MetaboLightsapplication/xmlftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/m_MTBLS11623_LC-MS_positive_reverse-phase_metabolite_profiling_v2_maf.tsvftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/m_MTBLS11623_LC-MS_negative_reverse-phase_metabolite_profiling_v2_maf.tsvftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/a_MTBLS11623_LC-MS_positive_reverse-phase_metabolite_profiling.txtftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/a_MTBLS11623_LC-MS_negative_reverse-phase_metabolite_profiling.txtftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/s_MTBLS11623.txtftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/i_Investigation.txtftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_E2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_C5.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_E3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_QC4.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_QC6.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_QC7.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_C1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_C5.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_QC5.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_QC2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_C2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_E6.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_C6.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_E4.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_QC3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_QC1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_E3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_C4.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_QC8.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_QC5.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_C2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_E5.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_QC2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_E4.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_C3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_QC7.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_QC4.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_E1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_C3.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_E5.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_E1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_C4.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_E2.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_QC8.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_C6.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_QC6.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_QC1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/pos_E6.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_C1.rawftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623/FILES/RAW_FILES/neg_QC3.rawprimaryOK200ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS11623<p>The online KEGG, HMDB database was used to annotate the metabolites by matching the exact molecular mass data (m/z) of samples with those from database. If a mass difference between observed and the database value was less than 10 ppm, the metabolite would be annotated and the molecular formula of metabolites would further be identified and validated by the isotopic distribution measurements. We also used a in-house fragment spectrum library of metabolites to validate the metabolite identidification.</p>MetaboLightsPublicLiquid Chromatography MS - negative - reverse phaseLiquid Chromatography MS - positive - reverse phase<p>All samples were acquired by the LC-MS system followed machine orders. Firstly, all chromatographic separations were performed using a Thermo Scientific UltiMate 3000 HPLC. An ACQUITY UPLC BEH C18 column (100 mm x 2.1 mm, 1.8 μm, Waters, UK) was used for the reversed phase separation. The column oven was maintained at 35 °C. The flow rate was 0.4 mL/min and the mobile phase consisted of solvent A (water, 0.1% formic acid) and solvent B (acetonitrile, 0.1% formic acid). Gradient elution conditions were set as follows: 0.0-0.5 min, 5% B; 0.5-7.0 min, 5-100% B; 7.0-8.0 min, 100% B; 8.0-8.1 min, 100-5% B; 8.1-10.0 min, 5% B. The injection volume for each sample was 4 μL.</p>Caffeine Enhances Antitumor T-cell Activity via COL12A1/IDO1/Kyn axis and Sensitivity to Anti-PD-1 Immunotherapy in Colorectal Cancer.Yuechen LiuSouthern Medical UniversityHCT-116 cellmass spectrometry assay<p>The collected samples were thawed on ice, and metabolite were extracted with 50% methanol buffer. Briefly, 20 μL of sample was extracted with 120 μL of precooled 50% methanol, vortexed for 1 min and incubated at room temperature for 10 min; the extraction mixture was then stored overnight at -20 °C. After centrifugation at 4000 x g for 20 min, the supernatants were transferred into new 96-well plates. The samples were stored at -80 °C prior to the LC-MS analysis. In addition, pooled QC samples were also prepared by combining 10 μL of each extraction mixture</p>Homo sapienshttps://www.ebi.ac.uk/metabolights/MTBLS11623Liu Yuechen. lyc19960908@163.com.<p>The acquired MS data pretreatments including peak picking, peak grouping, retention time correction, second peak grouping, and annotation of isotopes and adducts was performed using XCMS software. LC-MS raw data files were converted into mzXML format and then processed by the XCMS, CAMERA and metaX toolbox implemented with the R software.</p>caffeinelyc19960908@163.com<p>Supernatants from caffeine-treated and untreated HCT116 tumor cells</p>MetabolomicsCaffeic Acidsuntargeted metabolitesculture supernatantCaffeic Acidsuntargeted metabolitesculture supernatant<p>A high-resolution tandem mass spectrometer Q-Exactive (Thermo Scientific) was used to detect metabolites eluted form the column. The Q-Exactive was operated in both positive and negative ion modes. Precursor spectra (70-1050 m/z) were collected at 70,000 resolution to hit an AGC target of 3e6. The maximum inject time was set to 100 ms. A top 3 configuration to acquire data was set in DDA mode. Fragment spectra were collected at 17,500 resolution to hit an AGC target of 1e5 with a maximum inject time of 80 ms. In order to evaluate the stability of the LC-MS during the whole acquisition, a quality control sample (pool of all samples) was acquired after every 10 samples.</p>Caffeoyl tyrosineDoxazosin2-FuroateOlanzapineCorticosterone11,12-DimethoxydihydrokawainSalmeterol4-(4-Hydroxyphenyl)-2-butanoneMethionine sulfoximineDiazoxidePiceatannolFolic acidPetunidin 3-glucosideCefuroximeDeoxyinosine(2-Naphthalenyloxy)acetic acidDeoxyribose 1-phosphatePantothenolIndole-3-methyl acetateErgonovineL-ErythruloseKetoleucineCyanidin 3-sambubioside 5-glucosideThalidomideTetracosanoic acidIsosakuraninParaoxon3-Methyl-3-hydroxypentanedioateBiotin[4]-Gingerdiol 3,5-diacetateScopoletinCarprofenPaxillineCapric acid1-MethylxanthineTerephthalate(S)-Isocorydine4-tert-ButylphenolAmpicillinPentobarbitalAmlodipineNeopterinThiazoleCyclohexane-1-carboxylateLamotrigineCefoperazone1-HexadecanolHistidinyl-SerineValaciclovirGlechomafuran9-cis-Retinoic acidMethylglutaric acidEstradiolAgnusideUreidopropionic acidLusitanicosidePerfluorooctanoic acidOleic acidSecobarbitalAflatoxin G2BoldioneAflatoxin G1Epsilon-(gamma-Glutamyl)-lysineD-Glyceric acid12,13-DHOME2,4,12-Octadecatrienoic acid isobutylamideMiglitolUridine diphosphate-N-acetylglucosamineLamivudineGlycitein4-CoumarateFexofenadineSulfisoxazolePentazocine4-HydroxybenzeneacetonitrileHomovanillate3-(2-Hydroxyphenyl)propanoic acidTriclosanImidaclopridCiprofloxacinAcifluorfenPantothenic acid4-Pyridoxic acid1H-Indole-3-carboxaldehydeYohimbineD-Glucurono-6,3-lactoneGuanosineSinapyl alcoholAscorbatebeta-D-GlucosamineDoxorubicinMyricetinADPD-Glucosamine 6-phosphateShikimic acidCryptochlorogenic acidMalabaricano1,3,7-Trimethyluric acid3-Oxocholic acidMetaproterenolSaccharinalpha-Mangostin3-Methylxanthine3-hydroxytetradecanoic acidSulfadoxineGlyceric acidFlurbiprofenPyridoxamine 5'-phosphateLoteprednolCrustecdysonePhthalic acidDeoxyribose 5-phosphateCyclic AMP5-MethoxytryptamineMupirocinProstaglandin D3cis-Aconitate4-Bromophenol2-Phosphoglyceric acidIsorhamnetinSulfamethazineOxalacetic acidRaloxifene1,3-BenzenediolBendroflumethiazideEnterodiolCefalotinSulfaquinoxaline3-MethyladenineD-GlucoseJugloneDantroleneGentisate aldehydeGlucobrassicinIsoeugenol6''-O-p-Coumaroyltrifolin3-Hydroxymethylglutaric acidTridecanoic acidThiopental6-Keto-prostaglandin F1aCyanidin 3-glucosideSulfasalazine13-OxoODEProbenecidMethazolamideEstrone sulfateDesmethylxanthohumol2,3,6-TrimethylphenolProstaglandin B1PA(16_0_16_0)Indolepyruvate3-O-AcetylepisamarcandinMacrocarpal BGuanidoacetic acidIsoquercitrinRutarinAcitretinL-TyrosineMatairesinolL-DopaAflatoxin B2DigalacturonateD-Erythrose 4-phosphate1,5-Anhydro-D-glucitolGlucoiberin20-Carboxy-leukotriene B4Melatonin5a-TetrahydrocortisolDaidzinSucrose3-Hydroxycapric acidAcoric acidD-Ribulose 5-phosphateCinolazepamMethylsuccinic acidClomipramineHydantoin-5-propionic acidDocosahexaenoic acidAlpha-dihydroartemisinin3-Hydroxyanthranilate(-)-Jasmonic acidPhloretinSpermidineMetosulamMinocyclineGlucoraphanin(R)-MevalonateCMPTerephthalic acidRibitolL-IditolLuteolin 7-galactosideNitrofurazoneDehydroepiandrosterone sulfateBuprenorphineL-CystathionineAcetaminophenAmoxicillinPerindoprilLupuloneIndolebutyric acidDocosapentaenoic acid (22n-3)4-AcetylbutyrateTrehaloseCefradineSuberic acidAvicularinGalactonic acidCeftriaxone3-MethoxyanthranilateUridine diphosphategalactose2-ArachidonylglycerolGancaonin ADichlorphenamidem-CresolD-Fructose 1-phosphatePrednisolone2',5'-DihydroxychalconeCreatinineConiferinCiticolinedGMPXanthosine5-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]benzene-1,3-diol(R)-(E)-Sulforaphenen-Propyl gallateCitric acidNafcillin(-)-Epicatechin 3-O-gallate7-MethylguanineSulfamethizoleCefazolin5-Aminopentanoic acidCarboxy-ibuprofen12-KETEAesculinGlycyl-leucineDihydrobiopterinCefotaxime4-AminosalicylateIsochlorogenic acid bLevonorgestreltrans-3-HydroxycinnamateTheobromineLirioresinol Aalpha-D-Ribose 1-phosphateQuercetin 3-glucosyl-(1->2)-galactosyl-(1->2)-glucosideMilrinonePravastatinFenoldopamUTPCromoglicic acidBetaine(2R)-2-Hydroxy-3-(phosphonatooxy)propanoateHydroflumethiazideStearic acidSakuranetinBICINEIndapamideFluconazoleAtovaquone6-Hydroxynicotinic acidChloramphenicolBenzyl cinnamateZaleplonPipernonalineSulfanilamideLigustrosideN-Acetyl-L-aspartic acidAcetaminophen glucuronideCandoxatrilAtorvastatinMesobilirubinogenPirenzepine2-benzylbutanedioic acid9,10-Epoxyoctadecenoic acidPractololBeta-CarbolineCanavanine3-(4-Hydroxyphenyl)-1-(4-hydroxy-2-methoxyphenyl)-2-propen-1-oneGenisteinLimocitrinDimethylbenzimidazole(9Z,12Z,15Z)-Octadecatrienoic acidVardenafilCaffeate3-(3,4-Dihydroxy-5-methoxy)-2-propenoic acidTiagabine1-(2,6-Dihydroxy-4-methoxyphenyl)-3-phenyl-1-propanoneThyrotropin releasing hormone(+)-Sesamin19(S)-HETELS-Tetrasaccharide b2-linoleoyl-sn-glycero-3-phosphocholinePhenylethyl primeveroside7,8-DihydroneopterinEPA (d5)Traumatic AcidProstaglandin J2Indolelactate4-Hydroxybenzyl alcoholN-Acetylasparagine1-Methyluric acidQuinatePrulaurasin3,5-Diiodo-L-tyrosineMaltolProgesteroneCytokinin BFlecainideBenzylamineCTPIsonicotinic acidTaurineD-Fructose3-(4-Hydroxyphenyl)pyruvate1-Naphthol1-Naphthaleneacetic acidZalcitabineHydrocinnamic acidArachidic acidLeukotriene F4DapsoneProbucolFormylanthranilic acidOchratoxin AFluticasone propionateO-PhosphotyrosineFructose 1,6-bisphosphateL-Homoserine9(S)-HPODE1,11-Undecanedicarboxylic acidEnalaprilL-ThreonineNelfinavir6-ThiourateEprosartan5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4H-chromen-4-one3-Hydroxyvalproic acid4-Aminophenol(-)-Guttiferone EMyristoleic acidPyridoxalIsoliquiritigenin(4-Hydroxybenzoyl)cholineThiamine monophosphatePodofilox1-Aminocyclohexanecarboxylic acidAcetohexamide8-HydroxyguanosineFenitrothionalpha-Ketoisovaleric acidGanoderic acid GIndan-1-ol3-Hydroxy-carbofuran1-palmitoylglycerophosphocholineGlutamylglutamic acidPentostatinGlabroneFucose 1-phosphateSalicinRosmarinic acid1-MethylguanosinedTMP2,4-Dichlorophenoxyacetic acid4-HydroxyprolineCryptotanshinoneCelastrolEthyl glucuronideNevskinD-MannoseAlternariolcis,cis-Muconate3-MethoxytyramineAustalide HdTDP-D-glucoseSpironolactoneDemethylated antipyrineL-NorleucineAzlocillinL-TryptophanAdouetine XPentadecanoic acidAmygdalinPenicillin VGlutamylthreonineKaempferolDihydrolipoatePhenylacetylglycinePenciclovirdCMPProlylhydroxyprolineNifedipineL-ArabinoseEpiandrosterone2-MethoxyestradiolPQQFlutamideBenzyl isothiocyanateDimethylallylpyrophosphateL-ValineATPMelaninRhein(3'alpha,5'alpha,9'xi,10'beta)-O-(3-Hydroxy-7-drimen-11-yl)umbelliferoneQuinaprilN-Acetylserotonin4-AcetamidobutanoateNilutamideMorphineDiflunisalMinoxidilN2-gamma-Glutamylglutamine16-Hydroxy hexadecanoic acidCaprylic acidFluvastatin2,4-DichlorophenolAzacitidineD-2-Hydroxyglutaric acidNordiazepamAcicloviralpha-IsopropylmalateCholesterol sulfateFerulateDihydrojasmonic acidEmtricitabineSteviobiosideL-CystineGallic acidN2,N2-DimethylguanosineErgocalciferolGuanidinosuccinic acid3-MethylsalicylateCoumarinQuinineGibberellin A53ArformoterolL-Malic acidDeferasiroxCyanuric acidDehydroepiandrosteroneCarglumic acidMyristic acidCarvedilolBrassinolide(3S,5R,6R,7E)-3,5,6-Trihydroxy-7-megastigmen-9-oneAdipic acid1-Deoxy-D-xylulose 5-phosphateGluconolactonePhenacemide3-Methylthiopropionic acidHippuric acidEnterolactoneN-Acetylaspartylglutamate3-Aminosalicylic acidAlpha-LactosePhenylethylamine5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1<U+00CE><U+00BB><U+00E2><U+0081><U+00B4>-chromen-1-yliumBovinocidinIndole-3-acetateCytarabineHomocarnosineL-GuloseHeptenophos2-Methyl-3-hydroxybutyric acidCatechin(E)-3-(4-Hydroxyphenyl)-2-propenalMalonobenFADOxoadipic acidCortisoneCitraconic acidPurineNorepinephrineDidanosine3-MethylguanineBeta-LeucineCorchorifatty acid FBeta-Guanidinopropionic acidDiflubenzuronHetacillinN-Acetyl-L-phenylalaninePhenylacetic acid5-Aminoimidazole-4-carboxamideCaproic acidOuabainCloxacillinPalmitic acidProtocatechuic acidUDP-D-XyloseRaltitrexedN-Acetylmethionine2-(Methylamino)benzoic acidAdenosine 3',5'-diphosphateVoriconazoleEthylmalonic acidAlanyl-TyrosineTrichloroacetic acidTyramineMeloxicam20-HETE2-Amino-3-phosphonopropionic acidD-Glycero-D-galacto-heptitolD-Mannose 6-phosphateAcetylisoniazid1,8-ANS<U+00EF><U+00BB><U+00BF>BosutinibGeniposidic acidPhenylbutazoneLanosterin(9Z)-Hexadecenoic acid12-Hydroxydodecanoic acidGamma-Linolenic acidp-Hydroxyphenylacetic acidCucurbitacin DCortisone acetateAdenosine diphosphate ribosegamma-GlutamylcysteineCucurbitacin BVanylglycolSebacic acidPrazosin5,6-DHETL-MethioninePteroyl-D-glutamic acidDihydrouracil3-Methoxyphenylacetic acidQuercetin3-Hexenedioic acidResolvin D1FormononetinN-Glycolylneuraminic acidDihydroroseosideTryptophanamideMaslinic acidEthynodiol Diacetate(R)-KawainBovinic acid3-Methylglutaric acidNalidixic AcidOrotidylic acidEthionamideGambogic acidClavulanate(R)-3-Hydroxybutyric acidOxytetracyclinePicolinic acidNizatidinemyo-InositolAstragalinApiinMannitolPyroglutamic acidCoenzyme ALuteolinTeniposideNorspermidineHydroxyphenyllactic acidIsomucronulatolGlaucarubinSalicylic acid5,7-DihydroxyflavoneLevulinic acidDodecanedioic acidTryptophantrans-AconitateAndrosteroneXanthine1H-Indole-2,3-dioneDattelic acid(-)-Epigallocatechin3,4-Dihydro-2H-1-benzopyran-2-onebeta-N-AcetylglucosamineMefenamic acidNobiletin16alpha-Hydroxyestrone1-phosphatidyl-1D-myo-inositol-3,4-bisphosphateN-Acetyl-L-alanineMecarbamSildenafilLafutidineBlasticidin SBromocriptineNicotinic acidN-AcetylmuramateGeranylgeranyl-PPThymidineChlorothiazideL-Isoleucine3-Hydroxysebacic acidIsocaproic acidOrotic acid1,7-Diphenyl-4-hepten-3-oneGlucotropaeolin2-hydroxyflutamideSulfinpyrazoneQuercetin 3-arabinosideGluconic acido-TyrosineGlabreneMenadioneIndoxyl sulfateGalactaric acidAlpha-D-GlucoseCefoxitinIMPPhenobarbital(-)-ArctigeninFluphenazine9-HydroxyphenanthreneIsocitrateN-trans-FeruloyloctopamineO-PhosphothreonineL-Aspartic acidArtocarpinGlabraninGalacturonic acidNonadecanoic acidProtoporphyrin IXRifapentine(<U+00C2><U+00B1>)-FenarimolN-Methyl-D-aspartic acidTorasemidebeta-D-FructoseN-Alpha-acetyllysineLoxapineIsovalerylglycineNitrazepamGemcitabineFenamiphosOxycodone3,4-Dihydroxyphenylpropanoate17a-Ethynylestradiol5-HETELeucineL-3-Phenyllactic acidHomogentisate5-Methyl-2'-deoxycytidineRaffinoseCitramalic acidTrehalose 6-phosphate4-Hydroxy-3-(3-methyl-2-butenyl)acetophenoneMacelignanCephalexinPerillic acidBaicalinProstaglandin F2aD-Ornithine16(R)-HETEBromazepamPantoprazoleFeruloylcholineMalvidin 3-glucosideDethiobiotin2',4'-DihydroxyacetophenoneSedoheptulose 7-phosphateTopotecanTolterodine2',4',6'-Trihydroxydihydrochalcone 2'-glucosideClozapineDi-2-propenyl sulfidePyridoxal phosphateHydroxytyrosolIrinotecanIndole-3-carboxylic acidThreonatePsoralenAlbendazole[6]-Gingerdiol 3,5-diacetateSulfathiazoleSinapateDaidzeinDinosebBenzoinfalseCaffeine Enhances Antitumor T-cell Activity via COL12A1/IDO1/Kyn axis and Sensitivity to Anti-PD-1 Immunotherapy in Colorectal CancerMetabolomic sequencing on supernatants from caffeine-treated and untreated tumor cells to identify which metabolites are involved in activating CD8+ T 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