MetaboLightsapplication/xmlftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/m_MTBLS12717_LC-MS_positive_reverse-phase_metabolite_profiling_v2_maf.tsvftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/m_MTBLS12717_LC-MS_negative_reverse-phase_metabolite_profiling_v2_maf.tsvftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/a_MTBLS12717_LC-MS_negative_reverse-phase_metabolite_profiling.txtftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/a_MTBLS12717_LC-MS_positive_reverse-phase_metabolite_profiling.txtftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/s_MTBLS12717.txtftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/i_Investigation.txtftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_QC01.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_C2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_QC01.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_B2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_A1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_QC02.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk02LXX_DB_D1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_D3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_C3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_QC02.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_A3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_QC03.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_D2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_B1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_A2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_QC03.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_D2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_A2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_B1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_QC04.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_C3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_A3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk02LXX_DB_D1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_QC04.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_D3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_A1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_C1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_B2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_C1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_C2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/POS_Gk06LXX_DB_B3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717/FILES/RAW_FILES/NEG_Gk06LXX_DB_B3.rawprimaryOK200ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS12717<p>The raw data was imported into the metabolomics processing software Progenesis QI (Waters Corporation, Milford, USA) for baseline filtering, peak identification, integration, retention time correction, and peak alignment. The MS and MS/MS mass spectrometry information was matched with public databases, including HMDB (http://www.hmdb.ca/), Metlin (https://metlin.scripps.edu/), and a self-built database.</p>MetaboLightsPublicLiquid Chromatography MS - negative - reverse phaseLiquid Chromatography MS - positive - reverse phase<p>Additionally, an equal volume of the supernatant is taken from each sample and mixed as a QC sample. The instrument platform for analysis is the UHPLC-Exploris 240 system (Thermo Fisher Scientific Inc., Waltham, MA, USA). The 3 µL samples are separated using an ACQUITY UPLC HSS T3 column (100 mm _ 2.1 mm i.d., 1.8 µm Waters, Milford, USA) and then detected by mass spectrometry. The column temperature is set to 40 _.&nbsp;</p>Analysis of flavor formation and metabolite changes during production of buffalo milk Double-Layer Steamed Milk Custard.Foshan universityLan HongFood or Food Productmass spectrometry<p>Accurately weigh 200±5 mg of the sample and add a grinding bead. Add 800 µL of 80% methanol aqueous solution (methanol: water = 4:1 (v:v), HPLC grade) containing the internal standard solution L-2-chlorophenylalanine (0.02 mg/mL, _98%). The tissue samples are ground using a cryogenic tissue grinder for 6 minutes (-10_, 50 Hz) and then extracted by ultrasound at low temperature for 30 minutes (5_, 40 KHz). Place the sample at -20_ for 30 minutes, then centrifuge at 13,000 g and 4_ for 15 minutes, and remove the supernatant for machine analysis.</p>buffalohttps://www.ebi.ac.uk/metabolights/MTBLS12717Luo Xier.Li Ling.Qi Hao.Li Chuan.Liu Qingyou. College of Animal Science and Technology. Foshan University. qyliu-gene@fosu.edu.cn.Lan Hong. College of Animal Science and Technology. Foshan university. honglan1909@163.com.Xu Dingyun.Cui Kuiqing.<p>Primary mass spectrum resolution is 60000, secondary mass spectrum resolution is 15000, and data is collected using DDA mode.</p>Making processhonglan1909@163.com<p>This study collected buffalo milk samples from the Buffalo Breeding Farm at the Buffalo Research Institute, Chinese Academy of Agricultural Sciences in Nanning, Guangxi, China. The DLSMC production follows traditional processing: raw milk is boiled for 10 minutes then cooled at 25°C for 30 minutes to form the first milk skin layer. After piercing a hole and pouring out the milk, this first layer adheres to the bowl bottom. Following addition of appropriate proportions of eggs and sugar, the mixture is steamed for 20 minutes to form the second milk skin layer. Samples were collected at four key production stages: raw buffalo milk designated as Group A; material after thermoprocessing at 100°C for 10 minutes designated as Group B; product after first milk skin formation at 25°C for 30 minutes designated as Group C; and final product after second milk skin formation at 100°C for 20 minutes designated as Group D.</p>Metabolomicsbuffalo milk (raw)liquid chromatography-mass spectrometryFlavorbuffalo milk (raw)liquid chromatography-mass spectrometryFlavor<p>Positive and negative ion scanning modes are used to collect the sample mass spectrum signals, with a mass scanning range of 70-1050 m/z. The flow rate of sheath gas is 60 psi, the flow rate of auxiliary gas is 20 psi, the heating temperature of auxiliary gas is 350 _, the positive mode ion spray voltage is set to 3400 V, the negative mode ion spray voltage is set to -3000 V, and the ion transfer tube temperature is 350_. Primary mass spectrum resolution is 60000, secondary mass spectrum resolution is 15000, and data is collected using DDA mode.</p>1-Nonadecanoyl-glycero-3-phosphoethanolamineCorticosterone7-[(1R,2R,5S)-5-Hydroxy-2-[(1E,3S)-3-Hydroxyoct-1-en-1-yl]-3-oxocyclopentyl]heptanoylcarnitineSer Leu Ser Gly Leu4-Hydroxy-5-(dihydroxyphenyl)-valeric acid-O-sulphateCDP-DG(i-17:0/18:2(9Z,11Z))1-O-(3-Hydroxy-4,5-dimethoxybenzoyl)hexopyranoseQuercetin 7-glucuronide 3-rhamnoside3-Hydroxy-3-(3,4-dihydroxy-4-methylpentanoyl)-5-(3-methylbutyl)-1,2,4-cyclopentanetrione6-(2,2-Diphenylethylamino)-9-[(2r,3r,4s,5s)-5-(Ethylcarbamoyl)-3,4-Dihydroxy-Oxolan-2-Yl]-N-[2-[(1-Pyridin-2-Ylpiperidin-4-Yl)carbamoylamino]ethyl]purine-2-Carboxamide2-(beta-D-Mannopyranosyl)-L-tryptophanGinkgoic acid2-Keto-6-acetamidocaproateTimolol3-O-Demethylfortimicin ALysoPC(0:0/18:2(9Z,12Z))Kaempferol 3-O-beta-robinoside 7-O-alpha-L-rhamnopyranosideN-Phenyldiethanolamine8-Hydroxythioguanine2,5-Dihydroxybenzenesulfonic Acid3-Hydroxyanthranilic AcidCytidine 5'-monophosphate-N-acetylneuraminic acidBentazone(2R,4S)-6-Fluoro-2-methylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione2,3-Dimethyl-2-cyclohexen-1-onePA(2:0/PGE1)Quercetin 3-O-sophoroside3-ethylphenyl Sulfate2,9-Bis(3-methyl-2E-pentenoyl)-2b,9a-dihydroxy-4Z,10(14)-oplopadien-3-one16, 17-dihydro-16alpha, 17-dihydroxy GA9EpicylindrospermopsinSmall bacteriocinBenzyl alcohol, 4-(2,4-diamino-5-pyrimidinylmethyl)-2,6-dimethoxy-alpha,alpha-dimethyl-N-Acetyl-D-tryptophanAsebotoxinPG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:1(9Z))TerazosinLucuminoside2-Aminophenol N-formate sulfateP-Tolyl-ss-D-glucuronide2-Amino-9-[4-hydroxy-2-(hydroxymethyl)butyl]-3H-purin-6-oneMevalonic acidArginylprolineFlavin MononucleotideSilodosin2-(4-(Methylamino)phenyl)benzo[d]thiazol-6-olGentiopicrinTetrahydrocorticosteroneLysoPC(14:0/0:0)A-L-Fucopyranosyl-(1->2)-b-D-galactopyranosyl-(1->2)-D-xyloseTriglyceride palmitateDihydroxyphenylacetic acid sulfateMG(0:0/20:4(5Z,8Z,11Z,14Z)/0:0)AlgestoneAlfaprostolumPalmitaldehydeMalvidin 3-rhamnoside 5-glucosidePI(16:1(9Z)/20:4(5Z,8Z,11Z,14Z)-OH(19S))Cinncassiol D2 glucoside3'-thiacytidineIndoxylsulfuric acidQUINGESTANOL3,3'-DimethoxybenzidineHydroxyprolyl-LysineP-Tolyl Sulfate7-AminonitrazepamN-Acetyllactosamine(S)-TetrahydrocolumbamineDG(LTE4/12:0/0:0)L-Proline, 1-(N-((3-((propylamino)carbonyl)oxiranyl)carbonyl)-L-isoleucyl)-, (2S-trans)-Cysteinyl-IsoleucineChymostatinPG(6 keto-PGF1alpha/i-24:0)DG(20:4(6E,8Z,11Z,14Z)+=O(5)/8:0/0:0)1-(6-Hydroxy-2-azabicyclo[2.2.1]heptane-3-carbonyl)pyrrolidine-2-carbonitrilePA(i-18:0/18:3(10,12,15)-OH(9))Glaucine2-O-alpha-D-Glucopyranosyl-O-beta-D-galactopyranosylhydroxylysineMitemcinalProstaglandin G2 2-glyceryl Ester2-HydroxycarbamazepineLovastatinVINYLSULFONIC ACIDMuzanzagenin2-StearoylglycerophosphoglycerolDG(TXB2/10:0/0:0)SialorphinTeleocidin B 2Hydroxytriamterene sulfatePS(PGJ2/20:4(8Z,11Z,14Z,17Z))Diethylpropion2-(1-Hexyloxyethyl)-2-devinyl pyropheophorbide-aDG(PGF2alpha/2:0/0:0)Multiflorin B1-Hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1h-pyrrole-3-carboxamideAtalurenAconitic acidDihydroxylysinonorleucineRostafuroxin3-Hydroxyindolin-2-one-sulfatePC(PGD1/2:0)Ipamorelin17a,21-Dihydroxy-5b-pregnane-3,11,20-trioneDauricine20-Carboxy-leukotriene B4L-Phenylalanine13-HodePA(6 keto-PGF1alpha/20:5(5Z,8Z,11Z,14Z,17Z))Docosahexaenoic acidAlanyltryptophanO-AcetylserineHydroxydesmethyltetrahydropiperine sulfatePG(PGF1alpha/i-12:0)CoumafurylGlucoraphaninUrolithin-3-sulfate(S)-10,16-Dihydroxyhexadecanoic acidZaluzanin DPhalloidine(2R,3R)-3-[[(2S)-1-[4-(Diaminomethylideneamino)butylamino]-4-methyl-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylic acid3-O-Methyl-a-methyldopaNicotinamide ribosideBERBAMINELibenzaprilNitrofurazoneSagittatosdie B1,2-Di-(9Z,12Z,15Z-octadecatrienoyl)-3-(Galactosyl-alpha-1-6-Galactosyl-beta-1)-glycerolBeta-Citryl-L-glutamic acidLysoPE(0:0/16:0)Uridine 5'-Diphosphate2-Isopropylmalic AcidBufotalinQuinmeracLysyl-aspartyl-glutamyl-leucineArg-Thr-Lys-ArgTetrahydrocortisol2,3-Dihydro-2-(3,4-dihydroxyphenyl)-3-Carboxy-1,4-Benzodioxin-6-Acrylic AcidNepetariasidePrednisoloneCyclacillin2-Ethoxy-1-ethoxycarbonyl-1,2-dihydroquinolineALA-ILESyn-Copalyl diphosphateGonyautoxin VPisumoside B(R)-GlabridinMelledonal AMethyldopate3-Methoxy-4-hydroxyphenylethyleneglycol sulfateBamifylline[6]-Gingerdiol 4'-O-beta-D-glucopyranosideCyclopropanecarboxamide, 1,2,2,3,3-pentamethyl-Glycylserylprolylmethionylphenylalanylvalinamide1-[[4-(Dimethylamino)-3-methylphenyl]methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid3-Methyl-5-pentyl-2-furanundecanoic acid10-Hydroxydodec-10-enedioylcarnitineLevonorgestrelCarbamazepine iminoquinone9-HydroxypentadecanoylcarnitinePS(20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)/20:5(5Z,8Z,11Z,14Z,17Z))3-(3,5-dihydroxyphenyl)-1-propanoic acid sulphateDihydroergocornineHebevinoside IPS(18:1(9Z)/0:0)1-Octen-3-yl primeverosideUridine diphosphate acetylgalactosamine 4-sulfatePA(5-iso PGF2VI/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[(2S)-1-(4-Amino-2-oxopyrimidin-1-yl)-3-hydroxypropan-2-yl]oxymethyl-phosphonooxyphosphinic acidSN38 glucuronidePGP(16:1(9Z)/18:1(12Z)-2OH(9,10))PE(16:0/20:3(5Z,8Z,11Z))LysoPC(17:0/0:0)L-2-Amino-4-methylenepentanedioic acidFimasartanLysoPE(18:0/0:0)4-Methylumbelliferone sulfateDibenzo-18-crown-6PractololTulipinolideChenodeoxycholic acid glycine conjugateSibiricose A54-Hydroxy-3-methoxy-cinnamoylglycineTestosterone enanthatePhenylalanyllysine5-(3-Aminopropylphosphanyloxy)-2-(hydroxymethyl)pyran-4-oneThreonyltryptophan3-Sulfodeoxycholic acidPC(PGD2/17:0)5-hydroxy saxagliptinN-Linoleoyl MethionineTHYMOPENTINMeproscillarinAquifoliunine EII6-Epi-7-isocucurbic acid glucosideProstaglandin J2Erythromycin 2'-acetateCys-Arg-Glu-Lys-AlaPC(20:3(8Z,11Z,14Z)-2OH(5,6)/2:0)PA(10:0/LTE4)PhysostigmineCilomilastStercobilinHippuric acid sulfateMilbemycin A47a-HydroxytestosteroneDeoxycholylarginine(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-GlucopyranosidePS(20:5(5Z,8Z,11Z,14Z,17Z)/20:3(5Z,8Z,11Z))Mucronine DGoshonoside F52-Hydroxyacetaminophen sulfate6-[4-(4-carboxy-2-hydroxybutyl)-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acidMethylisocitric acidPentanoic acid, 5-(dipentylamino)-5-oxo-4-((3-quinolinylcarbonyl)amino)-, (R)-Janthitrem CJanthitrem FPE(22:4/0:0)TroxerutinNelfinavirPA(18:1(12Z)-2OH(9,10)/16:0)8-Amino-7-oxononanoic acidFormyllysineAndrographolidePA(10:0/18:1(12Z)-O(9S,10R))Leu Gln Ile ArgAminocatechol N-acetate sulfatePyridoxalDimerum acidErythromycin A enol ether3,4-Dihydroxyphenylglycol O-sulfateLeu-leu-tyr4,4'-Diphenylmethane diisocyanate6-[2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,2-dihydro-7-hydroxy-9-methoxy-cyclopenta[c][1]benzopyran-3,4-dione[(S)-1-Carboxy-2-phenyl-ethyl]-carbamoyl-Arg-Val-Arg-aldehydePE(15:0/20:4(6Z,8E,10E,14Z)-2OH(5S,12R))1-O-Sinapoyl-beta-D-glucoseH-D-Arg(NO2)-OHRhoifolinManzamine ANonioside B6-Thioinosine-5'-monophosphateMethyl 6-[(3S,6S,9S,12R)-3-butan-2-yl-6-[(1-methoxyindol-3-yl)methyl]-2,5,8,11-tetraoxo-1,4,7,10-tetrazabicyclo[10.4.0]hexadecan-9-yl]hexanoatePS(15:0/20:4(8Z,11Z,14Z,17Z))Neohesperidose(2R)-2-Acetyl-1-[(2S)-2-[acetyl-[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]-6-aminohexanoyl]pyrrolidine-2-carboxylic acidBeloranib9(S)-HOTrECinncassiol C2EpiandrosteroneAnetholeVidarabineL-arogenateFumonisin AK1LysoPE(0:0/20:0)NalfurafineNorethindrone oximeHippuric AcidFura-2 acetoxymethylOctopineN-Oleoyl LeucineOxamniquineTautomycinCAMPEribulinLysoPS(18:0/0:0)Erythromycin3-ThiacytidinePA(LTE4/10:0)EmbutramideSepimostatGDP-GlucoseMedemo17-AAGTrans-3,4-Dihydro-3,4-dihydroxy-7,12-dimethylbenz[a]anthraceneBudralazineKynurenic Acid21-DeoxycortisolN-(2-hydroxymethyl-3-chloro-4-hydroxyphenyl)anthranilic acidN-Acetylmuramoyl-AlaChrysoobtusin(2S,3S,4S,5R)-3,4,5-Trihydroxy-6-sulfooxyoxane-2-carboxylic acidPG(16:0/16:0)Ketotrilostane(Z)-N-Coumaroyl-5-hydroxyanthranilic acidAla Gly Leu Val SerVirginiamycin m12-Methylhippuric acid2-[4-(sulfooxy)phenyl]acetic acidN-alpha-Acetyl-L-citrulline12(R)-HETECantharidinDiflomotecanPGP(a-13:0/18:2(9Z,11Z))6-HydroxyfluvastatinHeliotronSemagacestatLacosamideBetamethasone 17,21-dipropionateGlucosyl (2E,6E,10x)-10,11-dihydroxy-2,6-farnesadienoate3-Allylphenol sulfateVanillic acid 4-O-glucuronideNaloxegol(S)-3-Butyl-1(3H)-isobenzofuranoneConcanamycinCogoxinAla Val Leu GluLeu-Arg-Asn-ArgNecatorineBeta-Elemonic acid(3b,16a,20R)-25-Acetoxy-3,16,20,22-tetrahydroxy-5-cucurbiten-11-one 3-glucosideUDP-glucoseN4-AcetylcytidineLysoPE(24:6(6Z,9Z,12Z,15Z,18Z,21Z)/0:0)N-Acetyl-D-Glucosamine 6-PhosphateDemethoxycentaureidin 7-O-RutinosideGly-Pro-Arg-Pro-LysPE(20:1/0:0)Acrylamide-sodium acrylate resinHYDROCHLORIDE SALTAla Leu Gly Ile SerFurostanolS-(11-hydroxy-9-deoxy-delta12-PGD2)-glutathioneCinobufotalin(3S,7E,9R)-4,7-Megastigmadiene-3,9-diol 9-[apiosyl-(1->6)-glucoside](R)-1-Octen-3-ol2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(4-Hydroxy-3-methoxyphenyl)-1-Propanol1,3-Diethyl-6-hydroxy-2-sulfanylidenepyrimidin-4-oneGlaucarubinPendetideNotoginsenoside R10(-)-2-Difluoromethylornithine[(2S,4R,5R,6R,14S,16R)-14-Hydroxy-7,11-dimethyl-6-(2-oxopyran-4-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-5-yl] acetate3-PyridinecarboxaldehydeAcetyl-pepstatin(Z)-3-Methyl-2-(2-pentenyl)-2-cyclopenten-1-onePyropheophorbide aPyrithioxin(3a,5b,7a,12a)-24-[(carboxymethyl)amino]-1,12-dihydroxy-24-oxocholan-3-yl-b-D-Glucopyranosiduronic acidFluocinoloneKetaminePGP(20:4(5Z,8Z,11Z,14Z)/PGD2)PE(DiMe(9,3)/6 keto-PGF1alpha)AntramycinDihydroferulic acid 4-O-sulfateCDP-DG(i-12:0/a-15:0)MethylnoradrenalineNandroloneSinapic acid 4-O-sulfateDolicholidePA(i-14:0/PGD2)Sebacic Acid5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-3'-O-sulphateDaurisolinePE(14:1(9Z)/20:3(8Z,11Z,14Z)-2OH(5,6))EtiracetamLysoPC(20:4(5Z,8Z,11Z,14Z)/0:0)3-DehydroteasteroneFasoracetamBeta-Thujaplicin3-Ethoxypropanoic AcidPE(5-iso PGF2VI/18:4(6Z,9Z,12Z,15Z))LysoPC(22:5(4Z,7Z,10Z,13Z,16Z)/0:0)17-beta-Estradiol-3-glucuronide(1alpha,4beta,5beta)-4-Hydroxy-7(11),10(14)-guaiadien-8-one(+/-)8-GINGEROLPS(PGE2/20:3(8Z,11Z,14Z))Amperozide3',5'-Cyclic AMPFluticasone 17beta-carboxylic acidCurcuminEpsilon-caprolactamAla Ser Phe GluDansylamidohexamethylamineAzelaic AcidDG(10:0/20:3(8Z,11Z,14Z)-2OH(5,6)/0:0)MarinobufageninDethiobiotinGlu Ile Arg GluCyclopropanecarboxylic acidHMDB0127639AlfentanilLysoPC(18:3(9Z,12Z,15Z)/0:0)EstroneGlutamyltryptophan5-Methoxy-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole5-Oxoicosa-3,6,8-trienoic acidPyocyaninPS(14:1(9Z)/18:4(6Z,9Z,12Z,15Z))FertirelinStercobilinogenLipoxin B4H-Val-pro-asn-leu-pro-gln-arg-phe-NH2Metyrapol(1x,2x)-Guaiacylglycerol 3-glucosideBenzyladenine 3-O-beta-D-glucosidePE(20:4/0:0)StreptidineAsn Leu Pro Ile AsnAspartame(2S,3S,4S,5R)-6-(4-Acetamidophenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acidL-SorbinoseCarnocin U I49Harmol sulfate3-cis-HydroxyglipizideVal Ile Asp LysCortisol 21-sulfate8-Hydroxy-7-methylguanineIndoxyl SulfateDG(22:4(7Z,10Z,13Z,16Z)/22:2(13Z,16Z)/0:0)PC(2:0/20:4(5Z,8Z,11Z,14Z)-OH(17))Oxoglutaric acidProstaglandin E2 methyl ester((2R,3S)-3-Amino-2-hydroxy-2-(1H-imidazol-4-ylmethyl)-5-methyl)-5-methylhexanoic AcidN-Formyl-met-leu-phe-lysNorepinephrine sulfateSer Leu Val GluIsoleucyl-GlutamineNoa-Asn-Apns-Dmt-NH-tBuPG(6 keto-PGF1alpha/16:1(9Z))3-Hydroxyocta-3,6-dienoylcarnitinePE(22:6/0:0)(1R,3S)-3-(6-Aminopurin-9-yl)cyclopentan-1-ol4-Acetyl-2-Hydroxyphenyl 2-O-Beta-D-Fructofuranosyl-Beta-D-XylopyranosideFlurithromycinFlumioxazinAucubinPhthalic AcidL-AsparagineDG(20:4(5Z,8Z,11Z,14Z)-OH(16R)/2:0/0:0)Phenylalanyl-leucyl-leucyl-arginyl-asparagineEstriol2,2-Bis(4-hydroxyphenyl)hexafluoropropane2-Furoic AcidVeranisatin AHistidylcysteineN-[(3a,5b,7a)-3-hydroxy-24-oxo-7-(sulfooxy)cholan-24-yl]-GlycineAustdiolDestruxin EUridine diphosphate-N-acetylglucosaminePseudouridinePG(18:3(9,11,15)-OH(13)/i-12:0)Galactocerebroside1-Palmitoyl Lysophosphatidic AcidCambendazoleBlumealactone CFarnesolMaduramicinPE(16:0/0:0)Linalool oxide D 3-[apiosyl-(1->6)-glucoside]LysoPS(18:1(9Z)/0:0)KetoprofenPS(6 keto-PGF1alpha/20:2(11Z,14Z))UrobilinogenPC(20:4(5Z,8Z,11Z,14Z)-OH(20)/2:0)DimethylaminoparthenolidePS(PGE1/16:0)3-Sulfinylpyruvic acidNeuromedin B (1-3)MorphPE(14:0/5-iso PGF2VI)PE(TXB2/14:0)Arenobufagin2,4-DINITROPHENOLPristanalHelenalin(S)-3-Hydroxyisobutyric acidEnt-kaurenal7-[(1R,2R,3R)-3-Hydroxy-2-[(3S)-3-hydroxyoctyl]-5-oxocyclopentyl]heptanoylcarnitine3-Hydroxybenzoic Acid1,2,10-Trihydroxydihydro-trans-linalyl oxide 7-O-beta-D-glucopyranosideGeneticinSerylmethionineDG(18:1(12Z)-2OH(9,10)/i-18:0/0:0)IdremcinalPE(PGE2/20:4(5Z,8Z,11Z,14Z))VamonolidePindololN-Linoleoyl IsoleucineBedoradrineTriterpenoidPhosphoribosyl formamidocarboxamideN-Arachidonoyl IsoleucineP-OctopamineDihydroxyferuloyl-sinapoyl spermidine6-O-Isobutyryl-Alpha-D-Glucopyranosyl Alpha-D-GlucopyranosidePuromycin3-Benzoyloxy-6-oxo-12-ursen-28-oic acidBeclomethasonePyridinolineGlutarylcarnitine(2S)-2-Cyclopentyl-2-[4-[(2,4-dimethylpyrido[2,3-b]indol-9-yl)methyl]phenyl]-N-[(1S)-2-hydroxy-1-phenylethyl]acetamideFasciculic acid CBeta-Casomorphin-7(5Z,8Z,13E,15S)-11,12,15-Trihydroxyicosa-5,8,13-trienoylcarnitine5-AcetamidovalerateCimicifugosideGingerenone AN'-nitrosoanabasine5'-O-Desmethyl omeprazoleFumagillolTryptophyl-Proline6-allyl-8b-Carboxy-ergolinePhorbol 12-myristate 13-acetateProstratin(4-((5,6-Diphenylpyrazin-2-yl)(isopropyl)amino)butoxy)acetic acid2-succinylbenzoateLysoPC(18:4(6Z,9Z,12Z,15Z)/0:0)HydroxyvalerylglycinePC(22:6(4Z,7Z,10Z,13E,15E,19Z)-OH(17)/DiMe(11,5))8-hydroxy GuanosineTetracosahexaenic acid1-Methyl-2-nitro-3-((tetrahydrofuran-3-yl)methyl)guanidineIsoleucyl-Aspartate2-Hydroxyfelbamate2,3-dihydroxy-3-methylvalerate3-(Benzoyloxy)-2-hydroxypropyl ?-D-glucopyranosiduronic acidAsparagoside BDibekacinAsparagoside A4,5-Dihydro-2,5-dimethyl-4-oxo-3-furanyl butyrate8,12-Epoxy-4(15),7,11-eudesmatrien-1-oneFolinic acidElastinApigeninidin 5-(5''-caffeylarabinoside)GentianineDeltalinePE-NMe2(20:3(8Z,11Z,14Z)/15:0)HydroxygaleonGly-arg-gly-glu-ser-proFuranofukininDG(2:0/0:0/PGF2alpha)4-[(Hydroxymethyl)nitrosoamino]-1-(3-pyridinyl)-1-butanoneVinaginsenoside R5PS(22:4(7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z))Vinaginsenoside R22-hydroxyhexadecanoic acidLysoPC(16:1(9Z)/0:0)Indole-3-carboxilic acid-O-sulphate3,5-dimethoxy-4-(sulfooxy)benzoic acidStavudine(23S,24S)-17,23-Epoxy-24,29-dihydroxy-27-norlanost-8-ene-3,15-dioneSpiropiperidineBeta-D-GlucosamineGUAIANOLIDEPC(P-16:0/PGJ2)DapitantPalosuran1-Ethyl-2-pyrrolidinoneAcacetin 7-[apiosyl(1->6)-glucoside]CDP-DG(i-13:0/a-13:0)PS(18:3(9Z,12Z,15Z)/22:0)5-MethoxydimethyltryptamineOxethazaine2-PhenylacetamideROSAMICINEthyl benzoate(1,10,11,12,14,23-Hexahydroxy-6,10,19-trimethyl-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosan-22-yl) 3,4-dimethoxybenzoate4-phenylbutanic acid-O-sulphateGalantamineLysoPC(0:0/16:0)Guanosine diphosphate mannoseHelianginPE(16:1/0:0)Isofebrifugine(1S,2S,3S,4R)-3-(1-Acetamido-2-ethylbutyl)-4-(diaminomethylideneamino)-2-hydroxycyclopentane-1-carboxylic acid(E)-4,5-Dihydro-6-(2-(4-pyridinyl)ethenyl)-3(2H)-pyridazinoneTetraazacyclododecanetetraacetic acid2-Ethoxyethyl acetateTetraglymeDehydroisoandrosterone 3-glucuronide(2S,3R)-2-Acetamido-3-hydroxy-4-methylpentanoate4-NitroanisoleLotaustralinPE(18:2/0:0)SpongothymidineTRIMOPROSTILGinsenoside Rh6Ginsenoside Rh5DG(22:5(4Z,7Z,10Z,13Z,19Z)-O(16,17)/2:0/0:0)PA(2:0/LTE4)PC(20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)/14:0)Terbogrel5-Azanonane deriv.DIPROTIN BDIPROTIN A1-a,24R,25-Trihydroxyvitamin D2LysylhydroxyprolinePS(18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z))GenipinNorethindroneGamma-GlutamyldopaIndolaprilLicoricidin2-HydroxyestronePS(5-iso PGF2VI/20:1(11Z))P-coumaroyltriacetic acid lactoneErythromycin CMaytansinoid DM4PS(16:0/6 keto-PGF1alpha)4-Allylpyrocatechol sulfateTemocaprilHydroxymethoxyphenylcarboxylic acid-O-sulphate2-(2,4-Dichloro-phenoxy)-N-(2-mercapto-ethyl)-acetamidePinometostatAngiotensin IIIMavoglurant4-(4-(Chloromethyl)phenyl)morpholin-3-one1,11-Undecanedicarboxylic acidLysoPA(16:0/0:0)GitoxinPC(17:2(9Z,12Z)/0:0)SinapineCepharanthineCohibin C2-Oxa-4,7,12-triazatridecan-13-oic acid, 9-hydroxy-5-(1-methylethyl)-3,6-dioxo-8,11-bis(phenylmethyl)-1-(2-pyridinyl)-, 3-pyridinylmethyl ester, (5S,8S,9S,11S)-1-Nitro-7-glutathionyl-8-hydroxy-7,8-dihydronaphthaleneLysoPC(22:4(7Z,10Z,13Z,16Z)/0:0)PG(a-25:0/PGF1alpha)Medicagenic acid 3-O-beta-D-glucosideCarbadoxChrysophaneinMetapro2,2-Bis[4-(2,3-epoxypropoxy)phenyl]propaneBeta-SolaninePGP(20:4(8Z,11Z,14Z,17Z)/PGD2)CholylarginineErgocornineLariciresinol3a,6b,7a,12a-Tetrahydroxy-5b-cholanoic acid4-EthylphenylsulfateSomatostatinPC(P-16:0/PGF1alpha)Asn Ile Thr GluMacrophorin DLumacaftorDihydrozeatin-9-N-glucoside-O-glucosideTetraethylene glycol monododecyl ether1,2,3,4-Tetrahydro-b-carboline-1,3-dicarboxylic acidPGP(PGF1alpha/i-12:0)Menahydroquinone-4PA(18:4(6Z,9Z,12Z,15Z)/5-iso PGF2VI)PGP(16:0/16:1(9Z))2,3,4,5-Tetrahydroxy-6-(1,2,3,4-tetrahydroxybutyl)oxane-2-carbaldehydePE(PGD2/22:5(7Z,10Z,13Z,16Z,19Z))N-Palmitoyl ArginineIndolelactic acidArg-Pro-Pro-Gly-Phe-Ser-Pro7-HydroxyetodolacL-Glutamic AcidAll-trans-Heptaprenyl diphosphateFluvastatinAciclovirBenzyl acetateLactapiperanol D1-beta-D-Arabinofuranosyl-5-fluorocytosineFuraginRiginLysoPE(0:0/18:3(6Z,9Z,12Z))L-a-LysophosphatidylserinePA(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/i-16:0)5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-4'-O-sulphateResmethrin5,6-epoxy,18R-HEPEDihydrozeatin-O-glucoside(-)-SlaframineLestaurtinibStizolamineMG(0:0/i-16:0/0:0)(+)-lariciresinolMART-1 AntigenPE(15:0/0:0)N-Tert-butyl-1-(2-sulfophenyl)methanimine oxidePhenacemide9H-Pyrido[3,4-b]indole-3-carboxylic acid5-(Tetrahydro-2H-pyran-4-yl)-1H-indoleTezampanelRibostamycinGlycylalanylprolylmethionylphenylalanylvalinamideUDP-D-GalactoseCholylserinePIP(20:3(5Z,8Z,11Z)/18:0)SemaxanibZankirenN-Lauroyl TryptophanAdeninePE(20:2/0:0)Oxoadipic acidDG(10:0/LTE4/0:0)16-KetoestradiolQuillaic acid 3-[galactosyl-(1->2)-[xylosyl-(1->3)]-glucuronide] 28-[xylosyl-(1->4)-rhamnosyl-(1->2)-[rhamnosyl-(1->3)]-4-acetyl-fucosyl] esterBenzonitrile, 3-fluoro-5-(2-(2-(fluoromethyl)-4-thiazolyl)ethynyl)-N-Eicosapentaenoyl IsoleucineArtemisinThr Thr Gly Leu IleLeu Ile Ser GluDiphenylhydantoic acidN-CholoylglycineLucidenic acid HIndole carboxylic acid sulfateHistrelin8-Acetamido-2-Methyl-7-Oxononanoic Acid(1S,2R,3R,4R,5R,6S,7S,8R,9R,10R,13R,14R,16S,17S,18R)-6,16,18-Trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,5,7,8,14-pentolLucidenic acid AMethotrexatePC(PGE1/2:0)(6AR,10AR)-3-(1,1-Dimethylbutyl)-6A,7,10,10A-tetrahydro-6,6,9-trimethyl-6H-dibenzo[B,D]pyranG-MelanotropinGeniposidic acidAconineArbutinDG(2:0/LTE4/0:0)FluprednisoloneTributyrylglycerolGlycyl-histidyl-arginyl-proline4-Methylumbelliferyl sulfateMethyldopa(8S,9S,10S,11S,13S,14S,17R)-11,17-Dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,4,5,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-2,3-dione25-Epiruizgenin 3-[4''-rhamnosylglucoside]Perfluoro(methylcyclohexane)HycanthonePenitrem DTG(10:0/i-16:0/8:0)Penitrem ENeocnidilidePenitrem BN-Oleoyl PhenylalanineEcdysonePenitrem A8,9-DiHETrEAscorbyl palmitateHMDB0240697PanoseLansioside ALappaol BPS(14:0/20:3(8Z,11Z,14Z))FraxinPGP(i-12:0/i-15:0)Duratocin2-Hydroxy-6-pentadecylbenzoic acidD-Galactose 1-PhosphatePA(TXB2/14:1(9Z))OmadacyclineCyclopassifloic acid AProglumideEtoperidoneTetronasinPGP(a-13:0/i-16:0)1,4-Butanediol diglycidyl etherTranexamic AcidDipfluzine1H-PerfluorooctaneBoviquinone 4Malic acidNodularin3,5,7,8-Tetrahydro-2-[4-(trifluoromethyl)phenyl]-4H-thiopyrano[4,3-d]pyrimidin-4-one18-HydroxycorticosteroneN-formylanthranilic acidTheasaponin F3TETRAHYDROURIDINECidofovirNonate3-Aminopropyl(diethoxymethyl)phosphinic acid2,2'-(3-methylcyclohexane-1,1-diyl)diacetic acidDimethyl-3-hydroxypyrid-4-oneCascarillinDG(22:4(7Z,10Z,13Z,16Z)/14:0/0:0)Lys Glu Thr GluEplerenone3a,11b,21-Trihydroxy-20-oxo-5b-pregnan-18-alMaleic AcidTaurodeoxycholic acidPIP(5-iso PGF2VI/16:0)(S)-IsowillardiineAcetyl-Ser-Asp-Lys-ProSpirolide ASpirolide C(6beta,7alpha,12beta,13beta)-7-Hydroxy-11,16-dioxo-8,14-apianadien-22,6-olideBeta-D-3-Ribofuranosyluric acidMethylgallic acid-O-sulphateOxypinnatanine(3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic AcidDNOCPolyanethole-sulfate(2E,8E)-10-hydroxydeca-2,8-dien-4-ynoylcarnitineVamoroloneLysoPC(20:3(8Z,11Z,14Z)/0:0)PE(5-iso PGF2VI/20:5(5Z,8Z,11Z,14Z,17Z))1-Linoleoyl-sn-Glycero-3-PhosphocholinePhenylacetylglutaminePC(2:0/PGD1)LysoPA(0:0/18:2(9Z,12Z))Mesaconic AcidL-HistidineN-Oleoyl AlanineLasalocidEthyl MyristateCitrullineCDP-DG(i-14:0/TXB2)Phorbolol myristate acetateSerylisoleucineMG(0:0/5-iso PGF2VI/0:0)3-Mercaptoheptyl acetate6-Hydroxyhexanoic AcidN-EthylglycineCitrusin ITempo-maleimideNeopterinCyclopentylaminePI(PGJ2/18:1(9Z))2-Methylbenzoic Acid17-Deoxyestradiol3',5'-Cyclic GMPPerfluorooctanoic acidTaurohyocholate4-MethylcatecholStreptomycin(D-Pen2,D-Pen5)-EnkephalinCyclotricuspidogenin CRacematesPromegestone3a,12b-Dihydroxy-5b-cholanoic acidMethyl 11,17,21-trihydroxy-3,20-dioxopregna-1,4-diene-16-carboxylateFluocortolone PivalatePA(i-14:0/PGF1alpha)L-Linalool 3-[xylosyl-(1->6)-glucoside]PS(14:1(9Z)/15:0)Isopropyl 2-[[[(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-(pyrimidine-4-carbonylamino)phosphoryl]amino]-2-methyl-propanoateTriethylene glycol bis(3-tert-butyl-4-hydroxy-5-methylphenyl)propionatePE-NMe(22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))Taxine BN-(9Z-Octadecenoyl)-4E,14Z-sphingadienine-1-phosphocholineAspartic AcidMalonic semialdehydeGlycinoeclepin APE(LTE4/DiMe(9,3))EtomidateShikimic acidDeacetyldiltiazemAraloside A2-Decyl-3-Hydroxypentanedioic AcidPI(16:1(9Z)/18:1(9Z))Malonic Acid(11S,14S,17R,20S,23R)-20-Benzyl-17-[3-(diaminomethylideneamino)propyl]-14-(1H-indol-3-ylmethyl)-2,5,13,16,19,22-hexaoxo-1,6,12,15,18,21-hexazabicyclo[21.3.0]hexacosane-11-carboxamide(2xi,3xi)-2,3-Dihydroxy-12,18-ursadien-28-oic acid diacetateDimethyl dimethoxy biphenylMupirocin17beta-Estradiol-3,4-quinoneElemicin12'-Apo-b-carotene-3,12'-diolLysoPS(16:0/0:0)2,3-Secoporrigenin1-(4-O-beta-D-glucopyranosyl-3-methoxyphenyl)-3,5-dihydroxydecaneGlutamylprolineImplitapide3,4-Dimethyl-5-pentyl-2-furanpropanoic acidCDP-DG(i-22:0/i-13:0)N-Acetyl-S-trans,trans-farnesyl-L-cysteine5-Hydroxy-2-[2-methyl-3-(trifluoromethyl)anilino]pyridine-3-carboxylic acid2-Methoxyacetaminophen sulfateN-Linoleoyl LeucineD-ErythroseGamma-GlutamylisoleucineLysoPE(0:0/22:4(7Z,10Z,13Z,16Z))Versetamide6-Hydroxypseudooxynicotine20-Trihydroxy-leukotriene-B426-Glucosyl-1,3,11,22-tetrahydroxyergosta-5,24-dien-26-oateGabexateUridine diphosphate (UDP)(S)-2-Aceto-2-hydroxybutanoic acidCyclo(-D-Tyr-Arg-Gly-Asp-Cys(carboxymethyl)-OH) sulfoxideDG(5-iso PGF2VI/8:0/0:0)2-Hydroxyestradiol[6]-GingerdioneDodecyl-beta-D-maltoside4-[[4-(4-Chlorophenyl)-2-thiazolyl]amino]phenolHomo-L-arginineGluten exorphin CDactimicin(S,E)-ZearalenoneLandiololValylvalineSagopiloneTetradecanedioic acidMomelotinibPectenotoxin 2L-histidinol-phosphateIdazoxanIsokobusoneCis-Uvariamicin IBPI(20:1(11Z)/PGF2alpha)2,3-Dimethoxyphenol sulfateUreidoisobutyric acidPE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/16:0)GlucoobtusifolinAcetaminophenRetinyl beta-glucuronide(23R)-1alpha-Hydroxy-25,27-didehydrovitamin D3 26,23-lactoneSalutaridinolAfamelanotideLupuloneVacciniinPS(TXB2/14:1(9Z))TrehalosePerfluorohexanoic AcidN1-(5-Phospho-a-D-ribosyl)-5,6-dimethylbenzimidazole3-Hydroxyhippuric acid sulfate1-O-E-Cinnamoyl-(6-arabinosylglucose)P-Toluenesulfonic AcidNivalenolXanthochymolHydratopyrrhoxanthinol5-Methylpyrogallol sulfateD-GalactoseDG(12:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)/0:0)1-heptadecanoyl-glycero-3-phosphate5-Phenyl-1,3-oxazinane-2,4-dioneTryptophyl-ThreoninePS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,13E)+=O(15))Butanedioic acid, octenyl-Neu5NAcalpha2->6lactoseLatrunculin BSuberic AcidLucidenic acid E2LFVerbascoside2-(2-Hydroxyethyl)phenyl hydrogen sulfateMETALDEHYDEProcarbazineGlutamylvalinePE(16:1(9Z)/14:1(9Z))N,N-Diallyl-tyrosyl-aminoisobutyryl-aminoisobutyryl-phenylalanyl-leucineDigoxigenin monodigitoxosidePravastatinZingeroneGilteritinibLithocholyltaurineFlurochloridonePeriplocoside ALithocholate 3-O-glucuronideIbuprofenBuprenorphine glucuronideN-Palmitoyl Valine(1R,9S,10S)-17-[(3-Hydroxycyclobutyl)methyl]-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol4-[(2,4-Dihydroxy-3,3-dimethylbutanoyl)amino]butanoic acidDynorphin B (6-9)MG(20:4(6E,8Z,11Z,14Z)+=O(5)/0:0/0:0)Monoaspartyl chlorin e6ElaterinideBisphenol ACirsimaritinGarcinone APGP(i-14:0/6 keto-PGF1alpha)ApramycinOcfentanilPC(18:3(10,12,15)-OH(9)/2:0)PA(8:0/6 keto-PGF1alpha)Prolyl-Glutamine(4,6-Dimethylpyrimidin-5-yl)-[4-[4-[2-[2-methoxy-4-(trifluoromethyl)phenyl]ethyl]-3-methylpiperazin-1-yl]-4-methylpiperidin-1-yl]methanoneCis-Sinapic acidSecologanateColforsin daropatePS(14:0/PGJ2)CyclofenilNorzolmitripan3-Methyl-2-Oxovaleric Acid1-(2-Amino-3-hydroxyphenyl)-ethanone sulfatePS(18:1(11Z)/14:0)2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-5-(2-fluorophenyl)-1-(2-hydroxyethyl)-Neoacrimarine GL-3-Aminodihydro-2(3H)-furanone9,10-DiHOME2-DechloroethylifosfamideEpothilone BTaurineEpothilone DPteroside ZAmastatin2,5-Dioxopyrrolidin-1-yl 2-(acetylthio)acetateN-Acetylserotonin sulfateNaltrexonePG(i-13:0/i-20:0)DigimedGastrodin6-Thiourate3-Methyl-1-(2,4,6-trihydroxyphenyl)-1-butanoneDihydrocubebinProscillaridinDihydroouabainGanoderic acid NGanoderic acid LIsoleucyl-TryptophanLeukotriene E3Pentafluorobenzyl etherStearaldehydeRetinoyl b-glucuronidePrednisoneGanoderic acid F4-coumaroylshikimateHordatine B10-GingerdionePC(2:0/20:4(5Z,8Z,11Z,14Z)-OH(20))NeuAc(alpha->6)GalNAc(alpha1->O)SerIle Glu His LysS-(PGA1)-glutathione9(S)-HpODE3-Acetylphenol sulfateLetaxabanMG(18:1(12Z)-2OH(9,10)/0:0/0:0)L-Palmitoylcarnitine(4-Chloro-2-methylphenoxy)acetic acidAstragaloside IIIN-Docosahexaenoyl HistidineLeucomycinL-TryptophanRuscogeninDimethyl fukiic acid[(2R,5R)-5-(2-Amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [(2R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphatePA(20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z))D-manno-2-HeptuloseBoc-phepsi(CH(OH)CH2)phe-val-phe-morpholinePGP(18:3(9,11,15)-OH(13)/16:0)1,2-Cyclohexanedicarboxylic acid, 4-methyl-3-MethyldioxyindoleValylmethioninePhenol sulphate4-Methoxyindoxyl sulfateMelleolidePicolinic AcidPS(20:4(5Z,8Z,11Z,14Z)-OH(19S)/20:0)Radalbuvir2-Carboxyarabinitol 1-phosphateAllylisopropylacetamidePE(18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))2-Hydroxybutyric AcidChinenoside VN-[(2R,3R,4S,6R)-4,6-Dihydroxy-6-methyl-2-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-3-yl]acetamideCis-Ferulic acid 4-sulfate4-Hydroxy-4-(methylnitrosoamino)-1-(3-pyridinyl)-1-butanoneArillatose BVal-Gly-Val-Ala-Pro-GlyPantetheine 4'-phosphateSuccinic AcidPonasteroside ACyclopropylpyrroloindoleGln Glu Leu GluPregnenolone sulfate17alpha-Estradiol(3S,5R,6R,7E)-3,5,6-Trihydroxy-7-megastigmen-9-oneMG(0:0/PGD2/0:0)2'',6''-O-DiacetylonininDazoxibenEnterolactone25-Acetyl-6,7-didehydrofevicordin F 3-glucosideCyclohexyladenosine3-Hydroxy-5Z-octenyl acetateN-Methyl-2-phenyl-n-[(5r,7s,8s)-7-(pyrrolidin-1-yl)-1-oxaspiro[4.5]dec-8-yl]acetamide1-Nitro-5,6-dihydroxy-dihydronaphthaleneBenazeprilat3beta,7alpha-Dihydroxy-5-cholestenoateCilastatinCorchorosol ABlumenol C O-[rhamnosyl-(1->6)-glucoside]Milbemycin alpha6CinchonidineBlumenol C O-[apiosyl-(1->6)-glucoside]Gamma-ButyrolactoneTRIETHYLENE GLYCOLPE(18:0/0:0)RepaglinideArabinosylhypoxanthine(R)-2-Amino-3-benzylthio-N-(4-nitrophenyl)propionamideSulfolithocholylglycineParamethasone acetateIndoxamDalarginBardoxoloneTri-glyceride16-Hydroxyhexadecanoic acid9-OxodecanoylcarnitinePE(18:1(9Z)/0:0)4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol glucuronideMicronomicinD-Glycero-D-galacto-heptitolPC-M5RutamarinIsopetasosideValylhydroxyprolineWithanolide BRhizonin APC(2:0/20:4(8Z,11Z,14Z,17Z)-2OH(5S,6R))2-Aminoacridone15(S)-Fluprostenol isopropyl esterAnthralin5-(3',5'-Dihydroxyphenyl)-gamma-valerolactone sulfateAmikacin11-Hydroperoxy-H4-neuroprostaneUrothionTrilostanePyrazofurinNorchalciporyl propionateLeucomycin a5PseudoprotodioscinIsovitexin 2''-O-Arabinoside(5Z,7E)-(3S)-26,26,26-Trifluoro-27-nor-9,10-seco-5,7,10(19)-cholestatriene-3,25-diol3-((((-Oxoheptyl)amino)acetyl)amino)methyl-7-oxobicyclo(2.2.1)hept-2-yl-5-heptenoic acidHymenoxonTetrahydrodeoxycortisol(3Z)-phytochromobilinAconitinumErythroseMoxidectin1-CarboxyethylisoleucineCyclo-dopa 5-O-glucosideAbbott-195773{1-[2-(4-Carbamimidoyl-benzoylamino)-propionyl]-piperidin-4-yloxy}-acetic acid3-O-Protocatechuoylceanothic acidGymnodiminePalmitoyl Ara-CAplavirocNovaluron1-Deoxo-1,10-dehydrosalvinorin AFlavin adenine dinucleotide (FAD)GlutamylleucineCitronellyl beta-sophorosidePS(LTE4/15:0)IsoforskolinLyciumoside VIIICGP72383Undecanedioic acidPhenytoin methylcatecholLysoPC(15:0/0:0)3,4-Dimethyl-5-pentyl-2-furannonanoic acid2-MercaptobenzothiazoleSer-LeuIsovalerylglycinePE(18:3/0:0)Orotic AcidNordihydrocapsaicinMalvidin 3-rhamnoside(1R,2R,4R,5S)-(+)-p-Menthane-2,5-diol4-Hydroxyphenylpyruvic acidCholesteryl glucoside10-Deacetylbaccatin IIILuteolin 7-glucoside 3'-glucuronideGlyceryl lactopalmitatePG(20:3(8Z,11Z,14Z)-2OH(5,6)/i-13:0)PyrrhoxanthinolAlpha-Hydroxyhippuric AcidDhlnlImmepipPA(P-16:0/5-iso PGF2VI)Pelargonidin 3-O-beta-D-p-coumaroylglucosidePA(18:3(9Z,12Z,15Z)/14:0)Avermectin A1aMethylmalonic AcidOpiorphinDisofeninLuteolin-6-C-GlucosideGlutaminyltryptophan(E)-indol-3-ylacetaldoximeRiboflavinPhenazineLyciumoside IXMPPa (Methyl pyropheophorbide-a)ArabinogalactoseDiazepamSENECIPHYLLINE2,4-DimethylphenolEstradiol cypionateTropinoneKukoamine CKukoamine BAlpha-ZearalenolPhospho-ibuprofenMonotropeoside2-Methoxy-4-vinylphenolCDP-DG(16:1(9Z)/18:2(9Z,12Z))ArmillaneSer Ile Gln Glu6''-O-MalonyldaidzinHexaminolevulinateTrihydroxycoprostanoic acidPS(22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z))Dioncophylline CGingerglycolipid APhotobarbatusin IPantothenic Acid2-Methoxyestrone9,10,13-TriHOMELeustroducsin B13,14-Dihydro PGF-1aVerbascoside A2,2-Dimethyl-5-oxo-2,3,4,5-tetrahydroindeno[1,2-b]pyran-6-Carboxylic Acid9(S)-HpOTrEMiglitol4-MethoxyestroneSer Asn Thr Ile LeuLysoPC(18:0/0:0)Glyburide2-Amino-3-cyclohexylpropanoic acidAc-Asp-Lys-Ala-Thr-Ile-Gly-Phe-Glu-Val-Gln-Glu-GluPS(18:1(12Z)-2OH(9,10)/14:1(9Z))(R)-LaudanidineCis-3-Hexenyl b-primeverosidePetasitenineN-({(1s,2r)-2-[(S)-[(1r)-1-{[(Benzyloxy)carbonyl]amino}-2-Phenylethyl](Hydroxy)phosphoryl]cyclopentyl}carbonyl)-L-TryptophanADPDeoxycholic acid glycine conjugate3-Methoxy-4-Hydroxyphenylglycol sulfate(3x,5x,10x)-9,10-Didehydroisohumbertiol O-[rhamnosyl-(1->4)-rhamnosyl-(1->2)-[rhamnosyl-(1->6)]-glucoside]DG(6 keto-PGF1alpha/8:0/0:0)OctanoylcarnitineFusidic AcidCucurbitacin I 2-glucosideArvensoside DIsoferulic acid 3-sulfatePolyporusterone A(1R*,2R*,4R*,8S*)-p-Menthane-1,2,8,9-tetrol 9-glucosideSM(d17:1/20:3(8Z,11Z,14Z)-2OH(5,6))Eriojaposide BPA(8:0/12:0)Uridine-5'-MonophosphateAnnomuricatin AFumonisin B2Uridine1-Methoxy-4-(2-propenyl)benzeneAvenestergenin A12-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-2-Amino-3-(4-hydroxyphenyl)propanoyl]pyrrolidin-2-yl]methylamino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]acetic acidDehydrosafynolBrincidofovir3,4-Dihydro-9-hydroxy-[1]benzothieno[2,3-f]-1,4-thiazepin-5(2H)-oneChlorambucilOnoninAgavoside AFumonisin A1Nummularine APS(PGE2/18:3(9Z,12Z,15Z))THIARABINETyrosol 4-sulfateJacarandic acidCorchorusoside EVitamin A2Z-Leu-Leu-Norvalinal5-Deoxy-D-riboseUzarigenin 3-[xylosyl-(1->2)-rhamnoside]PG(PGJ2/22:4(7Z,10Z,13Z,16Z))L-Tyrosine4-AcridinecarboxamideUric AcidIneketoneNonactinPA(PGF1alpha/P-16:0)Ginsenoside RdClarithromycinIsocarbacyclinSucroseSerylvalylglycylglutamic acidEpostaneN-Jasmonoylisoleucine2beta-HydroxytestosteroneDG(2:0/PGD2/0:0)(10Z,14E,16E)-10,14,16-Octadecatrien-12-ynoic acid2-(4-Methoxyphenyl)ethyl hydrogen sulfateAlbaconazoleApicidinCephaelineLeu Glu Ile GluHomoyessotoxinTaurocholic acid4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanone3-[2-[[2-[[2-Acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]propanoylamino]-4-oxobutanoic acid4,4'-(3,5-Diacetoxyheptane-1,7-diyl)bispyrocatecholPG(22:6(4Z,7Z,10Z,13E,15E,19Z)-OH(17)/i-15:0)Alpha-ENDORPHIN(5E)-7-{4,6-Dihydroxy-2-[(1E,5E)-3-hydroxyocta-1,5-dien-1-yl]oxan-3-yl}hept-5-enoylcarnitine3-[4-(sulfooxy)phenyl]propanoic acidFagominePerindoprilPE(20:3/0:0)HGluValLeuPnsAspAlaGluPheOHMeloside(4Z,7Z,10S,11E)-10-Hydroxy-12-[(1S,2R,5S)-5-hydroxy-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl]dodeca-4,7,11-trienoylcarnitineKaltostatCysteinyl-ValineDihydrocytochalasin BGcdcs(R)-pantoatePA(22:4(7Z,10Z,13Z,16Z)/18:3(6Z,9Z,12Z))Val-pro-proPregnanediol 3-O-glucuronideBenzoic AcidRitalinic acidCyclo(D-Trp-D-Asp-Pro-D-Ile-Leu)PA(20:5(5Z,8Z,11Z,14Z,16E)-OH(18R)/2:0)StachyflinLacosamide-glucuronidePG(i-14:0/20:4(5Z,8Z,11Z,14Z)-OH(18R))9-Hydroxy-10,12-Octadecadienoic AcidN-Acetylneuraminic Acid1,2-Dihydronaphthalene-1,2-diol5-Hydroxypentanoic acidCimifugin3'-Hydroxy-HT2 toxinBenzyl sulfateSwertisinLeucyl-TyrosineDeoxycholic acid 3-glucuronideSulfoglycolithocholate(2-)7,8-Dichloro-1,2,3,4-tetrahydroisoquinolineFurohyperforinAstaxanthinCortisol9-(2,3-dihydroxypropoxy)-9-Oxononanoic AcidPG(i-12:0/5-iso PGF2VI)10,20-Dihydroxyeicosanoic acid45-Hydroxyyessotoxin[6]-Gingerdiol 5-O-beta-D-glucopyranosidePG(i-12:0/PGE2)5-Hydroxy-2-oxoindolin-3-yl sulfateAnhydroerythromycinIndeloxazineImidazoleacetic acid ribotideButyl butyryllactateMesaconitineDG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/14:0/0:0)LigustrosideLysoPE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)TazemetostatD(CH2)5[D-Ile2,Ile4]AVPN-[(3s)-2-Oxotetrahydrofuran-3-Yl]butanamide5-Hydroxyindolin-2-one sulfateNitrosobenzeneAtorvastatin13-Demethylspirolide CHydroxyprolyl-ValineEthylmorphine1-Dehydro-[6]-gingerdione2-Amino-N-[1-[[2-[[1-(2-hydroxyethylamino)-1-oxo-3-phenylpropan-2-yl]-methylamino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamideImazamethabenz-methylPS(20:4(8Z,11Z,14Z,17Z)/14:1(9Z))ClovoxaminePC(2:0/PGE1)BiricodarLysoPE(P-18:0/0:0)2-Methoxy-4-methylphenol sulfateHydroxybuprenorphineNeotussilagineBiolimus A93-[[3-Methoxy-5-(1H-pyrrol-2-yl)pyrrol-2-ylidene]methyl]-1,4-dimethyl-4,5,6,7-tetrahydro-2H-isoindoleDG(8:0/i-16:0/0:0)Glu-val-phePE(18:4(6Z,9Z,12Z,15Z)/14:1(9Z))3-O-Methylniveusin A3-Benzoyloxy-11-oxo-12-ursen-28-oic acid3-HydroxycarbamazepineSM(d18:1/20:1(11Z))Z-Ile-Glu(O-t-butyl)-Ala-LeucinalEmbelinMontelukastCalenduloside G methyl esterIsovaleryl-Val-Val-Sta-OEtPFNACitramalic AcidPE(6 keto-PGF1alpha/DiMe(11,3))ZabiciprilAndrostane-3,17-diol dipropionateAcetyl-arginyl-glycyl-aspartyl-serinamide(R)-2-(4-(Tert-butoxycarbonyl)morpholin-3-yl)acetic acidNystatinDG(15:0/20:3(8Z,11Z,14Z)/0:0)Gibberellin A122,2,3,3-TetramethylcyclopropanecarboxamideCitreoviridin D20-Hydroxy-leukotriene E4PentostatinFlavogallolFormycin bAlbiflorinPetromyzonol sulfateLinezolidNavarixinLactulose3-O-beta-D-Galactopyranosyl-L-arabinoseCyclopassifloside IPIP2(18:0/16:0)PGP(PGJ2/22:6(4Z,7Z,10Z,13Z,16Z,19Z))Cis-9,10-Epoxystearic acidTraxoprodilAustalide K3-Propoxy-1H-pyrazole-4,5-diolPE(14:1(9Z)/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17))(15a,20R)-Dihydroxypregn-4-en-3-one 20-[glucosyl-(1->4)-6-acetyl-glucoside]5-(4-Carboxybutylperoxy)pentanoic acidTyr-D-thr-gly-phe-leu-thrMyo-Inositol(17E,19E,21E,23E,25E)-4,6,8,10,12,14,16,27-Octahydroxy-3-(1-hydroxyhexyl)-17,28-dimethyl-1-oxacyclooctacosa-17,19,21,23,25-pentaen-2-oneDeoxyuridineGalactinolDL-m-TyrosineZeranolCDP-DG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/5-iso PGF2VI)Tocopheronic acidPretyrosineCapsianoside IVMolinate2-Furancarboxylic acidPG(i-12:0/i-13:0)Pralsetinib8-Epiloganic acidSaquinavir-NORhizoxinGibberellin A37(+)-IsofebrifugineEtiocholanolone glucuronidePI(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13E,15E,19Z)-OH(17))Citric Acid(2S)-3-Hydroxy-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acidMibefradilBisphenol A bis(2-hydroxyethyl)etherDG(18:1(12Z)-O(9S,10R)/0:0/2:0)TelinavirFumitremorgin BHBOA trihexoseArachidoyl glycineCeanothine BPG(18:2(9Z,12Z)/16:0)DG(20:4(6E,8Z,11Z,14Z)+=O(5)/2:0/0:0)3,17-Androstanediol glucuronideQuinol glucuronideMozenavir5(6)-Epoxy Prostaglandin E1PsilocybineVenoterpineIle Val Ser LysStrophanthidinBeta-FunaltrexamineMoroxydineTrachelogeninNormethandroneGibberellin A15Threonic Acid2,6-Diamino-5-hydroxyhexanoic acid9-(Chloromethyl)anthracene13-Methyl-7-[9-(4,4,5,5,5-pentafluoropentylsulfinyl)nonyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diolPS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z))6-Dehydrotestosterone glucuronide5(S)-Hydroperoxyeicosatetraenoic acidPS(PGJ2/15:0)Senecionine N-oxideGlycerophosphoinositolCavipetin DNaloxoneMirodenafilL-SerinePhysapruin BHMDB0304569Leu Gln Tyr Asp6-Hydroxy-3,4-dihydro-2(1H)-quinolinoneSilenoside C1,2,3,10-Tetramethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-oneBenzeneacetamide-4-O-sulphatePanomifene(3S)-3-hydroxycyclocitralMidecamycin acetateLufenuronPE-NMe2(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))Cholylglutamic acidMetocurineGlycyl-prolyl-arginyl-valyl-valyl-glutamic acidHovenidulcigenin BHovenidulcigenin AMenadione bisulfiteHydroxypropionylcarnitineXemilofibanCaffeic acid sulfatePA(22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/13:0)Cholylhistidine2-Hydroxystearic acidN-AcetylhistamineN-Docosahexaenoyl Cysteine13-Demethyl tacrolimusHomovanillic acid sulfateAtractylenolide III3-hydroxypentadecanoic acidB-D-Glucuronopyranosyl-(1->3)-a-D-galacturonopyranosyl-(1->2)-L-rhamnoseIsobutyl 4-hydroxybenzoatePlazomicinOrotidylic acidCoutaric acidAsperulosidic acidDorsomorphinOlitorinPhosphoenolpyruvic Acid6-O-Oleuropeoylsucrose2-Methylbenzyl alcohol acetateRhodamine 1103-Feruloylquinic acidPropionic AcidDihyroxy-1H-indole glucuronide IALANYL-dl-PHENYLALANINE(9S,10S)-10-hydroxy-9-(phosphonooxy)octadecanoateScopolaminePentalenic acidPE(14:1(9Z)/18:4(6Z,9Z,12Z,15Z))(10E,15Z)-9,12,13-Trihydroxyoctadeca-10,15-dienoylcarnitine(6R)-6-(2-Hydroxy-2-methylpropyl)-3-[(1R)-1-[4-(1-methyl-2-oxopyridin-4-yl)phenyl]ethyl]-6-phenyl-1,3-oxazinan-2-oneN-Palmitoyl AsparagineOvalicin4,6-O-Ethylidene-alpha-D-glucoseSolasonine(+/-)-PelletierineManoalideDG(2:0/0:0/20:3(8Z,11Z,14Z)-2OH(5,6))(S)-scoulerine6-KetoestriolVitexinPC(LTE4/22:1(13Z))Gluconic Acid(S)-6-Acetamido-2-(2-((S)-2-acetamido-4-methylpentanamido)acetamido)-N-(4-methyl-2-oxo-2H-chromen-7-yl)hexanamidePC(6 keto-PGF1alpha/2:0)DHAP(18:0)Edta citrate3-Phosphoglyceric acidDocebenone3-Methoxyphenol sulfate2'-Fluoro-2',3'-dideoxyinosineOxolinic acidFipexideGlycochenodeoxycholic acid 3-glucuronide4-Oxo-1-(3-pyridyl)-1-butanone6-Hydroxyindoxyl sulfate2-(7'-methylthio)heptylmalatePE(17:0/0:0)Linalool 3,7-oxide beta-primeverosideCDP-DG(i-12:0/i-12:0)3-(Glutathion-S-yl)acetaminophenMethionine sulfoxideVal Ala Ile GluGliadorphinSalicylic acid 2-beta-D-glucoside20-Hydroxy-leukotriene B4Prolyl-ThreoninePhysangulideFAHFA(18:0/5-O-16:0)(2r,3r,4s,5r,6s)-2-(Hydroxymethyl)-6-Sulfanyl-Oxane-3,4,5-TriolRaffinoseKaempferol 3-glucosyl-(1->2)-(6''-acetylgalactoside)-7-glucosidePE(LTE4/22:0)Milbemycin beta1Salicyluric acid5-AndrostenediolPhenylalanylmethionineDG(22:4(7Z,10Z,13Z,16Z)/16:1(9Z)/0:0)2-Hydroxy-desipramine glucuronide2-Hydroxymyristic Acid5-(N-Hexadecanoyl)aminofluorescin3-Hydroxydodeca-5,7-dienoylcarnitineBiopterin1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthaleneDaidzeinEthyl ((3,4,5-trihydroxy-6-((4-(4-isopropoxybenzyl)-1-isopropyl-5-methyl-1H-pyrazol-3-yl)oxy)tetrahydro-2H-pyran-2-yl)methyl) carbonateAvenanthramide A2ArbaprostilfalseAnalysis of flavor formation and metabolite changes during production of buffalo milk Double-Layer Steamed Milk Custard<p>Metabolomics analysis showed that concentration of free amino acids and short-chain fatty acid lipids were increased in DLSMC, and they were more easily digested and absorbed. Key metabolic pathways, including alanine, aspartate, and glutamate metabolism, starch and sucrose metabolism, and glycerophospholipid metabolism, appear to be involved in forming essential flavors. Our research revealed that the manipulation of thermal processing and the oxidation of fatty acids in buffalo milk are crucial factors influencing the flavor profile of DLSMC.</p>2025-08-232025-07-15MTBLS12717HMDB0250439HMDB0255710HMDB0010392HMDB0010385HMDB0006285;PW_C002706HMDB0254093HMDB0245577HMDB0037560HMDB0011564;HMDB0245964HMDB0301778HMDB0242047HMDB0060095;PW_C040451HMDB0028699;HMDB0304776HMDB0034525HMDB0010403HMDB0000279;PW_C000189HMDB0032232HMDB0302241HMDB0002122HMDB0256579HMDB0302993;LMST01010198HMDB0254177HMDB0251330HMDB0037789HMDB0244567HMDB0259739HMDB0038149HMDB0255213HMDB0302463HMDB0249870HMDB0302470HMDB0257238HMDB0240266;HMDB0004815;HMDB0000484HMDB0002428HMDB0015111;PW_C009415HMDB0010387HMDB0249633HMDB0032669HMDB0001320HMDB0041044HMDB0009417;PW_C005465HMDB0006760;PW_C002913HMDB0030918HMDB0258139HMDB0006472HMDB0112099HMDB0001183HMDB0303335HMDB0260277HMDB0240601HMDB0248678HMDB0001104HMDB0244378HMDB0032075;HMDB0032073HMDB0038580;LMFA02000289HMDB0036690HMDB0041233HMDB0061033HMDB0244166HMDB0038558HMDB0240775;LMFA07070083HMDB0034107HMDB0033833;HMDB0303905;MJDBOTE0000298HMDB0031411HMDB0256741HMDB0243685HMDB0256711HMDB0249369;LMFA01030090HMDB0304091;HMDB0302963HMDB0005783HMDB0257928HMDB0245344HMDB0006765HMDB0030996HMDB0038622HMDB0000447HMDB0248341HMDB0035984HMDB0252101HMDB0031673HMDB0035798HMDB0040729HMDB0251573HMDB0253857HMDB0013070HMDB0060061HMDB0112193HMDB0030524HMDB0266931HMDB0004350HMDB0036763HMDB0254874HMDB0259955HMDB0245586HMDB0246998HMDB0029388HMDB0247977HMDB0028887HMDB0296908HMDB0250756HMDB0062483HMDB0007092;PW_C003143HMDB0272630HMDB0060559;PW_C040628HMDB0290422HMDB0014531HMDB0303977;HMDB0003175;LMFA03010030HMDB0014722;PW_C009073;HMDB0249344;MJDBOTE0001447HMDB0246785HMDB0241085HMDB0060119HMDB0057826;PW_C038280HMDB0241097HMDB0242687HMDB0036873;HMDB0001991HMDB0242297;HMDB0252258HMDB0002577;LMST05010044HMDB0038348HMDB0254039;HMDB0028933HMDB0030368;LMFA05000556HMDB0059850HMDB0284912HMDB0014884;LMFA08020169;MJDBOTE0001596HMDB0249361HMDB0006852HMDB0259762HMDB0283883HMDB0254362HMDB0004912HMDB0255693HMDB0268987HMDB0266658HMDB0247171HMDB0255204HMDB0039967HMDB0247956;HMDB0031448HMDB0254061;HMDB0015283HMDB0264424HMDB0263501HMDB0010408HMDB0290556HMDB0246466HMDB0041530HMDB0254029HMDB0001898HMDB0011896HMDB0034927;LMST01010104HMDB0000734HMDB0242623;HMDB0254722;HMDB0254721;HMDB0254730HMDB0284330HMDB0036406HMDB0250619HMDB0248652HMDB0030737HMDB0012535HMDB0000321;LMFA01170049HMDB0247405HMDB0253575HMDB0254710HMDB0037467;LMPK12112634HMDB0259342HMDB0281461HMDB0249438HMDB0256594HMDB0014646;MJDBOTE0000854HMDB0035685HMDB0040852HMDB0252932HMDB0245970HMDB0251271HMDB0030886HMDB0000446HMDB0302339HMDB0028942HMDB0002580HMDB0259756HMDB0062407HMDB0281244HMDB0031354HMDB0031959HMDB0302658HMDB0032211;HMDB0011623;LMFA06000052HMDB0281179HMDB0242562HMDB0254705HMDB0003640;HMDB0245808HMDB0011857HMDB0303074HMDB0294385HMDB0275744HMDB0037340HMDB0030003;HMDB0302313;HMDB0302264HMDB0251875HMDB0255694HMDB0280966HMDB0039342HMDB0256685HMDB0268095HMDB0242755;HMDB0014964HMDB0282076HMDB0013624HMDB0252686HMDB0304035;HMDB0006768;LMST02020083HMDB0283012HMDB0253667HMDB0011872HMDB0267758HMDB0256007HMDB0250631HMDB0029891HMDB0248579;HMDB0004246HMDB0012815HMDB0288830HMDB0247141HMDB0275639HMDB0241752HMDB0246084HMDB0277826HMDB0275903HMDB0061918;HMDB0244886HMDB0260532HMDB0028923HMDB0006578HMDB0031223HMDB0293124HMDB0241734HMDB0011175HMDB0250940HMDB0284924HMDB0271141HMDB0029354HMDB0252606HMDB0252616HMDB0294371HMDB0011913HMDB0241112HMDB0060558HMDB0258643;MJDBOTE0001224HMDB0254904HMDB0241718HMDB0280338HMDB0258348HMDB0275600HMDB0281253HMDB0001065HMDB0255289HMDB0254356;HMDB0247402HMDB0029340HMDB0244502;LMPR0104330003HMDB0029785HMDB0277788HMDB0283325HMDB0294381HMDB0271873HMDB0249347HMDB0262989HMDB0241208HMDB0004207HMDB0252205HMDB0292420HMDB0259311HMDB0255475;HMDB0257776HMDB0254548;PW_C000197;HMDB0000291;HMDB0304531HMDB0041467HMDB0276400HMDB0254493HMDB0258644;MJDBOTE0000976HMDB0244605HMDB0028822HMDB0038376HMDB0302593;LMST01010103HMDB0013674HMDB0301964HMDB0035369HMDB0283142HMDB0248239HMDB0014917;MJDBOTE0001474HMDB0254743HMDB0000716;HMDB0000070;MJDBOTE0000664HMDB0302041HMDB0033347HMDB0005849;LMST02020105HMDB0030205HMDB0059791HMDB0276998HMDB0294372HMDB0034575HMDB0032562HMDB0259346HMDB0302048HMDB0041354HMDB0251027HMDB0003950HMDB0302594HMDB0288513HMDB0000756HMDB0036626;HMDB0034527HMDB0254737HMDB0003626;HMDB0012469HMDB0303681HMDB0294119HMDB0000489HMDB0258278HMDB0252688HMDB0032644HMDB0248425HMDB0040133HMDB0014752;HMDB0247183HMDB0246981HMDB0033615HMDB0040961HMDB0278146HMDB0035602;HMDB0035604HMDB0006598HMDB0283331HMDB0247230HMDB0000954;MJDBOTE0000325HMDB0038516HMDB0011177HMDB0276044HMDB0241792HMDB0246716HMDB0031167HMDB0277865HMDB0014584;PW_C008951HMDB0001238;PW_C000956HMDB0277052HMDB0248310HMDB0293076HMDB0292368HMDB0271346HMDB0011687HMDB0253301HMDB0301757;PW_C000118;HMDB0000182;MJDBOTE0000528HMDB0034365HMDB0030206HMDB0302864HMDB0029427HMDB0035345HMDB0002339HMDB0291146HMDB0241955;LMFA08020137HMDB0015592HMDB0039021HMDB0060754HMDB0036074HMDB0250987HMDB0304456HMDB0060067HMDB0252925HMDB0251051HMDB0029121;HMDB0304792HMDB0259094HMDB0004094HMDB0252192HMDB0242382HMDB0247890HMDB0039389HMDB0280938HMDB0241665HMDB0254897HMDB0034518HMDB0278766HMDB0000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