_19774-Methylene-L-glutamatepos_1975TylophorineHydroxyspheroidenone6,7-BenzocoumarinIle-AsnEphedrine6-prenylnaringenintrans,trans-Farnesyl phosphatepos_196810-Heptadecenoic AcidEtioporphyrin IIIFeruloylagmatinepos_19631-Guanidino-1-deoxy-scyllo-inositol6-MethyluracilDapdiamide ALaudanine6-Oxocampestanolpos_1950Dapdiamide C13S-HpOTrE(gamma)pos_1959pos_1954pos_1955alpha-1,5-L-ArabinobiosePPA1,2,3,4,tetrahydro-1,5,7-trimethylnapthalenepos_1940Glutathione reduced form4-HydroxyphenylglyoxylateD-Glutaminepos_1945pos_194414,15-Epoxyemindole SBpos_19412,3-Dihydroxylup-20(29)-en-28-oic acid (Alphitolic acid)pos_1949Acetylsaikosaponin AMomilactone Apos_1936pos_1937pos_19341- (2-METHOXYPHENYL)PIERAZINEpos_1935pos_1938pos_395pos_4198pos_397pos_4196[5-(Aminomethyl)furan-3-yl]methyl phosphatepos_4195Indolelactic acidpos_391pos_4194pos_4193pos_393pos_4192(S)-N-Methylcanadineiridalpos_4199pos_1925pos_1926Tyr Valpos_1923pos_1921Lycaconitinepos_1928pos_4187pos_386pos_4185pos_4184pos_380pos_382Tetracosanoic Acid (Lignoceric acid)1-(5'-Phosphoribosyl)-5-formamido-4-imidazolecarboxamideKarounidiolpos_4189pos_1914pos_1912pos_1913pos_4190pos_4175pos_4173pos_4172pos_4171pos_41702-thiouridineDecursinolpos_4179pos_4178p-CymeneRhizocticin BVitamin D3 (Cholecalciferol)Cytarabinepos_19024alpha-Carboxy-5alpha-cholesta-8,24-dien-3beta-olLiquiritigeninpos_1909OxaloglutarateNateglinidepos_5497Alpha-Pyrrolidinopropiophenonepos_4165pos_5498pos_4164pos_5499pos_4163pos_4161pos_4160SolavetivolDG(18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z)/0:0)1-Pyrroline-4-hydroxy-2-carboxylateAdeninepos_5490Threoninyl-Tryptophanpos_5491pos_5492pos_5493pos_5494pos_4168pos_5495pos_5496pos_41661,6-Dihydroxy-5-methylcyclohexa-2,4-dienecarboxylateCaprylic Acid (Octanoic Acid)DL-Tyrosine3-amino-2-naphthoic acidpos_5486pos_5487pos_5488pos_4152pos_5489Reynosinpos_4151pos_415013(S)-HPOTpos_5481pos_4159pos_5482pos_4158pos_5483pos_4157pos_4156pos_5485(S)-ATPAKadsuralignan CLividomycin Bent-2alpha,3alpha-DihydroxyisokaureneNagilactone B2,5-Dimethylbenzaldehydepos_5475Cis-4,7,10,13,16,19-Docosahexaenoic Acidpos_5476pos_4142pos_5477pos_4141pos_5478(22R,23R)-22,23-Dihydroxycampesterolpos_41404-tert-Octylphenol(S,E)-Lyratol propanoatepos_5470pos_4148pos_5471pos_4147pos_5472pos_5473pos_4145pos_5474pos_4144L-MethionineMG(18_2(9Z,12Z)_0_0_0_0)[rac]Germacra-1(10),4,11(13)-trien-12-alLinustatinGlutamyl-Methioninepos_4132pos_5465pos_5466pos_4130L-4-Hydroxyglutamate semialdehydeKajiichigoside F1(Euscaphic acid 28-O-β-D-glucopyranoside)pos_5469pos_4138pos_4137pos_5460pos_4136pos_5461pos_4134pos_5463pos_41336-HydroxymelatoninDihydrosphingosinepos_5453pos_1095pos_5454pos_5455pos_1093pos_5456pos_1094pos_1091pos_1092pos_5459pos_4129pos_4128pos_4127pos_4126pos_4125pos_1099pos_5450pos_4124pos_5451pos_4123pos_1097pos_5452pos_4122pos_1098Bersaldegenin-3-acetate2-Hydroxyparaconatepos_1084pos_5443pos_1085pos_5444Cloversaponin Ipos_5446pos_1080pos_5447pos_1081pos_5448pos_5449pos_4118pos_4114pos_4113pos_1089pos_1086pos_5441pos_1087Oleandomycin triacetatepos_4119LoroglossinVal Glu Leupos_5431pos_1073pos_1074pos_1071pos_5434pos_1072pos_1070pos_5437MG(0:0/18:4(6Z,9Z,12Z,15Z)/0:0)pos_5438pos_4107pos_4105Ixorosidepos_1079pos_4102pos_1078pos_1075pos_5430pos_1076trans-3-Hydroxy-L-proline4-Methoxy-2,2'-bipyrrole-5-carbaldehydepos_4109pos_4108pos_5420pos_5421pos_2392pos_1061pos_5424pos_5425pos_2390pos_5426pos_2399pos_1068pos_1069pos_2397All-trans-Farnesyl acetateMeleagrinHomogentisatepos_1065pos_5428pos_5429pos_2382pos_1051pos_1052pos_2380pos_2381pos_1050pos_5415pos_5416Nicotinatepos_10593'-AMPpos_1057(13Z,16Z)-Docosadienoic acidpos_2389pos_1058pos_2386pos_1055pos_1056pos_1053pos_2385pos_5417pos_5418pos_5419pos_3461pos_4791pos_2130pos_4790DG(16:0/18:2(9Z,12Z)/0:0)[iso2]pos_876pos_3469pos_877pos_2138pos_878Scopinepos_4798pos_3467pos_2135pos_879pos_3466pos_872pos_4796pos_3465pos_2133pos_873pos_4795pos_3464pos_2134pos_874pos_3463pos_2131pos_875Hydroxyspheroidenepos_2132Coumestrolpos_2139pos_4781Luteinpos_865pos_4789pos_3458pos_2126pos_866pos_4788pos_2127pos_47874-Oxo-9Z,11Z,13E,15E-Octadecatetraenoic Acidpos_2124pos_868pos_4786pos_3455pos_2125pos_861pos_4785pos_3454pos_862pos_4784pos_3453pos_863pos_4783pos_3452Slaframinepos_21201,5-Naphthalenediaminepos_864pos_4782pos_34511-Kestosepos_2121pos_869Cer(d14:1(4E)/20:0(2OH))pos_2128pos_3459pos_2129pos_891pos_892pos_893pos_898pos_3447pos_899pos_4777pos_3446pos_2116pos_4776pos_3445pos_2113pos_3444pos_2114pos_4774pos_3443pos_2111N2-Succinyl-L-ornithinepos_4773pos_3442L-Pipecolic acidpos_896pos_4772pos_3441pos_897pos_3440pos_2110Demethoxycurcuminpos_2119pos_3449pos_4779pos_3448pos_880pos_881pos_882Streptomycinpos_4767pos_3436pos_2104pos_888pos_3435pos_889pos_47658(R)-HPODEpos_3434pos_2102pos_4764pos_21034-Hydroxy-L-threoninepos_883pos_3432pos_884pos_21013-Hexenalpos_885pos_4761pos_886alpha-curcumeneLimonene-1,2-diol7,8-Diaminononanoatepos_2108pos_3439pos_2109pos_3438pos_2106pos_4768pos_34374-Amino-5-hydroxymethyl-2-methylpyrimidineLidocaineEtodolac5S,8R-DiHODEpos_832pos_4756pos_34253alpha,7alpha-Dihydroxy-5beta-cholestanepos_833pos_4755pos_3424pos_834pos_4754pos_3423pos_835pos_4753pos_3422pos_4752pos_3421L-Ornithinepos_4751pos_3420pos_830pos_831pos_837pos_4759pos_3428pos_838pos_4758pos_3427pos_839pos_3426Vanillic acidCanthaxanthinpos_821pos_4745pos_3414pos_822pos_4744pos_3413Dihydrotachysterolpos_823pos_3412pos_4741pos_3410pos_4740pos_820pos_3419pos_4749pos_3418pos_826pos_4748pos_3417pos_4747pos_3416pos_828pos_4746pos_3415Retinal3-Hydroxy-2-methylpyridine-5-carboxylateCryptomeridiolLysoPE 180pos_854pos_3403pos_855pos_4733pos_3402pos_47321,2-Decanediolpos_3401pos_857pos_4731pos_3400pos_850pos_4730pos_851pos_8525-N-Acetyl-7-N-(D-alanyl)-legionaminic acidpos_3409pos_4739pos_3408pos_858pos_34076'-Oxo-G418pos_859pos_4737pos_3406pos_4735pos_340416-Oxolycoclavanol6-HydroxypseudooxynicotineDoxepincholacalcioic acid / 25,26,27-trinorvitamin D3 24-carboxylic acid / 25,26,27-trinorcholecalciferol 24-carboxylic acidpos_843pos_844pos_1698pos_4720pos_841pos_1691pos_842pos_4729pos_847pos_848pos_849pos_4725Serinyl-Threoninepos_1699pos_4724Hederagenin 3-O-arabinosideBenzoic acid(R)-1-Aminopropan-2-olLathyrolpos_4712pos_1686pos_4710pos_16824-O-Methylxanthohumolpos_4719pos_4718pos_4716Ecgoninepos_4714pos_1688pos_4713pos_1689Pentacosanoic acidLividaminepos_4700α-Chaconinepos_1673pos_1671pos_1670Zeatinpos_1677pos_4702VildagliptinVicinepos_2995pos_2993pos_2994pos_2991pos_2992pos_2999pos_1668pos_2997pos_2998pos_1667Pseudobaptigenin 7-O-glucosideLysoPC 15:1pos_29846-hydroxy-2-hexynoic acidpos_1654pos_2982pos_2983pos_1652pos_2980Myriocinpos_2981pos_1658pos_2986pos_2987L-2-Aminoadipate 6-semialdehydepos_2974pos_2971Leucyl-GlutamineGlycocholateCoumestrol 3-O-glucosideO-Phospho-4-hydroxy-L-threoninePhenylpropanoatepos_1648pos_1649pos_2977pos_1646Methyl cinnamate9(S)-HPOTpos_2975pos_1644pos_2976Sonchuside AEriocitrinpos_1631pos_1630pos_1637pos_1638pos_2966pos_2967pos_2964pos_2965pos_1634(2R,3R)-3-Methylglutamyl-5-semialdehyde-N6-lysineL-Glutamateo-Toluidinepos_2951Roxithromycinpos_2950Docosanoic acidpos_1628pos_1629pos_2957pos_2958pos_1627pos_1624pos_29561-Methyl-2-propylbenzenepos_2940pos_2941Propyl gallate2-(Hydroxymethyl)-3-(acetamidomethylene)succinatepos_2948pos_2946pos_2947pos_1616pos_2945pos_2942pos_1611Luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide]-4'-O-beta-D-glucuronidesesquicannabigerolPyrimidodiazepineLysoPA 180pos_293010,16-Dihydroxypalmitic acidTridecanoylglycinepos_2935pos_1604L-Rhamnono-1,4-lactonepos_2936Nerolidolpos_2933Lys Ile Leu Leupos_2934pos_2931pos_1600pos_2932Oryzalexin ERetronecine(3beta,5alpha,9alpha,22E,24R)-3,5,9-Trihydroxy-23-methylergosta-7,22-dien-6-oneMyristoleic acidpos_5193pos_5194pos_5195pos_5196pos_2924trans-Vaccenic acidpos_2922pos_2923pos_2920pos_2928pos_2929ConessineSaponin A(-)-Bornyl acetateSer Arg Val Argpos_5182pos_5183Leukotriene D4pos_5184pos_5185pos_5186pos_5187pos_5188pos_2916pos_2913pos_2911pos_5190pos_5191pos_2910pos_2919Methoxamine9Z,13-Tetradecadien-11-ynal4-Trimethylammoniobutanoatepos_2917pos_2918pos_51782,6-Dimethyl-7-octene-2,3,6-triolpos_5179pos_5170pos_5171pos_51726-Deoxoteasteronepos_5174dCMPpos_5175pos_5176Cholesterolpos_5177pos_2905pos_2902pos_2903Leukotriene B4pos_2901pos_5180pos_2909pos_2906pos_2907pos_5167Stearidonic Acid ethyl esterSphingosyl-phosphocholineAvermectin B1a monosaccharidepos_5162pos_5163pos_5164Formononetin 7-O-glucoside-6''-malonatepos_51663-PhenylpropanalNectandrin BDihydrojasmonic acidpos_5156Octyl gallatepos_5158LysoPI 16:022alpha-Hydroxy-5alpha-campestan-3-onepos_5150pos_5151pos_5152pos_5153(R)-2,3-Dihydroxy-3-methylpentanoatepos_5154Kuwanon S4-PyridoxolactoneDihydromonacolin L acid3-Hexaprenyl-4,5-dihydroxybenzoatecis-1,2-Dihydronaphthalene-1,2-diolAdrenic acidpos_5146pos_51481-Propenyl propyl sulfidepos_5141pos_5142Griffonilide3-Hydroxy-palmitic acid methyl esterL-Dihydroanticapsinpos_5134pos_5135pos_51373,6,8-dodecatrien-1-olpos_5139pos_5131Cynarasaponin CHeptadecanoic acidTerpendole Epos_2096pos_2097Terpendole Gpos_2094pos_2095LysoPC 20:1Terpendole Kpos_2090LysoPC 20:2pos_2091pos_910pos_911pos_912Palmitic acidpos_5122pos_20991,2,4-Trimethylbenzenepos_919pos_913pos_914pos_915Monoglucuronylglycyrrhetinic acidpos_2085pos_5113pos_2086(9Z)-Hexadecenoic acidpos_901pos_2089pos_5110pos_2087pos_51115,6-DHETpos_907pos_908pos_909Dihydrojasmonepos_902pos_904pos_905Validamycin AN-AcetyldemethylphosphinothricinGinkgolic AcidErgothioneinepos_2074pos_5102pos_2075pos_2072pos_5104pos_5105pos_2070pos_5106pos_5108pos_931(-)-Loliolidepos_932pos_933pos_934pos_2078Norcraugsodine1-Monomyristinpos_2076pos_5100pos_930pos_93912-Deoxyaklanonic acidpos_935pos_936pos_937pos_938Tranexamic acidCholecalciferol (Vitamin D3)1-(1-Pyrrolidinyl)-2-butanonepos_3395pos_2063pos_3394pos_2064pos_2061pos_3392pos_3391pos_3390Plaunol Epos_920epsilon-Rhodomycin TXanthinepos_3399pos_2067pos_3398pos_2065pos_3396pos_2066pos_9281-Stearoyl-rac-glycerolpos_929pos_925pos_926pos_92724-Methylenelophenolpos_2052DL-Phenylalaninepos_3383pos_3382pos_2050pos_3380(S)-Hemiketal1'-Hydroxy-gamma-carotene glucosideLauroyl-EApos_33892-(Hydroxymethyl)-4-oxobutanoatepos_3388pos_2054pos_3385α-Hydroxyl-β,β-Dimethyl-γ-Butyrolactonepos_2055D-Galactaro-1,5-lactoneTyrosyl-Arginine7-Deoxyloganetinpos_3372pos_2042pos_3371pos_3370pos_2040MG(18:3(6Z,9Z,12Z)/0:0/0:0)pos_3379pos_2047pos_3378pos_3377pos_3376pos_3375pos_2043pos_33744-Methylthiobutanaldoxime8-hydroxy-11Z-octadecen-9-ynoic acid2-MercaptobenzothiazoleSolasodine3-Methyl-2-oxopentanoateProcaineMedicagenic acid-3-O-glucuronide-28-O-xylosyl(1,4)-rhamnosyl(1,2)-arabinosidepos_4693pos_3362pos_4692pos_3361pos_3360pos_46902'-Deamino-2'-hydroxy-6'-dehydroparomaminePolyporenic acid Cpos_3369pos_3368pos_2036pos_4698pos_3367pos_3366pos_2034pos_4696pos_3365styrylaminepos_4695pos_3364pos_2032pos_3363pos_2033Esculentic acid (Phytolacca)Colnelenic acidArginyl-Glutaminepos_4682pos_3351pos_2020MetaxaloneN1-(5-Phospho-alpha-D-ribosyl)-5,6-dimethylbenzimidazolepos_2027pos_4689pos_335812-hydroxy-3Z,6Z-dodecadienoic acidpos_2028pos_2026pos_4686pos_3355pos_2023pos_4685pos_3354pos_2024pos_3353pos_3352Kadcoccilactone RFormamidepos_2029Biotinyl-5'-AMPpos_2250pos_990pos_3581pos_2251pos_991pos_3580pos_992pos_997pos_998pos_2259pos_999pos_2256pos_2257pos_2254pos_994Arabidiolpos_2255pos_3584pos_2252pos_996ent-11beta-Hydroxycassa-12,15-diene6-dehydrotestosterone3-O-p-Coumaroyloleanolic acidpos_3571pos_2240pos_981O-Acetyl-L-serine3-Geranylgeranylindolepos_986pos_3579pos_2247pos_987pos_2248pos_988pos_3577pos_2245pos_989pos_2246pos_982L-Homophenylalaninepos_3575pos_2243pos_983pos_3574pos_2244pos_984pos_22411,2,4,5-Tetramethylbenzene1-Naphthylmethanolpos_2242pos_2249MithramycinSoyasaponin beta-A3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dioneIsoprenepos_48911α,25-dihydroxy-26,27-dimethyl-22,22,23,23-tetradehydrovitamin D3 / 1α,25-dihydroxy-26,27-dimethyl-22,22,23,23-tetradehydro-cholecalciferol5-Hydroxy-2-pyrrolidinoneGingerglycolipid Cpos_4899pos_2236pos_4898pos_3567pos_3566pos_2234Lucidulinepos_3565pos_4895pos_2232Ricinoleic acid methyl esterpos_4893pos_2230pos_4892pos_3561pos_2238pos_35699,10,13-TriHOMESclareol3,29-Dihydroxyolean-12-en-28-oic acid (Mesembryanthemoidigenic acid)pos_4880Icosadienoic acidpos_3557pos_2225pos_3555pos_2223pos_3554pos_2224pos_4884pos_3553pos_2221pos_3552pos_2222Baptifolinepos_4881pos_3550pos_2220pos_3559pos_4889pos_2228Dehydrosoyasaponin IIcosenoic acidAtractylenolide â?2.08_253.1197m/z(E)-4-(Trimethylammonio)but-2-enoatepos_953Quillaic acidpos_954pos_3545pos_2215pos_4875pos_955pos_3544pos_2212pos_4874pos_956pos_2213Moxifloxacinpos_4873pos_3542pos_2210pos_4872L-Histidinalpos_950pos_3541pos_2211pos_4871pos_951pos_3540pos_4870pos_95217alpha-Hydroxyprogesteronepos_957pos_2218pos_958pos_4879pos_959pos_2217Methylisoeugenolpos_4866pos_942pos_3535pos_2203pos_3534pos_2204pos_4864pos_3533pos_2201pos_4863pos_2202pos_4862pos_3531pos_3530pos_2200pos_4860pos_940pos_941m-Xylenepos_2209pos_946pos_2207pos_4869pos_947pos_3538pos_2208pos_948pos_2205pos_4867pos_949pos_2206N-Glycoloyl-neuraminateDecanoic acidSaikosaponin BK1Melatonin (N-Acetyl-5-methoxytryptamine)Dapiprazolepos_4855pos_3524Indole-3-ethanolpos_976pos_4854pos_977pos_4853pos_4852pos_3521pos_971pos_4851pos_3520pos_972pos_973pos_974Phe-SerOnonin7-Ethyl-5,6-dihydro-1,4-dimethylazulenepos_979pos_4859pos_4858pos_3526Donepezilpos_4856pos_3525N-Methyltryptaminepos_964pos_3513pos_965pos_4843pos_3512pos_966pos_4842pos_3511pos_4841pos_3510pos_960pos_961pos_962N-Formylmethionyl-Leucylphenylalaninepos_963pos_3519pos_968pos_4848pos_3517pos_969pos_3516pos_3515pos_3514Fumigaclavine Apos_110Clarithromycinpos_111pos_112Sucrose3-Methoxy-4-hydroxyphenylethylene glycolpos_4833pos_3502pos_4832Antibiotic G-418pos_118pos_4831pos_3500pos_119pos_113pos_114pos_115pos_116pos_4839pos_3507pos_4837pos_3505pos_48352,5-Diamino-6-(5-phospho-D-ribosylamino)pyrimidin-4(3H)-onepos_4834SCOPOLINEPro Glu ThrUndecanoic gamma-lactonepos_100pos_101(R)-Mevalonatepos_1796pos_106pos_4821pos_1797pos_107pos_4820pos_108GlcCer(d14:2(4E,6E)/18:0(2OH))pos_109pos_102pos_1793pos_103pos_104pos_1791pos_105pos_4829pos_4828pos_4827pos_4826pos_4825pos_4824Geosmin3''-Hydroxy-geranylhydroquinonep-Mentha-1,3,8-trienepos_131pos_132Histidinyl-Cysteinepos_133pos_134pos_130pos_139ZearalenoneN-Monomethyl-2-aminoethylphosphonatepos_135pos_136pos_137pos_138pos_4819Z-Ligustilidepos_4817pos_4815pos_4814pos_4813pos_1787pos_48124-(Trimethylammonio)but-2-enoatepos_1788pos_120pos_121pos_122pos_123pos_4800pos_128pos_1775pos_129pos_1772pos_124pos_1771pos_125pos_126Roseoflavinpos_127pos_4808pos_4807pos_4806pos_4805Vetiveryl acetatepos_1779pos_4802Nicotine-N-glucosidepos_1777pos_4809LysoPE 18:44-phenylbutyrateCycloserineLeucyl-Serine5-Hydroxyflavonepos_1760pos_1768pos_1765Heptadecatrienal7Z,11E-Hexadecadien-1-olKankanoside Apos_1753pos_1756pos_1757pos_1740pos_17471,3,11(13)-Eudesmatrien-12-oic acidpos_1745pos_1744pos_1730pos_1738pos_1739pos_1736(2S,2'S)-Oscillolpos_198pos_199pos_193pos_194Thr Glu Pro Glnp-HydroxyphenylacetylglycineN-Succinyl-LL-2,6-diaminoheptanedioatepos_195pos_172016-Hydroxyiridal (isoiridogermanal)pos_1723Germacronepos_1722GlutathionylspermidineIsofucosterolpos_1729Dihydrostreptomycin 6-phosphatepos_187pos_182Anabasinepos_183Succinatepos_184pos_185L-leucyl-L-prolineBethanechol cationpos_1712pos_1713pos_190pos_191pos_192L-HistidinolGabapentinNH-DVal(NMe)-Val-OMepos_1705pos_1706pos_1703pos_1704Docosapentaenoic acidpos_17023,4,3',4'-Tetrahydrospirilloxanthin3-(O-Geranylgeranyl)-sn-glycerol 1-phosphateMonoisobutyl phthalic acidpos_1709Urdamycin GMethyl beta-D-galactoside3-[(3aS,4S,7aS)-7a-Methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoateDeoxyuridinepos_5291pos_5292pos_5293pos_5294pos_5295pos_5296pos_5297pos_5298pos_153pos_5289pos_154pos_155D-4'-Phosphopantothenatepos_156pos_150pos_151pos_152pos_5280pos_5281pos_5283pos_157pos_5285pos_158pos_5286pos_159pos_5287Phytosphingosinepos_52901-Hydroxyoctadecanepos_142pos_143pos_5279pos_144D-Cycloserinepos_145pos_140pos_141pos_52702,6-nonadienalpos_5271Fumitremorgin C3,6,9,12,15-octadecapentaenoic acidpos_146pos_147pos_148pos_5276pos_1494alpha-Methylzymosterol-4-carboxylate3,4-Dihydrospheroidenepos_52661-Linoleoylglycerolpos_175pos_176pos_177pos_5269pos_178pos_172pos_173(E)-Antibiotic BE 23372MD-Pipecolic acidpos_5261pos_5264pos_5265pos_181pos_164pos_5256pos_165N-(3-Hydroxypropyl)phthalimidepos_166pos_167pos_5259pos_160pos_161Senecionine N-oxidepos_162pos_163pos_5250pos_5251pos_16821,2324,25-Diepoxy-21-hydroxylanost-7-en-3-one (Melianone)pos_169Hydrangeifolin Ipos_52549(S)-HOTIcariside B1Capsi-amidePC(16_0_16_0)Inosinedesethyletomidatedelta-12-PGJ2pos_1701-[(5-Methyl-2-furanyl)methyl]pyrrolidineLysoPC 22:5(2n isomer)pos_52459,10,18-Trihydroxystearatepos_5246pos_52492'-Deamino-2'-hydroxyparomamineCapsoside BMethadonepos_5240pos_5242pos_52437-Oxateasterone3-Amino-3-(4-hydroxyphenyl)propanoatepos_5233pos_5234Paraldehydepos_5236pos_5237Ectocarpenpos_5238(15Z)-Tetracosenoic acidMegalomicin Bpos_5230pos_5231pos_52324'-OxolividamineMeldenin3alpha-17alpha-21-Trihydroxy-5beta-pregnane-11,20-dione13(S)-HpOTrEpos_5224pos_5226pos_2191pos_2192Gly Gly Gly Argpos_5229pos_21903-Dehydro-L-Threonic Acid5-Hydroxyectoinepos_2199pos_5221pos_2198pos_9pos_7pos_8pos_5Sophoridinepos_6pos_3pos_4Dibutyl sulfideSerinyl-Glutaminepos_1pos_2Rubuside Jγ-Solaninepos_5211pos_2184pos_5212pos_2182(2'S)-Deoxymyxol 2'-alpha-L-fucosideScopolaminepos_2183pos_5217pos_5218pos_2186pos_2187S-(4-Methylthiobutylthiohydroximoyl)-L-cysteineVal His Arg Hispos_5219Glycycoumarinpos_5200pos_5201pos_2174pos_5202pos_5204pos_5205pos_2170Zeaxanthin diglucosidepos_2177pos_2175Undecanoic Acidpos_5208Feruloylmalic acidpos_3494pos_2162pos_3493pos_21607,8-Didemethyl-8-hydroxy-5-deazariboflavinpos_3491Coixenolidepos_2161SimvastatinBenzaldehydeLathosterolpos_3498pos_2166pos_3497Reticulataxanthinpos_3496pos_3495Isoleucyl-Valine3,6-NonadienalGenkwaninpos_3483pos_2151pos_3482pos_2152pos_3481Virginiamycin S1Umbellifolidepos_3486Soyasaponin IIIpos_2156pos_2153pos_3484pos_2154pos_3472pos_2140pos_3471pos_3470Medicoside Cpos_2148pos_3479pos_2149pos_2146pos_2144pos_34753-O-Caffeoyl-9-hydroxylup-20(30)-en-7-one (Querspicatin A)pos_2145pos_3474pos_2142pos_2143(4R)-7-Hydroxy-4-isopropenyl-7-methyl-2-oxo-oxepanone2,3,19-Trihydroxyurs-12-en-28-oic acid (Tormentic acid)falseMulti-omics and physiological analysis reveal the involvement of secondary metabolism and carbohydrate in drought regulation in alfalfaMetabolite differential analysis indicates that genes involved in pathways such as secondary metabolism, carbohydrate, phenylpropanoid biosynthesis and flavonoid biosynthesis may regulate drought adaptation in alfalfa.2025-09-232025-09-23MTBLS9934