<HashMap><database>MetaboLights</database><file_versions><headers><Content-Type>application/xml</Content-Type></headers><body><files><Tabular>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/m_MTBLS14953_LC-MS_positive_reverse-phase_v2_maf.tsv</Tabular><Tabular>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/m_MTBLS14953_LC-MS_negative_reverse-phase_v2_maf.tsv</Tabular><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/a_MTBLS14953_LC-MS_negative_reverse-phase.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/i_Investigation.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/s_MTBLS14953.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/a_MTBLS14953_LC-MS_positive_reverse-phase.txt</Txt><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/QC3.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/QC5.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/DCM3.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/Control1.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/DCM4.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/Control3.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/Control5.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/DCM3.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/QC2.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/Control2.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/Control6.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/DCM2.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/DCM2.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/QC4.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/QC1.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/Control4.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/QC3.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/QC5.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/DCM1.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/QC1.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/DCM6.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/DCM5.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/Control5.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/Control3.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/DCM1.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/DCM6.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/QC2.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/Control6.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/QC4.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/DCM4.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/DCM5.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/Control1.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/NEG/Control2.raw</Raw><Raw>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953/FILES/RAW_FILES/POS/Control4.raw</Raw></files><type>primary</type></body><statusCode>OK</statusCode><statusCodeValue>200</statusCodeValue></file_versions><scores/><additional><ftp_download_link>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14953</ftp_download_link><metabolite_identification_protocol>&lt;p>Metabolite annotation was performed by matching the accurate mass-to-charge ratio values of detected ion features against online databases, including KEGG and HMDB. A metabolite was annotated when the mass difference between the observed value and the database value was less than 10 ppm. Molecular formulas were further evaluated and validated using isotopic distribution information. An in-house fragment spectrum library was also used to validate metabolite identification.&lt;/p>&lt;p>&lt;br>&lt;/p>&lt;p>For MS1-level annotation, adducts considered in positive ion mode included [2M+H]+, [M+H]+, [M+K]+, [M+Na]+, and [M+NH4]+. Adducts considered in negative ion mode included [M-H]−, [M+Cl]−, [2M-H]−, [M+CHO2]−, and [M+C2H3O2]−. The MS1 mass tolerance was 10 ppm. For MS2 identification, the MS1 and MS2 mass tolerances were both set to 20 ppm, and the identification score cutoff was 70%. Databases used for MS2 identification included an in-house database and commonly used open-source databases.&lt;/p></metabolite_identification_protocol><repository>MetaboLights</repository><study_status>Public</study_status><ptm_modification></ptm_modification><instrument_platform>Liquid Chromatography MS - negative - reverse-phase</instrument_platform><instrument_platform>Liquid Chromatography MS - positive - reverse-phase</instrument_platform><chromatography_protocol>&lt;p>Chromatographic separation was performed using a Thermo Vanquish Flex UPLC system. An ACQUITY UPLC HSS T3 column (100 mm × 2.1 mm, 1.8 μm, Waters) was used for separation. The mobile phase consisted of solvent A, 5 mmol/L ammonium acetate and 5 mmol/L acetic acid in water, and solvent B, acetonitrile.&lt;/p>&lt;p>&lt;br>&lt;/p>&lt;p>The gradient elution program was as follows: 0–0.8 min, 2%–70% B; 0.8–2.8 min, 70%–90% B; 2.8–5.3 min, 90%–99% B; 5.3–5.9 min, 99% B; 5.9–7.5 min, 99%–2% B; 7.5–7.6 min, 2% B; and 7.6–10.0 min, 2% B. The flow rate was 0.35 mL/min. The injection volume was 4 μL. The column temperature was maintained at 40°C.&lt;/p></chromatography_protocol><publication>Gut Microbiota-Derived Indole-3-Propionic Acid Ameliorates Diabetic Cardiomyopathy by Regulating Mitochondrial Dynamics via the AhR/Nrf2 Pathway.</publication><submitter_name>JD Zhou</submitter_name><submitter_affiliation>ningbo university</submitter_affiliation><organism_part>blood serum</organism_part><technology_type>mass spectrometry assay</technology_type><disease></disease><extraction_protocol>&lt;p>Serum samples were thawed at 4°C. A total of 100 μL of serum sample was mixed with 400 μL of ice-cold methanol. The mixture was incubated at −20°C for 30 min to precipitate proteins and then centrifuged at 20,000 g for 10 min at 4°C. The supernatant was transferred to a fresh vial for UPLC-HRMS analysis.&lt;/p>&lt;p>&lt;br>&lt;/p>&lt;p>Quality control samples were prepared by mixing equal aliquots of the supernatants from all serum samples. These pooled QC samples were used to monitor the stability and reproducibility of the LC-MS analysis.&lt;/p></extraction_protocol><organism>Mus musculus</organism><full_dataset_link>https://www.ebi.ac.uk/metabolights/MTBLS14953</full_dataset_link><author>Jiedong Zhou. Ningbo University. 2401140180@nbu.edu.cn.</author><data_transformation_protocol>&lt;p>Raw LC-MS data files were converted into mzXML format and processed using XCMS, CAMERA, and metaX implemented in R. The data preprocessing steps included peak picking, peak grouping, retention time correction, secondary peak grouping, isotope annotation, and adduct annotation. Each ion feature was characterized using retention time and m/z information. Peak intensities were recorded to generate a three-dimensional data matrix containing peak indices, sample names, and ion intensity values.&lt;/p>&lt;p>&lt;br>&lt;/p>&lt;p>The metabolomics data were further processed using R. Features with more than 80% missing values in samples or more than 50% missing values in quality control samples were filtered out. Missing values were imputed using the K-nearest neighbor method, and data normalization was performed using probabilistic quotient normalization. Principal component analysis and differential metabolite analysis were performed using metaX. Partial least squares discriminant analysis was performed using ropls, and variable importance in projection values were calculated.&lt;/p></data_transformation_protocol><study_factor>Addition amount of magnesium potassium sulfate</study_factor><submitter_email>2401140180@nbu.edu.cn</submitter_email><sample_collection_protocol>&lt;p>Mouse serum samples were collected at the end of the intervention. Mice in the control group were fed a standard chow diet without additional treatment. To establish the diabetic cardiomyopathy model, mice were fed a high-fat diet for 4 weeks and then intraperitoneally injected with streptozotocin (STZ; Sigma-Aldrich, 50 mg/kg) for 5 consecutive days. One week after the final STZ injection, mice with blood glucose levels greater than 16.7 mmol/L were considered to have successfully developed a diabetic model. Thereafter, mice in the diabetic cardiomyopathy group continued to receive the high-fat diet and were administered PBS by oral gavage as vehicle treatment until week 16 of the experiment.&lt;/p>&lt;p>&lt;br>&lt;/p>&lt;p>After the intervention, mice were anesthetized and terminal blood collection was performed. Whole blood samples were allowed to stand and then centrifuged at 1,500 g for 10 min at 4°C to separate serum. The serum supernatant was carefully collected to avoid hemolysis, aliquoted into sterile EP tubes, and repeated freeze-thaw cycles were avoided. All serum samples were immediately frozen and stored at −80°C, and then transported to the mass spectrometry company on dry ice.&lt;/p></sample_collection_protocol><omics_type>Metabolomics</omics_type><study_design>pooled quality control sample</study_design><study_design>Metabolomics</study_design><study_design>LC-MS</study_design><study_design>Mus musculus</study_design><study_design>untargeted analysis</study_design><study_design>blood serum</study_design><study_design>Diabetic cardiomyopathy</study_design><study_design>Serum</study_design><study_design>Q Exactive Plus, Thermo Fisher Scientific</study_design><study_design>Thermo Vanquish Flex UPLC system</study_design><study_design>experimental sample</study_design><curator_keywords>pooled quality control sample</curator_keywords><curator_keywords>Metabolomics</curator_keywords><curator_keywords>LC-MS</curator_keywords><curator_keywords>Mus musculus</curator_keywords><curator_keywords>untargeted analysis</curator_keywords><curator_keywords>blood serum</curator_keywords><curator_keywords>Diabetic cardiomyopathy</curator_keywords><curator_keywords>Serum</curator_keywords><curator_keywords>Q Exactive Plus, Thermo Fisher Scientific</curator_keywords><curator_keywords>Thermo Vanquish Flex UPLC system</curator_keywords><curator_keywords>experimental sample</curator_keywords><mass_spectrometry_protocol>&lt;p>Metabolites were detected using a high-resolution tandem mass spectrometer Q Exactive Plus (Thermo Fisher Scientific). Each serum sample was analyzed in both positive and negative electrospray ionization modes. The ESI source temperature was 350°C. The spray voltage was +3.8 kV in positive ion mode and −3.4 kV in negative ion mode. Sweep gas, auxiliary gas, and sheath gas were set to 0 Arb, 15 Arb, and 50 Arb, respectively.&lt;/p>&lt;p>&lt;br>&lt;/p>&lt;p>Mass spectrometric data were acquired using full scan and data-dependent acquisition modes. In one acquisition cycle, the full scan range was 70–1050 Da, with a resolution of 70,000, an AGC target of 3E6, and a maximum injection time of 100 ms. The top 5 ions with signal intensity greater than 100,000 were selected for MS/MS acquisition. The MS/MS resolution was 17,500, the maximum injection time was 50 ms, and the dynamic exclusion time was set to 6 s.&lt;/p></mass_spectrometry_protocol><metabolite_name>Tricyclohumuladiol</metabolite_name><metabolite_name>2-Hydroxydodecyl methacrylate</metabolite_name><metabolite_name>Sibopirdine</metabolite_name><metabolite_name>Chloroacetone</metabolite_name><metabolite_name>2,5-Di-tert-butylhydroquinone</metabolite_name><metabolite_name>Ribociclib</metabolite_name><metabolite_name>all-trans-5,6-Epoxyretinoic acid</metabolite_name><metabolite_name>Hydroquinone sulfate</metabolite_name><metabolite_name>Butyl 2-methylbutanoate</metabolite_name><metabolite_name>Diethyl decanedioate</metabolite_name><metabolite_name>Dacarbazine</metabolite_name><metabolite_name>N1,N12-Diacetylspermine</metabolite_name><metabolite_name>Octadeca-2,4-dienoic acid</metabolite_name><metabolite_name>(4-Amino-2-methylpyrimidin-5-YL)methyl dihydrogen phosphate</metabolite_name><metabolite_name>Heptanoic acid</metabolite_name><metabolite_name>Altretamine</metabolite_name><metabolite_name>(2R,3R,4R,5S,6S)-3,4,5,6-Tetrahydroxyoxane-2-carboxylic acid</metabolite_name><metabolite_name>Ketoleucine</metabolite_name><metabolite_name>N-Phenyl-1-naphthylamine</metabolite_name><metabolite_name>Hexanoylglycine</metabolite_name><metabolite_name>Cis-8,11,14,17-Eicosatetraenoic acid</metabolite_name><metabolite_name>12-HEPE</metabolite_name><metabolite_name>Musanolone C</metabolite_name><metabolite_name>Nipecotic acid</metabolite_name><metabolite_name>Glutarylglycine</metabolite_name><metabolite_name>N2-Methyl-L-arginine</metabolite_name><metabolite_name>Capric acid</metabolite_name><metabolite_name>isocaproylglycine</metabolite_name><metabolite_name>Hydroxypyruvic acid</metabolite_name><metabolite_name>Dimethindene</metabolite_name><metabolite_name>2-Ethyl-1-hexanol sulfate</metabolite_name><metabolite_name>Octadecanedioic acid</metabolite_name><metabolite_name>Syringic acid</metabolite_name><metabolite_name>1-Hydroxy-2-naphthoic acid</metabolite_name><metabolite_name>Methoxyacetaldehyde</metabolite_name><metabolite_name>L-Proline, 1-(2-methyl-3-(methylthio)-1-oxopropyl)-, (S)-</metabolite_name><metabolite_name>Eberconazole</metabolite_name><metabolite_name>N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea</metabolite_name><metabolite_name>7-Octadecynoic acid</metabolite_name><metabolite_name>Capryloylglycine</metabolite_name><metabolite_name>5-Hydroxyindoleacetic acid</metabolite_name><metabolite_name>N2-Acetylornithine</metabolite_name><metabolite_name>trans-Nicotine-1'-oxide</metabolite_name><metabolite_name>Desipramine</metabolite_name><metabolite_name>3-Hydroxypyridine sulfate</metabolite_name><metabolite_name>1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-5-ol</metabolite_name><metabolite_name>Metapramine</metabolite_name><metabolite_name>5-(3E-Pentenyl)tetrahydro-2-oxo-3-furancarboxylic acid</metabolite_name><metabolite_name>LysoPE(P-16:0/0:0)</metabolite_name><metabolite_name>(1R,3S,5Z)-5-[(2Z)-2-[(1R,3Ar,7aS)-1-[(2S)-1-[3-(2-hydroxypropan-2-yl)phenoxy]propan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol</metabolite_name><metabolite_name>9-Hpode</metabolite_name><metabolite_name>Ureidopropionic acid</metabolite_name><metabolite_name>Budipine</metabolite_name><metabolite_name>Tibric acid</metabolite_name><metabolite_name>cis-3-Hexenyl lactate</metabolite_name><metabolite_name>(1S,2S,4S,5R)-1,8-Epoxy-p-menthane-2,5-diol</metabolite_name><metabolite_name>Palmitelaidic acid</metabolite_name><metabolite_name>Glutaric acid</metabolite_name><metabolite_name>m-chlorophenylpiperazine (m-CPP)</metabolite_name><metabolite_name>Isoalantolactone</metabolite_name><metabolite_name>Trihomomethionine</metabolite_name><metabolite_name>12,13-DHOME</metabolite_name><metabolite_name>exo,exo-1,8-Epoxy-p-menthane-2,6-diol</metabolite_name><metabolite_name>Metaldehyde</metabolite_name><metabolite_name>Dimethyl tetrasulfide</metabolite_name><metabolite_name>Pseudouridine</metabolite_name><metabolite_name>4-(1,1,3,3-Tetramethylbutyl)-phenol</metabolite_name><metabolite_name>N,N'-Dibenzylethylenediamine</metabolite_name><metabolite_name>Triclosan</metabolite_name><metabolite_name>Dimetacrine</metabolite_name><metabolite_name>(±)-3-Hydroxynonanoic acid</metabolite_name><metabolite_name>4-Pyridoxic acid</metabolite_name><metabolite_name>[3-[(2R,6S)-2,6-Dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide</metabolite_name><metabolite_name>3alpha,12beta-Dihydroxy-5alpha-cholan-24-oic Acid</metabolite_name><metabolite_name>D-Glucurono-6,3-lactone</metabolite_name><metabolite_name>3,3'-Dimethoxybenzidine</metabolite_name><metabolite_name>(15alpha,20R)-15,20-Dihydroxypregn-4-en-3-one</metabolite_name><metabolite_name>Dodecyl benzenesulfonate</metabolite_name><metabolite_name>Glyceraldehyde</metabolite_name><metabolite_name>Pumiliotoxin A</metabolite_name><metabolite_name>Pristanic acid</metabolite_name><metabolite_name>Diphenyl sulfone</metabolite_name><metabolite_name>(+)-Setoclavine</metabolite_name><metabolite_name>Allyl chloride</metabolite_name><metabolite_name>Erucic acid</metabolite_name><metabolite_name>Glyceraldehyde 3-phosphate</metabolite_name><metabolite_name>1-Palmitoylphosphatidylcholine</metabolite_name><metabolite_name>1-Hydroxyanthraquinone</metabolite_name><metabolite_name>Macaridine</metabolite_name><metabolite_name>3-Oxocholic acid</metabolite_name><metabolite_name>4-methoxy-3-(sulfooxy)benzoic acid</metabolite_name><metabolite_name>LysoPC(14:1(9Z)/0:0)</metabolite_name><metabolite_name>1-Isopropyl-6-methylergoline-8-carboxylic acid</metabolite_name><metabolite_name>Ketotifen</metabolite_name><metabolite_name>Acetylglycine</metabolite_name><metabolite_name>Thermophillin</metabolite_name><metabolite_name>(1R,4R,5S,9R,10S,13R)-5,9-Dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid</metabolite_name><metabolite_name>(1S,4S,9R,10S,13R,14R)-5,5,9,14-Tetramethyltetracyclo[11.2.1.01,10.04,9]hexadec-6-ene</metabolite_name><metabolite_name>2,3,4-Trichlorophenol</metabolite_name><metabolite_name>1-Chlorobutane</metabolite_name><metabolite_name>cis-2,3-Dimethylthiirane</metabolite_name><metabolite_name>Indole-3-acetylglycine</metabolite_name><metabolite_name>N-methylhydroxyproline</metabolite_name><metabolite_name>tetrahydropyridoindole</metabolite_name><metabolite_name>Lactaldehyde</metabolite_name><metabolite_name>Hexadecanedioic acid</metabolite_name><metabolite_name>Phthalic acid</metabolite_name><metabolite_name>(8betaOH,10beta)-8-Hydroxy-3-oxo-7(11)-eremophilen-12,8-olide</metabolite_name><metabolite_name>1,4-Dioctyl sulfosuccinic acid</metabolite_name><metabolite_name>Bisbynin</metabolite_name><metabolite_name>Glycylglycylglycine</metabolite_name><metabolite_name>Vulgarole</metabolite_name><metabolite_name>PI(18:1(9Z)/20:4(5Z,8Z,11Z,14Z))</metabolite_name><metabolite_name>2,4-Di-tert-butylphenol</metabolite_name><metabolite_name>Aprindine</metabolite_name><metabolite_name>4-Hydroxyquinoline</metabolite_name><metabolite_name>Sulfamethazine</metabolite_name><metabolite_name>Decadienyl-l-carnitine</metabolite_name><metabolite_name>17-HDoHE</metabolite_name><metabolite_name>N-Butyrylglycine</metabolite_name><metabolite_name>Uridine</metabolite_name><metabolite_name>Chenodeoxycholic acid</metabolite_name><metabolite_name>1,3-Dioxolane</metabolite_name><metabolite_name>Isocurcumenol</metabolite_name><metabolite_name>3-hydroxydecanoyl carnitine</metabolite_name><metabolite_name>5-(4-Chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole</metabolite_name><metabolite_name>Sterculic acid</metabolite_name><metabolite_name>Asp-Gly-Lys</metabolite_name><metabolite_name>(R)-5-Hydroxy-2-(4-hydroxyphenyl)-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)chroman-4-one</metabolite_name><metabolite_name>Proline</metabolite_name><metabolite_name>N-(1,3-Dimethylbutyl)-N'-phenyl-p-phenylenediamine</metabolite_name><metabolite_name>Tris(2-ethylhexyl) phosphate</metabolite_name><metabolite_name>alpha-Peroxyachifolide</metabolite_name><metabolite_name>3-Hydroxymethylglutaric acid</metabolite_name><metabolite_name>Tridecanoic acid</metabolite_name><metabolite_name>Tigloidine</metabolite_name><metabolite_name>Marimastat</metabolite_name><metabolite_name>Octyl butanoate</metabolite_name><metabolite_name>Thiopental</metabolite_name><metabolite_name>2,4-Dihydroxyacetophenone 5-sulfate</metabolite_name><metabolite_name>Decanal</metabolite_name><metabolite_name>Butyl levulinate</metabolite_name><metabolite_name>Dihydroferulic acid</metabolite_name><metabolite_name>N-Dodecylsarcosinate</metabolite_name><metabolite_name>Dihydrodioscorine</metabolite_name><metabolite_name>5-(2-Chlorophenyl)-1,3-dihydro-1-methyl-7-nitro-2H-1,4-benzodiazepin-2-one</metabolite_name><metabolite_name>1,2-Dichloroethane</metabolite_name><metabolite_name>Nomifensine</metabolite_name><metabolite_name>2-Ethylhexyl acrylate</metabolite_name><metabolite_name>3,7-Dihydroxycholan-24-oic acid</metabolite_name><metabolite_name>N-Methyltryptamine</metabolite_name><metabolite_name>Phthalimide</metabolite_name><metabolite_name>Nitrendipine</metabolite_name><metabolite_name>Dihydroresveratrol</metabolite_name><metabolite_name>N-Acetyl-L-glutamic acid</metabolite_name><metabolite_name>Ethylene carbonate</metabolite_name><metabolite_name>(8R,9R,10R,13S,14S)-10,13-Dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene-3,17-diol</metabolite_name><metabolite_name>Aniracetam</metabolite_name><metabolite_name>Uric acid</metabolite_name><metabolite_name>DL-Norvaline</metabolite_name><metabolite_name>Guanidoacetic acid</metabolite_name><metabolite_name>Linoleic acid</metabolite_name><metabolite_name>15,16-DiHODE</metabolite_name><metabolite_name>Peracetic acid</metabolite_name><metabolite_name>5-ethyl-5-methyl-2,4-oxazolidinedione</metabolite_name><metabolite_name>4-O-Methylgallic acid</metabolite_name><metabolite_name>Thyronamine</metabolite_name><metabolite_name>Valyltyrosine</metabolite_name><metabolite_name>3-Hydroxybutyric acid</metabolite_name><metabolite_name>PC(16:0/20:4(5Z,8Z,11Z,14Z))</metabolite_name><metabolite_name>(4-((5,6-Diphenylpyrazin-2-yl)(isopropyl)amino)butoxy)acetic acid</metabolite_name><metabolite_name>Benzoic acid</metabolite_name><metabolite_name>Ascorbic acid</metabolite_name><metabolite_name>3-Hydroxycapric acid</metabolite_name><metabolite_name>(R)-Dihydromaleimide</metabolite_name><metabolite_name>5Z-Dodecenoic acid</metabolite_name><metabolite_name>Acoric acid</metabolite_name><metabolite_name>1,1,1-Trifluoroheptadecan-2-one</metabolite_name><metabolite_name>(4R,5S,7R,11R)-11,12-Dihydroxy-1(10)-spirovetiven-2-one</metabolite_name><metabolite_name>Traumatic acid</metabolite_name><metabolite_name>2-Methacryloyloxyethyl phosphorylcholine</metabolite_name><metabolite_name>Tetradecanedioic acid</metabolite_name><metabolite_name>Docosahexaenoic acid</metabolite_name><metabolite_name>N-Methylphthalimide</metabolite_name><metabolite_name>Momelotinib</metabolite_name><metabolite_name>Norizalpinin</metabolite_name><metabolite_name>Erythritol</metabolite_name><metabolite_name>2-Butenoylglycine</metabolite_name><metabolite_name>Triclofos</metabolite_name><metabolite_name>2,3-dihydroxyisovaleric acid</metabolite_name><metabolite_name>Ecabet</metabolite_name><metabolite_name>PG(18:3(9Z,12Z,15Z)/18:1(9Z))</metabolite_name><metabolite_name>Tri-P-cresyl phosphate</metabolite_name><metabolite_name>Taurocholic acid</metabolite_name><metabolite_name>Emeriamine</metabolite_name><metabolite_name>Dropropizine</metabolite_name><metabolite_name>2-Isopropylmalic acid</metabolite_name><metabolite_name>Terephthalic acid</metabolite_name><metabolite_name>13-HODE</metabolite_name><metabolite_name>Isodeoxycholic acid</metabolite_name><metabolite_name>Phenazopyridine</metabolite_name><metabolite_name>Trimetazidine</metabolite_name><metabolite_name>cis-3-Hexenyl tiglate</metabolite_name><metabolite_name>3-Hydroxypropanal</metabolite_name><metabolite_name>2-Methyl-5-vinylpyrazine</metabolite_name><metabolite_name>N,N,O-Tridesmethyltramadol</metabolite_name><metabolite_name>Hydroxyoctanoic acid</metabolite_name><metabolite_name>2-(Diethylamino)ethyl methacrylate</metabolite_name><metabolite_name>(1R,2R,3S,1'R)-Nepetalinic acid</metabolite_name><metabolite_name>Trehalose</metabolite_name><metabolite_name>Cyclocalopin F</metabolite_name><metabolite_name>Pheniramine</metabolite_name><metabolite_name>Cyclocalopin E</metabolite_name><metabolite_name>Epoxycampholenic aldehyde</metabolite_name><metabolite_name>Suberic acid</metabolite_name><metabolite_name>Natsudaidain</metabolite_name><metabolite_name>Astemizole</metabolite_name><metabolite_name>Aminomalonic acid</metabolite_name><metabolite_name>4-Nitrophenol</metabolite_name><metabolite_name>Hydroxyacetone</metabolite_name><metabolite_name>2,6-Dihydroxybenzoic acid</metabolite_name><metabolite_name>Mianserin</metabolite_name><metabolite_name>urapidil</metabolite_name><metabolite_name>2-Chlorobenzoic acid</metabolite_name><metabolite_name>D-Galactose</metabolite_name><metabolite_name>Tetrahydrozoline</metabolite_name><metabolite_name>Kessyl glycol</metabolite_name><metabolite_name>Phenyl phosphonothioate</metabolite_name><metabolite_name>Isoleucyl-Asparagine</metabolite_name><metabolite_name>(1R,2R,4R)-1,8-Epoxy-p-menthane-2,4-diol</metabolite_name><metabolite_name>DL-Norleucine</metabolite_name><metabolite_name>Uridine 5'-monophosphate</metabolite_name><metabolite_name>Diacetyl</metabolite_name><metabolite_name>Citric acid</metabolite_name><metabolite_name>Polyethylene, oxidized</metabolite_name><metabolite_name>5-Aminopentanoic acid</metabolite_name><metabolite_name>Thiosulfate</metabolite_name><metabolite_name>12-KETE</metabolite_name><metabolite_name>Icos-2-enoic acid</metabolite_name><metabolite_name>2-Benzyl-4-chlorophenol</metabolite_name><metabolite_name>Methacrylic Acid</metabolite_name><metabolite_name>Tetracosapentaenoic acid (24:5n-6)</metabolite_name><metabolite_name>5,6-Methylenedioxy-2-aminoindane</metabolite_name><metabolite_name>Daidzein 4'-sulfate</metabolite_name><metabolite_name>Hydroxyisocaproic acid</metabolite_name><metabolite_name>Octylphenol</metabolite_name><metabolite_name>7,8-Dihydro-3-methylpyrrolo[1,2-a]pyrimidin-2(6H)-one</metabolite_name><metabolite_name>Levonorgestrel</metabolite_name><metabolite_name>N-(6-Chloro-9h-pyrido[3,4-b]indol-8-yl)-3-pyridinecarboxamide</metabolite_name><metabolite_name>Glycocholic acid</metabolite_name><metabolite_name>Itaconic acid</metabolite_name><metabolite_name>4-Octylphenol</metabolite_name><metabolite_name>2,3-Bis(3-hydroxybenzyl)butane-1,4-diol</metabolite_name><metabolite_name>4-Chloro-3,5-dimethoxybenzyl alcohol</metabolite_name><metabolite_name>Glucose 6-phosphate</metabolite_name><metabolite_name>Tetraglyme</metabolite_name><metabolite_name>Myristicin</metabolite_name><metabolite_name>Phosphatidylinositol(36:4)</metabolite_name><metabolite_name>2,6-Dimethoxy-1,4-benzoquinone</metabolite_name><metabolite_name>Heneicosapentaenoic acid</metabolite_name><metabolite_name>Stearic acid</metabolite_name><metabolite_name>1-Octen-3-yl primeveroside</metabolite_name><metabolite_name>Jasmonic acid</metabolite_name><metabolite_name>p-Fluorofentanyl</metabolite_name><metabolite_name>Dibutyl adipate</metabolite_name><metabolite_name>1H-Imidazole-1-acetic acid</metabolite_name><metabolite_name>Cinnamoylglycine</metabolite_name><metabolite_name>(2S)-6-Oxa-1-azabicyclo[3.1.0]hexane-2-carboxylic acid</metabolite_name><metabolite_name>1,1-Dichloroethane</metabolite_name><metabolite_name>1-Chlorodibenzo-p-dioxin</metabolite_name><metabolite_name>2-Hydroxy-3-methylpentanoic acid</metabolite_name><metabolite_name>10-(Phosphonooxy)decyl methacrylate</metabolite_name><metabolite_name>Acetyl vitamin K5</metabolite_name><metabolite_name>Hydroquinone</metabolite_name><metabolite_name>Triphenylmethane</metabolite_name><metabolite_name>N-Methylserotonin</metabolite_name><metabolite_name>6-Amino-4-(4-phenoxyphenylethylamino)quinazoline</metabolite_name><metabolite_name>Octahydrohyperforin</metabolite_name><metabolite_name>Octoxynol-1</metabolite_name><metabolite_name>Guanidinopropionic acid</metabolite_name><metabolite_name>Heptyl cyclohexane carboxylic acid</metabolite_name><metabolite_name>9,10-Epoxyoctadecenoic acid</metabolite_name><metabolite_name>glycodeoxycholate sulfate</metabolite_name><metabolite_name>3-Hydroxyisovaleric acid</metabolite_name><metabolite_name>Dimethylbenzimidazole</metabolite_name><metabolite_name>3-[(2,2-Dichlorovinyl)thio]-L-alanine</metabolite_name><metabolite_name>Dodecanoic acid</metabolite_name><metabolite_name>Sulfamide</metabolite_name><metabolite_name>Trimecaine</metabolite_name><metabolite_name>Maleamic Acid</metabolite_name><metabolite_name>2,2'-Methylenebis(4-methyl-6-tert-butylphenol)</metabolite_name><metabolite_name>Allopurinol riboside</metabolite_name><metabolite_name>Dehydrochorismic acid</metabolite_name><metabolite_name>5-hydroxy saxagliptin</metabolite_name><metabolite_name>3',4'-Di-O-methylquercetin</metabolite_name><metabolite_name>4-Carboxypyrazole</metabolite_name><metabolite_name>Tetracosatetraenoic acid (24:4n-6)</metabolite_name><metabolite_name>N,N'-Diphenylmethylenediamine</metabolite_name><metabolite_name>(4E,7E,10Z,13E,16E,19E)-Docosa-4,7,10,13,16,19-hexaenoic acid</metabolite_name><metabolite_name>2,3,4,6-Tetrachlorophenol</metabolite_name><metabolite_name>(S)-Abscisic acid</metabolite_name><metabolite_name>Blumenol C glucoside</metabolite_name><metabolite_name>Pantoic acid</metabolite_name><metabolite_name>3a,6b,7b-Trihydroxy-5b-cholanoic acid</metabolite_name><metabolite_name>2,9-Dimethyl-2,9-diazatricyclo[10.2.2.25,8]octadeca-5,7,12,14,15,17-hexaene-3,10-diol, 9CI</metabolite_name><metabolite_name>2-Carboxy-5,7-dimethyl-4-octanolide</metabolite_name><metabolite_name>Pelargonic acid</metabolite_name><metabolite_name>15(16)-EpODE</metabolite_name><metabolite_name>2-Amino-3-methylimidazo[4,5-f]quinoline</metabolite_name><metabolite_name>Hyodeoxycholic acid</metabolite_name><metabolite_name>Fasudil</metabolite_name><metabolite_name>3-Hydroxy-2-octanone</metabolite_name><metabolite_name>Tetracosapentenoic acid</metabolite_name><metabolite_name>O,O,S-Trimethyl phosphorothioate</metabolite_name><metabolite_name>N-(2-Hydroxyethyl)-morpholine N-oxide</metabolite_name><metabolite_name>2-Anthraquinonesulfonic acid</metabolite_name><metabolite_name>Sulfate</metabolite_name><metabolite_name>Ketanserin</metabolite_name><metabolite_name>Taurine</metabolite_name><metabolite_name>16-HDoHE</metabolite_name><metabolite_name>Allantoin</metabolite_name><metabolite_name>Embelin</metabolite_name><metabolite_name>p-Cresol sulfate</metabolite_name><metabolite_name>Arachidic acid</metabolite_name><metabolite_name>Paullinic acid</metabolite_name><metabolite_name>3-carboxy-4-methyl-5-pentyl-2-furanpropanoic acid</metabolite_name><metabolite_name>3-Hydroxysuberic acid</metabolite_name><metabolite_name>Procainamide 4-hydroxylamine</metabolite_name><metabolite_name>1,11-Undecanedicarboxylic acid</metabolite_name><metabolite_name>Tetrahydroaldosterone</metabolite_name><metabolite_name>Phygrine</metabolite_name><metabolite_name>12(13)Ep-9-KODE</metabolite_name><metabolite_name>3,5-Dichloro-2-hydroxybenzenesulfonic acid</metabolite_name><metabolite_name>Ajmaline</metabolite_name><metabolite_name>Xylometazoline</metabolite_name><metabolite_name>(2S)-6-Hydroxy-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecanoyl]-3,4-dihydrochromene-5-carbaldehyde</metabolite_name><metabolite_name>PC(17:2(9Z,12Z)/0:0)</metabolite_name><metabolite_name>Trimethadione</metabolite_name><metabolite_name>Docosatrienoic acid</metabolite_name><metabolite_name>Tetradecylthioacetic acid</metabolite_name><metabolite_name>5alpha-Androstenone</metabolite_name><metabolite_name>3,4-Dihydroxyphenylglycol O-sulfate</metabolite_name><metabolite_name>alpha-Ketoisovaleric acid</metabolite_name><metabolite_name>3- Acetylphenol sulfate</metabolite_name><metabolite_name>Diethyl succinate</metabolite_name><metabolite_name>Alanylglycine</metabolite_name><metabolite_name>Ne,Ne dimethyllysine</metabolite_name><metabolite_name>Chloroprene</metabolite_name><metabolite_name>Estazolam</metabolite_name><metabolite_name>Gemfibrozil</metabolite_name><metabolite_name>Dicyclohexylcarbodiimide</metabolite_name><metabolite_name>Salicylanilide</metabolite_name><metabolite_name>7-Methylguanosine</metabolite_name><metabolite_name>Aldophosphamide</metabolite_name><metabolite_name>3-Hydroxydodecanoic acid</metabolite_name><metabolite_name>Butenylcarnitine</metabolite_name><metabolite_name>Undecanoic acid</metabolite_name><metabolite_name>LysoPA(18:2(9Z,12Z)/0:0)</metabolite_name><metabolite_name>Acetylhydrazine</metabolite_name><metabolite_name>1,4-Butanediphosphonic acid</metabolite_name><metabolite_name>Eletriptan</metabolite_name><metabolite_name>Methoxsalen</metabolite_name><metabolite_name>Pyruvic acid</metabolite_name><metabolite_name>Cuscohygrine</metabolite_name><metabolite_name>Vanillin 4-sulfate</metabolite_name><metabolite_name>Prilocaine</metabolite_name><metabolite_name>2-[(1r,3s)-3-Hydroxycyclohexyl]-5-(2-methyloctan-2-yl)phenol</metabolite_name><metabolite_name>Arlatin</metabolite_name><metabolite_name>4-Methylcatechol 1-sulfate</metabolite_name><metabolite_name>4-Vinylphenol sulfate</metabolite_name><metabolite_name>Eicosa-11,14,17-trienoic acid</metabolite_name><metabolite_name>3-Hydroxyvaleric acid</metabolite_name><metabolite_name>4-Amino-1,2,4-triazole</metabolite_name><metabolite_name>Feprazone</metabolite_name><metabolite_name>Quinaldic acid</metabolite_name><metabolite_name>Doxylamine</metabolite_name><metabolite_name>1,2 Dipalmitoylphosphatidylcholine</metabolite_name><metabolite_name>12-(3-(Adamantan-1-yl)ureido)dodecanoic acid</metabolite_name><metabolite_name>4-Ethylphenylsulfate</metabolite_name><metabolite_name>Phosphate</metabolite_name><metabolite_name>4-Methyl-2-pentyl-1,3-dioxolane</metabolite_name><metabolite_name>Glycolic acid</metabolite_name><metabolite_name>Solanolone</metabolite_name><metabolite_name>4-Thiocyanatophenol</metabolite_name><metabolite_name>PC(P-16:0/20:4(8Z,11Z,14Z,17Z))</metabolite_name><metabolite_name>3-Methylcrotonylglycine</metabolite_name><metabolite_name>Takinib</metabolite_name><metabolite_name>Proquazone</metabolite_name><metabolite_name>7-Methylhypoxanthine</metabolite_name><metabolite_name>Tert-butyl formate</metabolite_name><metabolite_name>Cyclizine</metabolite_name><metabolite_name>10Z-Nonadecenoic acid</metabolite_name><metabolite_name>Pentadecanoic acid</metabolite_name><metabolite_name>1-Methylhypoxanthine</metabolite_name><metabolite_name>Atipamezole</metabolite_name><metabolite_name>Diaminopimelic acid</metabolite_name><metabolite_name>Curcumol</metabolite_name><metabolite_name>2-[(2-Amino-2-oxoethyl)-[(2S)-2-[(2-amino-2-oxoethyl)-(carboxymethyl)amino]propyl]amino]acetic acid</metabolite_name><metabolite_name>Deoxyuridine</metabolite_name><metabolite_name>Piperonyl butoxide</metabolite_name><metabolite_name>Isoleucyl-Alanine</metabolite_name><metabolite_name>Pirlindole</metabolite_name><metabolite_name>N-3-Hydroxyoctanoyl-L-homoserine lactone</metabolite_name><metabolite_name>Clomifene</metabolite_name><metabolite_name>2-Amino-4-methylpyridine</metabolite_name><metabolite_name>3,3'-Dimethylbenzidine</metabolite_name><metabolite_name>6-(3,4-Methylenedioxyphenyl)-3,5-hexadien-2-one</metabolite_name><metabolite_name>Eicosadienoic acid</metabolite_name><metabolite_name>Naphazoline</metabolite_name><metabolite_name>Indole-3-propionic acid</metabolite_name><metabolite_name>Phenol sulphate</metabolite_name><metabolite_name>D-Lactaldehyde</metabolite_name><metabolite_name>2-Hydroxyhexadecanoic acid</metabolite_name><metabolite_name>Tazolol</metabolite_name><metabolite_name>2-Amino-4-[(2-hydroxy-1-oxopropyl)amino]butanoic acid</metabolite_name><metabolite_name>5-((6-((Aminomethyl)amino)-1-oxohexyl)amino)pentanoic acid</metabolite_name><metabolite_name>PC(36:6)</metabolite_name><metabolite_name>5,6-Dihydro-5-fluorouracil</metabolite_name><metabolite_name>1-[(2R,3S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione</metabolite_name><metabolite_name>Uracil</metabolite_name><metabolite_name>Eicosapentaenoic acid</metabolite_name><metabolite_name>Corynanthine</metabolite_name><metabolite_name>20-Hydroxy-6Z,15Z-eicosadienoic acid</metabolite_name><metabolite_name>3alpha,7alpha-Dihydroxycoprostanic acid</metabolite_name><metabolite_name>5-Hydroxy-3,3',7,8-tetramethoxy-4',5'-methylenedioxyflavone</metabolite_name><metabolite_name>Indolelactic acid</metabolite_name><metabolite_name>2-Methoxy-4-(4-methyl-1,3-dioxolan-2-yl)phenol</metabolite_name><metabolite_name>4-Nitrobenzoic acid</metabolite_name><metabolite_name>Xanthotoxol</metabolite_name><metabolite_name>Triethylene glycol monobutyl ether</metabolite_name><metabolite_name>Caprylic acid</metabolite_name><metabolite_name>sphingosylphosphorylcholine</metabolite_name><metabolite_name>gamma-Diosphenol</metabolite_name><metabolite_name>cis-Mevinphos</metabolite_name><metabolite_name>Cholesterol sulfate</metabolite_name><metabolite_name>N-Nitrosoanatabine</metabolite_name><metabolite_name>Glucosereductone</metabolite_name><metabolite_name>Behenic acid</metabolite_name><metabolite_name>Indoleacrylic acid</metabolite_name><metabolite_name>Palmitoyl glucuronide</metabolite_name><metabolite_name>syringol sulfate</metabolite_name><metabolite_name>3-Hydroxytetradecanoic acid</metabolite_name><metabolite_name>LysoPE(0:0/18:3(6Z,9Z,12Z))</metabolite_name><metabolite_name>Isoplumbagin</metabolite_name><metabolite_name>D-Leucic acid</metabolite_name><metabolite_name>Gallic acid</metabolite_name><metabolite_name>Trimipramine</metabolite_name><metabolite_name>12-Methyltridecanoic acid</metabolite_name><metabolite_name>2-Hydroxy-2,6,6-trimethylcyclohexanone</metabolite_name><metabolite_name>Methylphosphonic acid</metabolite_name><metabolite_name>Oxalic acid</metabolite_name><metabolite_name>Myristic acid</metabolite_name><metabolite_name>3,4-Dihydro-2,2,5,7,8-pentamethyl-2H-1-benzopyran-6-ol</metabolite_name><metabolite_name>Brassinolide</metabolite_name><metabolite_name>Succinic acid</metabolite_name><metabolite_name>Nonoxinol</metabolite_name><metabolite_name>Bergaptol</metabolite_name><metabolite_name>Annuionone A</metabolite_name><metabolite_name>Phenyllactic acid</metabolite_name><metabolite_name>Nicotine-1'-N-oxide</metabolite_name><metabolite_name>2,4-Dinitrophenol</metabolite_name><metabolite_name>Adipic acid</metabolite_name><metabolite_name>ent-7alpha,12beta-Dihydroxy-16-kauren-19,6beta-olide</metabolite_name><metabolite_name>Tetrahydrofurfuryl butyrate</metabolite_name><metabolite_name>Adrenic acid</metabolite_name><metabolite_name>2,6-Pyridinedicarboxylic acid</metabolite_name><metabolite_name>(±)-Camphoric acid</metabolite_name><metabolite_name>N-Acetyl-DL-phenylalanine</metabolite_name><metabolite_name>Hippuric acid</metabolite_name><metabolite_name>alpha-Linolenic acid</metabolite_name><metabolite_name>Acrylic acid</metabolite_name><metabolite_name>Pimonidazole</metabolite_name><metabolite_name>Pivagabine</metabolite_name><metabolite_name>MG(15:0/0:0/0:0)</metabolite_name><metabolite_name>17-Methyloctadecanoic acid</metabolite_name><metabolite_name>2-Methylbenzaldehyde</metabolite_name><metabolite_name>LysoPA(0:0/16:0)</metabolite_name><metabolite_name>Goshuyic acid</metabolite_name><metabolite_name>Bis(2-propylheptyl) phthalate</metabolite_name><metabolite_name>p-Coumaric acid sulfate</metabolite_name><metabolite_name>4,7,10,13-Hexadecatetraenoic acid</metabolite_name><metabolite_name>Quinolinic acid</metabolite_name><metabolite_name>3,7,11-Trimethyldodeca-2,6,10-trienoic acid</metabolite_name><metabolite_name>Phensuximide</metabolite_name><metabolite_name>3-[3-(Sulfooxy)phenyl]propanoic acid</metabolite_name><metabolite_name>Cibulins</metabolite_name><metabolite_name>m-Methylhippuric acid</metabolite_name><metabolite_name>Cycluron</metabolite_name><metabolite_name>xi-2,5-Dihydro-2,4-dimethylthiazole</metabolite_name><metabolite_name>2(3H)-Benzothiazolethione</metabolite_name><metabolite_name>2-Methylhippuric acid</metabolite_name><metabolite_name>Acetoin</metabolite_name><metabolite_name>Palmitic acid alkyne</metabolite_name><metabolite_name>Thiram</metabolite_name><metabolite_name>Threonic acid</metabolite_name><metabolite_name>Dimethoxycarbene</metabolite_name><metabolite_name>Oxoadipic acid</metabolite_name><metabolite_name>Isobutyric acid</metabolite_name><metabolite_name>2,2'-Azobis(2-amidinopropane)</metabolite_name><metabolite_name>(2R)-2-{[(9Z)-Hexadec-9-enoyl]oxy}-3-hydroxypropyl 2-(trimethylazaniumyl)ethyl phosphate</metabolite_name><metabolite_name>Palmitoleic acid</metabolite_name><metabolite_name>Heptadecanoic acid</metabolite_name><metabolite_name>Citraconic acid</metabolite_name><metabolite_name>(S)-3-Octanol glucoside</metabolite_name><metabolite_name>Rizatriptan</metabolite_name><metabolite_name>Didanosine</metabolite_name><metabolite_name>Sporol</metabolite_name><metabolite_name>Vitacoxib</metabolite_name><metabolite_name>Sulfolithocholylglycine</metabolite_name><metabolite_name>Tripelennamine</metabolite_name><metabolite_name>Glutamine</metabolite_name><metabolite_name>Blood platelet activating factor-acether</metabolite_name><metabolite_name>cis-3-Hexenyl acetate</metabolite_name><metabolite_name>Phenylacetic acid</metabolite_name><metabolite_name>(Z)-1-[4-(4-Diethylaminobutoxy)phenyl]-1,2-diphenyl-2-chloro-ethylene</metabolite_name><metabolite_name>Dihydroxyacetone phosphate</metabolite_name><metabolite_name>Tebufelone</metabolite_name><metabolite_name>Pyridine-3,5-dicarboxylic acid</metabolite_name><metabolite_name>Arachidonic acid</metabolite_name><metabolite_name>Palmitic acid</metabolite_name><metabolite_name>(1S)-3-[2-[(1R,7Ar)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-1-hydroperoxy-4-methylidenecyclohexan-1-ol</metabolite_name><metabolite_name>11,12-Epoxyeicosatrienoic acid</metabolite_name><metabolite_name>16-Hydroxyhexadecanoic acid</metabolite_name><metabolite_name>Phosphonoacetate</metabolite_name><metabolite_name>Rogletimide</metabolite_name><metabolite_name>Ethyl dodecanoate</metabolite_name><metabolite_name>N-alpha-Acetyl-L-lysine</metabolite_name><metabolite_name>(±)-trans-Linalyl oxide</metabolite_name><metabolite_name>O-Methylisourea</metabolite_name><metabolite_name>Phenyl dihydrogen phosphate</metabolite_name><metabolite_name>2-Aminopyridine</metabolite_name><metabolite_name>Nervonic acid</metabolite_name><metabolite_name>Flibanserin</metabolite_name><metabolite_name>4-Hydroxybenzoic acid</metabolite_name><metabolite_name>beta-propiolactone</metabolite_name><metabolite_name>N-Hydroxysuccinimide</metabolite_name><metabolite_name>Cadabicilone</metabolite_name><metabolite_name>(S)-14-Methylhexadecanoic acid</metabolite_name><metabolite_name>Malondialdehyde</metabolite_name><metabolite_name>Dodecyl methacrylate</metabolite_name><metabolite_name>Abametapir</metabolite_name><metabolite_name>Sebacic acid</metabolite_name><metabolite_name>Glycidol</metabolite_name><metabolite_name>Triprolidine</metabolite_name><metabolite_name>2-Hydroxystearic acid</metabolite_name><metabolite_name>13-HOTE</metabolite_name><metabolite_name>1-(2,4,5-Trimethoxyphenyl)-1,2-propanedione</metabolite_name><metabolite_name>Ergothioneine</metabolite_name><metabolite_name>Homovanillic acid sulfate</metabolite_name><metabolite_name>Tryptophanamide</metabolite_name><metabolite_name>Dicarbine</metabolite_name><metabolite_name>Maslinic acid</metabolite_name><metabolite_name>1,2,4,5,7,8-Hexathionane</metabolite_name><metabolite_name>11-(3-Pentyloxiran-2-yl)undec-9-enoic acid</metabolite_name><metabolite_name>2-Hydroxyvaleric acid</metabolite_name><metabolite_name>Octadeca-2,4,6,8-tetraenoic acid</metabolite_name><metabolite_name>Ethionamide</metabolite_name><metabolite_name>Zoxazolamine</metabolite_name><metabolite_name>Acetylenedicarboxylic acid</metabolite_name><metabolite_name>Mepanipyrim</metabolite_name><metabolite_name>N-Nitrosodimethylamine</metabolite_name><metabolite_name>Exametazime</metabolite_name><metabolite_name>Aminooxyacetic acid</metabolite_name><metabolite_name>Picolinic acid</metabolite_name><metabolite_name>Phthalazine</metabolite_name><metabolite_name>Succinic acid semialdehyde</metabolite_name><metabolite_name>myo-Inositol</metabolite_name><metabolite_name>Ecdysone</metabolite_name><metabolite_name>Leucylleucine methyl ester</metabolite_name><metabolite_name>N-Phenylpropionamide</metabolite_name><metabolite_name>4',7-Di-O-methylcatechin</metabolite_name><metabolite_name>3'-Hydroxy-3,4,5,4'-tetramethoxystilbene</metabolite_name><metabolite_name>Isopalmitic acid</metabolite_name><metabolite_name>Hydroxyphenyllactic acid</metabolite_name><metabolite_name>(-)-2-Difluoromethylornithine</metabolite_name><metabolite_name>Tricyclodehydroisohumulone</metabolite_name><metabolite_name>Dodecanedioic acid</metabolite_name><metabolite_name>Ethyl formate</metabolite_name><metabolite_name>Pandamarilactam 3x</metabolite_name><metabolite_name>Xanthine</metabolite_name><metabolite_name>Pactimibe</metabolite_name><metabolite_name>Di-alpha-furfuryl ether</metabolite_name><metabolite_name>19,20-DiHDPA</metabolite_name><metabolite_name>Azatadine</metabolite_name><metabolite_name>Allixin</metabolite_name><metabolite_name>Vorinostat</metabolite_name><metabolite_name>N-Acetyl-L-alanine</metabolite_name><metabolite_name>Dimethylarginine</metabolite_name><metabolite_name>2-(5-Chloro-2-fluorophenyl)-N-(pyridin-4-yl)pteridin-4-amine</metabolite_name><metabolite_name>Indalpine</metabolite_name><metabolite_name>(2S)-5-(Diaminomethylideneamino)-4-methyl-2-(methylamino)pentanoic acid</metabolite_name><metabolite_name>desmethylcyclobenzaprine</metabolite_name><metabolite_name>Avasimibe</metabolite_name><metabolite_name>xi-2,3-Dihydro-2-oxo-1H-indole-3-acetic acid</metabolite_name><metabolite_name>(±)-Rollipyrrole</metabolite_name><metabolite_name>Phenyl acetate</metabolite_name><metabolite_name>Propenoylcarnitine</metabolite_name><metabolite_name>Thymidine</metabolite_name><metabolite_name>Aldosterone</metabolite_name><metabolite_name>4-(2-Aminophenyl)-2,4-dioxobutanoic acid</metabolite_name><metabolite_name>Ursodeoxycholic acid</metabolite_name><metabolite_name>Desloratadine</metabolite_name><metabolite_name>Isocaproic acid</metabolite_name><metabolite_name>2-Methyl-3-oxopropanoic acid</metabolite_name><metabolite_name>Pantetheine</metabolite_name><metabolite_name>Pexacerfont</metabolite_name><metabolite_name>Tiglylglycine</metabolite_name><metabolite_name>6-Oxopiperidine-2-carboxylic acid</metabolite_name><metabolite_name>(E)-8-(3,4-Dimethoxystyryl)-7-methyl-1,3-dipropylxanthine</metabolite_name><metabolite_name>Epiacorone</metabolite_name><metabolite_name>4-Methyl-2-(1-phenylethyl)-1,3-dioxolane, 9CI</metabolite_name><metabolite_name>Malic acid</metabolite_name><metabolite_name>2,4-Dimethyl-1,3-dioxolane</metabolite_name><metabolite_name>Drostanolone</metabolite_name><metabolite_name>12,13-EpOME</metabolite_name><metabolite_name>LysoPE(16:0/0:0)</metabolite_name><metabolite_name>Gluconic acid</metabolite_name><metabolite_name>PI(20:4(8Z,11Z,14Z,17Z)/18:0)</metabolite_name><metabolite_name>ortho-Hydroxyphenylacetic acid</metabolite_name><metabolite_name>Valganciclovir</metabolite_name><metabolite_name>12-HETE</metabolite_name><metabolite_name>Indoxyl sulfate</metabolite_name><metabolite_name>Galactaric acid</metabolite_name><metabolite_name>N-Propionylmethionine</metabolite_name><metabolite_name>Undecanedioic acid</metabolite_name><metabolite_name>(12R)-12-Hydroxyoctadec-9-enoic acid</metabolite_name><metabolite_name>2-Hydroxy-2-methylbutyric acid</metabolite_name><metabolite_name>15-Methylpalmitate</metabolite_name><metabolite_name>L-Aspartic acid</metabolite_name><metabolite_name>Procaine</metabolite_name><metabolite_name>Methyl acetate</metabolite_name><metabolite_name>Oxypurinol</metabolite_name><metabolite_name>Pyruvaldehyde</metabolite_name><metabolite_name>12-Hydroxystearic acid</metabolite_name><metabolite_name>Butyl 3-hydroxy-2-methylidenebutanoate</metabolite_name><metabolite_name>Isovalerylglycine</metabolite_name><metabolite_name>N-Methylcalystegine B2</metabolite_name><metabolite_name>13-Hydroxymarasmene</metabolite_name><metabolite_name>Methionine sulfoxide</metabolite_name><metabolite_name>4,7,10,13,16-Docosapentaenoic acid</metabolite_name><metabolite_name>Leucine</metabolite_name><metabolite_name>Citramalic acid</metabolite_name><metabolite_name>Taurodeoxycholic acid</metabolite_name><metabolite_name>Dihomo-gamma-linolenic acid</metabolite_name><metabolite_name>3-Oxotetradecanoic acid</metabolite_name><metabolite_name>Methylpyrogallol sulfate 3</metabolite_name><metabolite_name>Azelaic acid</metabolite_name><metabolite_name>9,10-Epoxystearic acid</metabolite_name><metabolite_name>Dihomo-alpha-linolenic acid</metabolite_name><metabolite_name>5-Pyridoxolactone</metabolite_name><metabolite_name>3-Isobutyl-1-methylxanthine</metabolite_name><metabolite_name>alpha-D-Glucose</metabolite_name><metabolite_name>Perillic acid</metabolite_name><metabolite_name>2-Hydroxymyristic acid</metabolite_name><metabolite_name>Salicyluric acid</metabolite_name><metabolite_name>Bergapten</metabolite_name><metabolite_name>Isocolumbin</metabolite_name><metabolite_name>2,5-Furandicarboxylic acid</metabolite_name><metabolite_name>9-beta-d-Arabinofuranosylguanine</metabolite_name><metabolite_name>Deoxycholic acid</metabolite_name><metabolite_name>5Z-Tetradecenoic acid</metabolite_name><metabolite_name>Methylurea</metabolite_name><metabolite_name>xi-10-Hydroxyoctadecanoic acid</metabolite_name><metabolite_name>2-Methylpropyl 3-hydroxy-2-methylidenebutanoate</metabolite_name><metabolite_name>Piperidine, 1-(4-(1-methyl-1-(4-methylcyclohexyl)ethoxy)phenyl)-, cis-</metabolite_name><metabolite_name>Mestranol</metabolite_name></additional><is_claimable>false</is_claimable><name>Gut Microbiota-Derived Indole-3-Propionic Acid Ameliorates Diabetic Cardiomyopathy by Regulating Mitochondrial Dynamics via the AhR/Nrf2 Pathway</name><description>This study investigated serum metabolic alterations in a mouse model of diabetic cardiomyopathy and evaluated the protective role of the gut microbiota-derived metabolite indole-3-propionic acid. Serum samples from mice were analyzed using untargeted LC-MS metabolomics. The study focused on the relationship between indole-3-propionic acid, cardiac dysfunction, oxidative stress, mitochondrial dynamics, and the AhR/Nrf2 signaling pathway. The results indicate that indole-3-propionic acid may ameliorate diabetic cardiomyopathy by activating AhR/Nrf2-mediated antioxidant signaling and restoring mitochondrial fission/fusion balance.</description><dates><publication>2026-07-26</publication><submission>2026-07-06</submission></dates><accession>MTBLS14953</accession><cross_references><HMDB>HMDB0001645</HMDB><HMDB>HMDB0251528</HMDB><HMDB>HMDB0000050</HMDB><HMDB>HMDB0000853</HMDB><HMDB>HMDB0000925</HMDB><HMDB>HMDB0000045</HMDB><HMDB>HMDB0033923</HMDB><HMDB>HMDB0000043</HMDB><HMDB>HMDB0033731</HMDB><HMDB>HMDB0341345</HMDB><HMDB>HMDB0250782</HMDB><HMDB>HMDB0003312</HMDB><HMDB>HMDB0015049</HMDB><HMDB>HMDB0000097</HMDB><HMDB>HMDB0013205</HMDB><HMDB>HMDB0259583</HMDB><HMDB>HMDB0002014</HMDB><HMDB>HMDB0000157</HMDB><HMDB>HMDB0012273</HMDB><HMDB>HMDB0251144</HMDB><HMDB>HMDB0000206</HMDB><HMDB>HMDB0011740</HMDB><HMDB>HMDB0247583</HMDB><HMDB>HMDB0004827</HMDB><HMDB>HMDB0247501</HMDB><HMDB>HMDB0000715</HMDB><HMDB>HMDB0001565</HMDB><HMDB>HMDB0001431</HMDB><HMDB>HMDB0000235</HMDB><HMDB>HMDB0012245</HMDB><HMDB>HMDB0015255</HMDB><HMDB>HMDB0245009</HMDB><HMDB>HMDB0035996</HMDB><HMDB>HMDB0000262</HMDB><HMDB>HMDB0013324</HMDB><HMDB>HMDB0250696</HMDB><HMDB>HMDB0000259</HMDB><HMDB>HMDB0000716</HMDB><HMDB>HMDB0000089</HMDB><HMDB>HMDB0029737</HMDB><HMDB>HMDB0041008</HMDB><HMDB>HMDB0240752</HMDB><HMDB>HMDB0249457</HMDB><HMDB>HMDB0000688</HMDB><HMDB>HMDB0000883</HMDB><HMDB>HMDB0000177</HMDB><HMDB>HMDB0000875</HMDB><HMDB>HMDB0006317</HMDB><HMDB>HMDB0014514</HMDB><HMDB>HMDB0000699</HMDB><HMDB>HMDB0000881</HMDB><HMDB>HMDB0001065</HMDB><HMDB>HMDB0013127</HMDB><HMDB>HMDB0257557</HMDB><HMDB>HMDB0251709</HMDB><HMDB>HMDB0000791</HMDB><HMDB>HMDB0010384</HMDB><HMDB>HMDB0035830</HMDB><HMDB>HMDB0010392</HMDB><HMDB>HMDB0012108</HMDB><HMDB>HMDB0000479</HMDB><HMDB>HMDB0000222</HMDB><HMDB>HMDB0253643</HMDB><HMDB>HMDB0034149</HMDB><HMDB>HMDB0000014</HMDB><HMDB>HMDB0000277</HMDB><HMDB>HMDB0002815</HMDB><HMDB>HMDB0000244</HMDB><HMDB>HMDB0246234</HMDB><HMDB>HMDB0010393</HMDB><HMDB>HMDB0001406</HMDB><HMDB>HMDB0341406</HMDB><HMDB>HMDB0000630</HMDB><HMDB>HMDB0010382</HMDB><HMDB>HMDB0010395</HMDB><HMDB>HMDB0003320</HMDB><HMDB>HMDB0243899</HMDB><HMDB>HMDB0015352</HMDB><HMDB>HMDB0034171</HMDB><HMDB>HMDB0000897</HMDB><HMDB>HMDB0010397</HMDB><HMDB>HMDB0010387</HMDB><HMDB>HMDB0010383</HMDB><HMDB>HMDB0000064</HMDB><HMDB>HMDB0011177</HMDB><HMDB>HMDB0010381</HMDB><HMDB>HMDB0010379</HMDB><HMDB>HMDB0255842</HMDB><HMDB>HMDB0013335</HMDB><HMDB>HMDB0000301</HMDB><HMDB>HMDB0013154</HMDB><HMDB>HMDB0013339</HMDB><HMDB>HMDB0013333</HMDB><HMDB>HMDB0013336</HMDB><HMDB>HMDB0006318</HMDB><HMDB>HMDB0013330</HMDB><HMDB>HMDB0013166</HMDB><HMDB>HMDB0001545</HMDB><HMDB>HMDB0000201</HMDB><HMDB>HMDB0000195</HMDB><HMDB>HMDB0013331</HMDB><HMDB>HMDB0014686</HMDB><HMDB>HMDB0240760</HMDB><HMDB>HMDB0005862</HMDB><HMDB>HMDB0062517</HMDB><HMDB>HMDB0001044</HMDB><HMDB>HMDB0060677</HMDB><HMDB>HMDB0001476</HMDB><HMDB>HMDB0000210</HMDB><HMDB>HMDB0248463</HMDB><HMDB>HMDB0034244</HMDB><HMDB>HMDB0002250</HMDB><HMDB>HMDB0005066</HMDB><HMDB>HMDB0000133</HMDB><HMDB>HMDB0243964</HMDB><HMDB>HMDB0250791</HMDB><HMDB>HMDB0000517</HMDB><HMDB>HMDB0003011</HMDB><HMDB>HMDB0246304</HMDB><HMDB>HMDB0013122</HMDB><HMDB>HMDB0254199</HMDB><HMDB>HMDB0000736</HMDB><HMDB>HMDB0256997</HMDB><HMDB>HMDB0034587</HMDB><HMDB>HMDB0000001</HMDB><HMDB>HMDB0003012</HMDB><HMDB>HMDB0256594</HMDB><HMDB>HMDB0000821</HMDB><HMDB>HMDB0000738</HMDB><HMDB>HMDB0061634</HMDB><HMDB>HMDB0251189</HMDB><HMDB>HMDB0244237</HMDB><HMDB>HMDB0000015</HMDB><HMDB>HMDB0014862</HMDB><HMDB>HMDB0254019</HMDB><HMDB>HMDB0011174</HMDB><HMDB>HMDB0001901</HMDB><HMDB>HMDB0000512</HMDB><HMDB>HMDB0256030</HMDB><HMDB>HMDB0011749</HMDB><HMDB>HMDB0000148</HMDB><HMDB>HMDB0001889</HMDB><HMDB>HMDB0008057</HMDB><HMDB>HMDB0000898</HMDB><HMDB>HMDB0258493</HMDB><HMDB>HMDB0000594</HMDB><HMDB>HMDB0245325</HMDB><HMDB>HMDB0250763</HMDB><HMDB>HMDB0000712</HMDB><HMDB>HMDB0005781</HMDB><HMDB>HMDB0011130</HMDB><HMDB>HMDB0007973</HMDB><HMDB>HMDB0246971</HMDB><HMDB>HMDB0000153</HMDB><HMDB>HMDB0247290</HMDB><HMDB>HMDB0014417</HMDB><HMDB>HMDB0015191</HMDB><HMDB>HMDB0031172</HMDB><HMDB>HMDB0014581</HMDB><HMDB>HMDB0000159</HMDB><HMDB>HMDB0256501</HMDB><HMDB>HMDB0014868</HMDB><HMDB>HMDB0243975</HMDB><HMDB>HMDB0002100</HMDB><HMDB>HMDB0256160</HMDB><HMDB>HMDB0255052</HMDB><HMDB>HMDB0245012</HMDB><HMDB>HMDB0001392</HMDB><HMDB>HMDB0031849</HMDB><HMDB>HMDB0008002</HMDB><HMDB>HMDB0005808</HMDB><HMDB>HMDB0242579</HMDB><HMDB>HMDB0000619</HMDB><HMDB>HMDB0015560</HMDB><HMDB>HMDB0002039</HMDB><HMDB>HMDB0032231</HMDB><HMDB>HMDB0030396</HMDB><HMDB>HMDB0000930</HMDB><HMDB>HMDB0255572</HMDB><HMDB>HMDB0007991</HMDB><HMDB>HMDB0061189</HMDB><HMDB>HMDB0061918</HMDB><HMDB>HMDB0031492</HMDB><HMDB>HMDB0032603</HMDB><HMDB>HMDB0246552</HMDB><HMDB>HMDB0004193</HMDB><HMDB>HMDB0011171</HMDB><HMDB>HMDB0000158</HMDB><HMDB>HMDB0032991</HMDB><HMDB>HMDB0001511</HMDB><HMDB>HMDB0002820</HMDB><HMDB>HMDB0004825</HMDB><HMDB>HMDB0255878</HMDB><HMDB>HMDB0249636</HMDB><HMDB>HMDB0008039</HMDB><HMDB>HMDB0244074</HMDB><HMDB>HMDB0094691</HMDB><HMDB>HMDB0003447</HMDB><HMDB>HMDB0259357</HMDB><HMDB>HMDB0029083</HMDB><HMDB>HMDB0244507</HMDB><HMDB>HMDB000026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