<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/MTBLS14056/m_MTBLS14056_total.tsv</Tabular><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14056/i_Investigation.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14056/a_MTBLS14056_LC-MS_negative_hilic_metabolite_profiling.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14056/s_MTBLS14056.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14056/a_MTBLS14056_LC-MS_positive_hilic_metabolite_profiling.txt</Txt></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/MTBLS14056</ftp_download_link><metabolite_identification_protocol>&lt;p>Metabolite annotation was performed using an R package combined with the BiotreeDB database (version 3.0), based on accurate mass and, where available, MS/MS fragmentation matching. Annotated metabolite lists and feature tables were exported for downstream analysis and interpretation.&lt;/p></metabolite_identification_protocol><repository>MetaboLights</repository><study_status>Public</study_status><ptm_modification></ptm_modification><instrument_platform>Liquid Chromatography MS - positive - hilic</instrument_platform><instrument_platform>Liquid Chromatography MS - negative - hilic</instrument_platform><chromatography_protocol>&lt;p>Polar metabolites were separated using a Vanquish UHPLC system (Thermo Fisher Scientific) equipped with a Waters ACQUITY UPLC BEH Amide column (2.1 mm × 50 mm, 1.7 µm; HILIC). Mobile phase A was 25 mM ammonium acetate and 25 mM ammonia hydroxide in water (pH 9.75), and mobile phase B was acetonitrile. The autosampler temperature was maintained at 4 °C and the injection volume was 2 µL. (Gradient program and flow rate followed the service provider’s standard method.)&lt;/p></chromatography_protocol><publication>Micro(nano)plastics in the development of myocardial fibrosis: from clinical detection to molecular mechanism.</publication><submitter_affiliation>Beijing Anzhen Hospital</submitter_affiliation><submitter_name>Yilin Pan</submitter_name><organism_part>Left Atrial Appendage</organism_part><technology_type>mass spectrometry assay</technology_type><disease></disease><extraction_protocol>&lt;p>Approximately 25±1 mg human left atrial appendage tissue was extracted with 500 µL methanol:acetonitrile:water (2:2:1, v/v) containing deuterated internal standards. Samples were vortexed (30 s), homogenized (35 Hz, 4 min) and sonicated (4°C water bath, 5 min) for three cycles, then incubated at −40°C for 1 h and centrifuged.&lt;/p></extraction_protocol><organism>Homo sapiens</organism><data_transformation_protocol>&lt;p>Raw LC–MS data were converted to mzXML format using ProteoWizard. Converted mzXML files were processed using an in-house R-based pipeline incorporating XCMS for peak detection, retention-time alignment, and peak integration to generate the feature intensity matrix. Features were filtered by relative standard deviation (RSD) de-noising. Missing values were imputed with half of the minimum detected value, and peak intensities were normalized using the internal standard method. The processed data matrix was used for downstream statistical analyses.&lt;/p></data_transformation_protocol><study_factor>Nanoplastics</study_factor><metabolights_link>https://www.ebi.ac.uk/metabolights/MTBLS14056</metabolights_link><submitter_email>pyldudu@outlook.com</submitter_email><sample_collection_protocol>&lt;p>Left atrial appendage was obtained as specimens before initiation of cardiopulmonary bypass and surgical ablation. Sample collection was performed by trained research staff wearing cotton surgical scrub suits and rubber surgical gloves near the operating table. The tissue was frozen in liquid nitrogen and stored at -80°C for downstream molecular analyses. All samples were collected following standardized surgical procedures, ensuring patients were not exposed to any additional harm.&lt;/p></sample_collection_protocol><omics_type>Metabolomics</omics_type><study_design>Myocardial fibrosis</study_design><study_design>micro(nano)plastic</study_design><study_design>untargeted metabolite profiling</study_design><curator_keywords>Myocardial fibrosis</curator_keywords><curator_keywords>micro(nano)plastic</curator_keywords><curator_keywords>untargeted metabolite profiling</curator_keywords><mass_spectrometry_protocol>&lt;p>Mass spectrometry was performed on an Orbitrap Exploris 120 mass spectrometer (Thermo Fisher Scientific) with an electrospray ionization (ESI) source, operating in positive and negative ion modes (separate acquisitions). Data were acquired under Xcalibur software in information-dependent acquisition (IDA) mode (full-scan MS with data-dependent MS/MS). Source conditions were: sheath gas 50 Arb, auxiliary gas 15 Arb, capillary temperature 320 °C, spray voltage +3.8 kV (positive) and −3.4 kV (negative). Full-scan MS resolution was 60,000 and MS/MS resolution was 15,000, with normalized collision energy (NCE) 20/30/40.&lt;/p></mass_spectrometry_protocol><metabolite_name>S-Adenosylmethioninamine</metabolite_name><metabolite_name>Caprolactam</metabolite_name><metabolite_name>Phenylacetylglutamine</metabolite_name><metabolite_name>Mangiferdesmethylursanone</metabolite_name><metabolite_name>PC(14:1(9Z)/16:0)</metabolite_name><metabolite_name>Cefuroxime</metabolite_name><metabolite_name>4-Cresol sulfate</metabolite_name><metabolite_name>Ectoine</metabolite_name><metabolite_name>Coumestrol</metabolite_name><metabolite_name>Val-Met</metabolite_name><metabolite_name>Pantothenol</metabolite_name><metabolite_name>L-Erythrulose</metabolite_name><metabolite_name>Altretamine</metabolite_name><metabolite_name>Ketoleucine</metabolite_name><metabolite_name>Tacrine</metabolite_name><metabolite_name>Cholest-4-en-26-oic acid, 7alpha-hydroxy-3-oxo</metabolite_name><metabolite_name>(25S)-26-Hydroxy-24-methylenecycloartan-3-one</metabolite_name><metabolite_name>Caplamin</metabolite_name><metabolite_name>Nipecotic acid</metabolite_name><metabolite_name>PC(18:4(6Z,9Z,12Z,15Z)/P-16:0)</metabolite_name><metabolite_name>Valdecoxib</metabolite_name><metabolite_name>Scopoletin</metabolite_name><metabolite_name>Glyzaglabrin</metabolite_name><metabolite_name>1-Kestose</metabolite_name><metabolite_name>Capric acid</metabolite_name><metabolite_name>PC(20:3(5Z,8Z,11Z)/15:0)</metabolite_name><metabolite_name>1-Hydroxy-2-naphthoic acid</metabolite_name><metabolite_name>D-Glucosaminic acid</metabolite_name><metabolite_name>cis-?9,?10-?Epoxystearic acid</metabolite_name><metabolite_name>4-Hydroxybenzaldehyde</metabolite_name><metabolite_name>Picolinamide</metabolite_name><metabolite_name>N2-Acetylornithine</metabolite_name><metabolite_name>Adenosine 5'-triphosphate (ATP)</metabolite_name><metabolite_name>1H-Indole-4-carboxaldehyde</metabolite_name><metabolite_name>1-O-beta-D-Glucopyranosyl-2,3-di-O-(8-hexadecenoyl)glycerol</metabolite_name><metabolite_name>Mevalonic acid</metabolite_name><metabolite_name>Arginine</metabolite_name><metabolite_name>[12]-Gingerol</metabolite_name><metabolite_name>PC(16:0/18:0)</metabolite_name><metabolite_name>Glutathione</metabolite_name><metabolite_name>4-Hydroxyglutamic acid</metabolite_name><metabolite_name>PC(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))</metabolite_name><metabolite_name>Piperonylic acid</metabolite_name><metabolite_name>Tetrabenazine</metabolite_name><metabolite_name>Maltopentaose</metabolite_name><metabolite_name>Deoxyguanosine triphosphate (dGTP)</metabolite_name><metabolite_name>Isodesmosine</metabolite_name><metabolite_name>Galactono-1,4-lactone</metabolite_name><metabolite_name>Pro-Gly</metabolite_name><metabolite_name>Dioscin</metabolite_name><metabolite_name>Isradipine</metabolite_name><metabolite_name>Kainic acid</metabolite_name><metabolite_name>N-Methyl-L-proline</metabolite_name><metabolite_name>N-Acetylneuraminic acid</metabolite_name><metabolite_name>Moxonidine</metabolite_name><metabolite_name>Pantothenic acid</metabolite_name><metabolite_name>Etodolac</metabolite_name><metabolite_name>Hygric acid</metabolite_name><metabolite_name>Leu-Val</metabolite_name><metabolite_name>1-O-Hexadecyl-sn-glycero-3-phosphocholine (LPC(O-16:0/0:0))</metabolite_name><metabolite_name>Erythrose 4-phosphate</metabolite_name><metabolite_name>3-Nitrophenylhydrazine</metabolite_name><metabolite_name>Acetylglycine</metabolite_name><metabolite_name>HEPTANOIC ACID</metabolite_name><metabolite_name>Mono(2-ethylhexyl) phthalate</metabolite_name><metabolite_name>Prolylalanine</metabolite_name><metabolite_name>Dienestrol diacetate</metabolite_name><metabolite_name>Homoarecoline</metabolite_name><metabolite_name>Metoprolol acid</metabolite_name><metabolite_name>12'-Apo-b-carotene-3,12'-diol</metabolite_name><metabolite_name>Methylguanidine</metabolite_name><metabolite_name>Asparaginyl-Valine</metabolite_name><metabolite_name>Chenodeoxycholic acid</metabolite_name><metabolite_name>Ornithine</metabolite_name><metabolite_name>N-Acetyl-D-glucosamine 6-phosphate</metabolite_name><metabolite_name>PS(18:0/18:2)</metabolite_name><metabolite_name>Carbidopa</metabolite_name><metabolite_name>Evocarpine</metabolite_name><metabolite_name>Decadienoylcarnitine</metabolite_name><metabolite_name>Serine</metabolite_name><metabolite_name>4-Methyl-5-vinylthiazole</metabolite_name><metabolite_name>cis-11.14-Eicosadienoic acid</metabolite_name><metabolite_name>LysoPC(22:5(7Z,10Z,13Z,16Z,19Z))</metabolite_name><metabolite_name>LPE(P-16:0)</metabolite_name><metabolite_name>risedronate</metabolite_name><metabolite_name>(3beta,5alpha,6beta,22E,24R)-23-Methylergosta-7,22-diene-3,5,6-triol</metabolite_name><metabolite_name>Promethazine sulfoxide</metabolite_name><metabolite_name>Phenylsulfate</metabolite_name><metabolite_name>Isocitric acid</metabolite_name><metabolite_name>Tiaprost</metabolite_name><metabolite_name>Tyr-Gly</metabolite_name><metabolite_name>Tetradecyl sulfate (sodium)</metabolite_name><metabolite_name>N-Lauroylglycine</metabolite_name><metabolite_name>Adenosine</metabolite_name><metabolite_name>PC(16:0/18:1(9Z))</metabolite_name><metabolite_name>L-beta-aspartyl-L-threonine</metabolite_name><metabolite_name>Diphenhydramine (hydrochloride)</metabolite_name><metabolite_name>N-acetyldopamine</metabolite_name><metabolite_name>Allopurinol</metabolite_name><metabolite_name>Uric acid</metabolite_name><metabolite_name>PIPES</metabolite_name><metabolite_name>Pro-Ile</metabolite_name><metabolite_name>L-tyrosine-methyl-ester</metabolite_name><metabolite_name>Linoleic acid</metabolite_name><metabolite_name>PC(18:0/18:3(6Z,9Z,12Z))</metabolite_name><metabolite_name>Occidentoside</metabolite_name><metabolite_name>Glucitol</metabolite_name><metabolite_name>Adenosine 3',5'-diphosphate (PAP)</metabolite_name><metabolite_name>MOXIFLOXACIN</metabolite_name><metabolite_name>O-Methyl-DL-serine</metabolite_name><metabolite_name>3-Hydroxybutyric acid</metabolite_name><metabolite_name>Betonicine</metabolite_name><metabolite_name>Benzoic acid</metabolite_name><metabolite_name>LysoPE(22:5(7Z,10Z,13Z,16Z,19Z)/0:0)</metabolite_name><metabolite_name>5-Methylcytosine</metabolite_name><metabolite_name>Methylsuccinic acid</metabolite_name><metabolite_name>N-Acetylneuraminate 9-phosphate</metabolite_name><metabolite_name>Glycolithocholic acid 3-sulfate</metabolite_name><metabolite_name>PC(20:2(11Z,14Z)/18:1(9Z))</metabolite_name><metabolite_name>Dalfopristin</metabolite_name><metabolite_name>Sedoheptulose 1,7-bisphosphate</metabolite_name><metabolite_name>O-Acetylserine</metabolite_name><metabolite_name>Ecgonine</metabolite_name><metabolite_name>PC(16:0/16:0)</metabolite_name><metabolite_name>Sphingosine</metabolite_name><metabolite_name>Minocycline</metabolite_name><metabolite_name>Chlorhexidine</metabolite_name><metabolite_name>Calcimycin</metabolite_name><metabolite_name>1-Hydroxy-3,5-dimethoxy-2,4-diprenylxanthone</metabolite_name><metabolite_name>Carbendazim</metabolite_name><metabolite_name>6-Formylpterin</metabolite_name><metabolite_name>Threonine</metabolite_name><metabolite_name>2-Deoxyribose 5-phosphate</metabolite_name><metabolite_name>2-Ketobutyric acid</metabolite_name><metabolite_name>Isodeoxycholic acid</metabolite_name><metabolite_name>Ecabet (sodium)</metabolite_name><metabolite_name>Nitrofurazone</metabolite_name><metabolite_name>Lysine</metabolite_name><metabolite_name>SM(d18:1/17:0)</metabolite_name><metabolite_name>Cyclobenzaprine</metabolite_name><metabolite_name>Linoleoylcarnitine</metabolite_name><metabolite_name>Melibiitol</metabolite_name><metabolite_name>Desethylchloroquine</metabolite_name><metabolite_name>Trehalose</metabolite_name><metabolite_name>alpha-Ketoglutaric acid (alpha-KG)</metabolite_name><metabolite_name>cis-4-Decenoylcarnitine</metabolite_name><metabolite_name>2-O-Methylcytosine</metabolite_name><metabolite_name>PE(20:2(11Z,14Z)/14:1(9Z))</metabolite_name><metabolite_name>Guanine</metabolite_name><metabolite_name>SM(d18:0/18:0)</metabolite_name><metabolite_name>(R)-6'-O-(4-Geranyloxy-2-hydroxycinnamoyl)-marmin</metabolite_name><metabolite_name>2-Naphthol</metabolite_name><metabolite_name>(S)-2-[5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamido]succinate (SAICAR)</metabolite_name><metabolite_name>Prostaglandin I2 (PGI2)</metabolite_name><metabolite_name>1-Methylnicotinamide</metabolite_name><metabolite_name>LysoPE(22:4(7Z,10Z,13Z,16Z)/0:0)</metabolite_name><metabolite_name>PC(18:1(9Z)/18:0)</metabolite_name><metabolite_name>Prednisolone</metabolite_name><metabolite_name>2-Hydroxyoctanoic acid</metabolite_name><metabolite_name>1-(2-Thienyl)-1-heptanone</metabolite_name><metabolite_name>N-[2-(1H-Indol-3-yl)ethyl]docosanamide</metabolite_name><metabolite_name>Prolintane</metabolite_name><metabolite_name>Cysteine-glutathione disulfide</metabolite_name><metabolite_name>3-Methyl-2-oxovaleric acid</metabolite_name><metabolite_name>Mannose 1-phosphate</metabolite_name><metabolite_name>Citric acid</metabolite_name><metabolite_name>Glycylleucine</metabolite_name><metabolite_name>7-Methylguanine</metabolite_name><metabolite_name>cis-9-Palmitoleic acid</metabolite_name><metabolite_name>1-Phenyl-1,3-nonadecanedione</metabolite_name><metabolite_name>8-iso-15-keto-PGE2</metabolite_name><metabolite_name>5,6-Dihydrouridine</metabolite_name><metabolite_name>6-Acetylcodeine</metabolite_name><metabolite_name>Hydroxyisocaproic acid</metabolite_name><metabolite_name>Glutathione disulfide</metabolite_name><metabolite_name>Mepirizole</metabolite_name><metabolite_name>Nadolol</metabolite_name><metabolite_name>Tauroursodeoxycholic acid</metabolite_name><metabolite_name>SM(d18:0/16:0)</metabolite_name><metabolite_name>Inosine 5'-monophosphate (IMP)</metabolite_name><metabolite_name>Glycocholic acid</metabolite_name><metabolite_name>PC(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z))</metabolite_name><metabolite_name>Pipecolic acid</metabolite_name><metabolite_name>Phe-Val</metabolite_name><metabolite_name>Ranolazine</metabolite_name><metabolite_name>Glucose 6-phosphate</metabolite_name><metabolite_name>1-Methylpiperazine</metabolite_name><metabolite_name>Adenosine dialdehyde</metabolite_name><metabolite_name>2'-Deoxyuridine</metabolite_name><metabolite_name>Indole-3-carboxaldehyde</metabolite_name><metabolite_name>1,4-Ipomeadiol</metabolite_name><metabolite_name>Stearic acid</metabolite_name><metabolite_name>Sakuranetin</metabolite_name><metabolite_name>PC(38:5)</metabolite_name><metabolite_name>Nitrilotriacetic acid</metabolite_name><metabolite_name>Chloramphenicol</metabolite_name><metabolite_name>Glutamate</metabolite_name><metabolite_name>Sulfanilamide</metabolite_name><metabolite_name>Carnitine</metabolite_name><metabolite_name>xi-2,2,6-Trimethyl-1,4-cyclohexanedione</metabolite_name><metabolite_name>Dyphylline</metabolite_name><metabolite_name>Americine</metabolite_name><metabolite_name>2-Amino-4-nitrophenol</metabolite_name><metabolite_name>MES</metabolite_name><metabolite_name>DL-Isocitric acid lactone</metabolite_name><metabolite_name>LPC(16:0)</metabolite_name><metabolite_name>Taurochenodeoxycholic acid</metabolite_name><metabolite_name>AVOCADYNE</metabolite_name><metabolite_name>AG 1295</metabolite_name><metabolite_name>(22E,24R)-Stigmasta-4,22-diene-3,6-dione</metabolite_name><metabolite_name>Trimethylamine N-oxide</metabolite_name><metabolite_name>N-Stearoyltaurine</metabolite_name><metabolite_name>PC(14:1(9Z)/18:2(9Z,12Z))</metabolite_name><metabolite_name>5-(Galactosylhydroxy)-L-lysine</metabolite_name><metabolite_name>Alanylalanine (Ala-Ala)</metabolite_name><metabolite_name>Isobutyrylcarnitine (Car(4:0))</metabolite_name><metabolite_name>N6,N6,N6-Trimethyllysine</metabolite_name><metabolite_name>PC(38:3)</metabolite_name><metabolite_name>Fluoxymesterone</metabolite_name><metabolite_name>2,5-Dihydro-2,4,5-trimethyloxazole</metabolite_name><metabolite_name>PI(16:0/18:1)</metabolite_name><metabolite_name>Thymine</metabolite_name><metabolite_name>suberosin</metabolite_name><metabolite_name>Pelargonic acid</metabolite_name><metabolite_name>Cyproterone</metabolite_name><metabolite_name>3-Methylhistamine</metabolite_name><metabolite_name>taxifolin</metabolite_name><metabolite_name>D-Ribose</metabolite_name><metabolite_name>Trolox</metabolite_name><metabolite_name>4-Hydroxyisoleucine</metabolite_name><metabolite_name>Sarcosine</metabolite_name><metabolite_name>Heptanoylcarnitine</metabolite_name><metabolite_name>Galactose</metabolite_name><metabolite_name>rubiadin</metabolite_name><metabolite_name>mollugin</metabolite_name><metabolite_name>PC(38:4)</metabolite_name><metabolite_name>16-Hydroxypalmitic acid</metabolite_name><metabolite_name>1-Methylhistamine</metabolite_name><metabolite_name>Taurine</metabolite_name><metabolite_name>Zalcitabine</metabolite_name><metabolite_name>Car(18:1)</metabolite_name><metabolite_name>Probucol</metabolite_name><metabolite_name>2-Aminonicotinic acid</metabolite_name><metabolite_name>O-Phosphoethanolamine</metabolite_name><metabolite_name>Benzenesulfonic acid</metabolite_name><metabolite_name>Mannose 6-phosphate</metabolite_name><metabolite_name>10-methylacridone</metabolite_name><metabolite_name>4-Chloro-2-methylphenol</metabolite_name><metabolite_name>Trifluoroacetic acid</metabolite_name><metabolite_name>Pirbuterol</metabolite_name><metabolite_name>2-Hexaprenyl-6-methoxyphenol</metabolite_name><metabolite_name>PC(22:5(7Z,10Z,13Z,16Z,19Z)/24:0)</metabolite_name><metabolite_name>SUXIBUZONE</metabolite_name><metabolite_name>Dapsone hydroxylamine</metabolite_name><metabolite_name>Agmatine</metabolite_name><metabolite_name>Sph(d18:0)</metabolite_name><metabolite_name>PE(18:1(9Z)/18:2(9Z,12Z))</metabolite_name><metabolite_name>acetohexamide</metabolite_name><metabolite_name>Diclofensine</metabolite_name><metabolite_name>Mebeverine</metabolite_name><metabolite_name>Ganoderic acid H</metabolite_name><metabolite_name>Trifolirhizin</metabolite_name><metabolite_name>Pi-Methylimidazoleacetic acid (hydrochloride)</metabolite_name><metabolite_name>Danazol</metabolite_name><metabolite_name>17alpha-Hydroxypregnenolone</metabolite_name><metabolite_name>Ganoderic acid B</metabolite_name><metabolite_name>Ganoderic acid A</metabolite_name><metabolite_name>PC(18:1(11Z)/15:0)</metabolite_name><metabolite_name>trans-Vaccenic acid</metabolite_name><metabolite_name>PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-16:0)</metabolite_name><metabolite_name>4-Chlorophenol</metabolite_name><metabolite_name>7-Methylguanosine</metabolite_name><metabolite_name>PE(P-18:1(11Z)/22:4(7Z,10Z,13Z,16Z))</metabolite_name><metabolite_name>PC(37:5)</metabolite_name><metabolite_name>1-Methylguanosine</metabolite_name><metabolite_name>PC(18:1(9Z)/P-16:0)</metabolite_name><metabolite_name>N-[(Ethoxycarbonyl)methyl)-p-menthane-3-carboxamide</metabolite_name><metabolite_name>Iditol</metabolite_name><metabolite_name>ACARBOSE</metabolite_name><metabolite_name>Penicillin G</metabolite_name><metabolite_name>Fructose 1-phosphate</metabolite_name><metabolite_name>3-Hydroxyvaleric acid</metabolite_name><metabolite_name>2-Aminobutyric acid</metabolite_name><metabolite_name>Val-Ile</metabolite_name><metabolite_name>Dinor-12-oxophytodienoic acid</metabolite_name><metabolite_name>Minaprine (dihydrochloride)</metabolite_name><metabolite_name>PI(18:1/18:1)</metabolite_name><metabolite_name>Harmanine</metabolite_name><metabolite_name>6-Thioinosine-5'-monophosphate</metabolite_name><metabolite_name>Dehydroacetic acid</metabolite_name><metabolite_name>PS(18:1(9Z)/20:1(11Z))</metabolite_name><metabolite_name>PC(16:0/16:1(9Z))</metabolite_name><metabolite_name>Dopamine</metabolite_name><metabolite_name>Phenylalanine</metabolite_name><metabolite_name>Sph(d18:2)</metabolite_name><metabolite_name>Car(18:0)</metabolite_name><metabolite_name>Erythromycylamine</metabolite_name><metabolite_name>Pyrazinamide</metabolite_name><metabolite_name>Prolylhydroxyproline</metabolite_name><metabolite_name>Benzoylcarnitine</metabolite_name><metabolite_name>Pentaethylene glycol</metabolite_name><metabolite_name>Persicachrome</metabolite_name><metabolite_name>CDP-glycerol</metabolite_name><metabolite_name>Uracil</metabolite_name><metabolite_name>Eicosapentaenoic acid</metabolite_name><metabolite_name>Oxooctanoylcarnitine</metabolite_name><metabolite_name>Difloxacin</metabolite_name><metabolite_name>Azithromycin</metabolite_name><metabolite_name>Octenoylcarnitine</metabolite_name><metabolite_name>Creatine</metabolite_name><metabolite_name>AS057278</metabolite_name><metabolite_name>Isoniazid alpha-ketoglutaric acid</metabolite_name><metabolite_name>5-Aminolevulinic acid</metabolite_name><metabolite_name>Caprylic acid</metabolite_name><metabolite_name>L-2-Aminoadipate adenylate</metabolite_name><metabolite_name>Maraviroc</metabolite_name><metabolite_name>SM(d18:1/18:0)</metabolite_name><metabolite_name>Cytosine</metabolite_name><metabolite_name>PG(18:1(11Z)/18:1(9Z))</metabolite_name><metabolite_name>Ferulate</metabolite_name><metabolite_name>Ciprostene</metabolite_name><metabolite_name>2-Acetylthiazole</metabolite_name><metabolite_name>Carebastine</metabolite_name><metabolite_name>Pro-Phe</metabolite_name><metabolite_name>Ethosuximide</metabolite_name><metabolite_name>Xanthopterin</metabolite_name><metabolite_name>N2,N2-Dimethylguanosine</metabolite_name><metabolite_name>5-Hydroxypyrazine-2-Carboxylic Acid</metabolite_name><metabolite_name>Tryptophyl-Methionine</metabolite_name><metabolite_name>3-Hydroxylauric acid</metabolite_name><metabolite_name>Oxalic acid</metabolite_name><metabolite_name>N,N-Dimethylarginine (ADMA)</metabolite_name><metabolite_name>Pehanorm</metabolite_name><metabolite_name>Methylgallate</metabolite_name><metabolite_name>2'-Deoxyguanosine 5'-diphosphate (dGDP)</metabolite_name><metabolite_name>5-Hydroxyisourate</metabolite_name><metabolite_name>PE(P-36:4)</metabolite_name><metabolite_name>3-Hydroxysintaxanthin</metabolite_name><metabolite_name>Pimonidazole</metabolite_name><metabolite_name>Statine</metabolite_name><metabolite_name>N-Acetylmuramoyl-Ala</metabolite_name><metabolite_name>Pimozide</metabolite_name><metabolite_name>Hypaphorine</metabolite_name><metabolite_name>Val-Val</metabolite_name><metabolite_name>(2S)-4-amino-2-[(azaniumylacetyl)amino]-4-oxobutanoate</metabolite_name><metabolite_name>Bendamustine</metabolite_name><metabolite_name>LPC(18:0/0:0)</metabolite_name><metabolite_name>2-Propanoylthiazole</metabolite_name><metabolite_name>UDP-N-acetylglucosamine</metabolite_name><metabolite_name>Vaccinoside</metabolite_name><metabolite_name>Isoleucine</metabolite_name><metabolite_name>Glycohyodeoxycholic acid</metabolite_name><metabolite_name>Harmaline</metabolite_name><metabolite_name>2-Methyl-3-hydroxybutyric acid</metabolite_name><metabolite_name>Arachidonic acid (AA)</metabolite_name><metabolite_name>Pyruvate</metabolite_name><metabolite_name>N-Lactoyl-Phenylalanine</metabolite_name><metabolite_name>Threonic acid</metabolite_name><metabolite_name>Neotame</metabolite_name><metabolite_name>Fructose</metabolite_name><metabolite_name>2,2'-Iminodiacetic acid</metabolite_name><metabolite_name>Heptadecanoic acid</metabolite_name><metabolite_name>Doxycycline</metabolite_name><metabolite_name>Citraconic acid</metabolite_name><metabolite_name>Dehydroascorbic acid (Oxidized vitamin C)</metabolite_name><metabolite_name>PC(14:0/P-18:1(9Z))</metabolite_name><metabolite_name>Amobarbital</metabolite_name><metabolite_name>Cytidine 5'-diphosphocholine (CDP-choline)</metabolite_name><metabolite_name>Dimethylglycine</metabolite_name><metabolite_name>Glutamine</metabolite_name><metabolite_name>1,2-Dimethylimidazole</metabolite_name><metabolite_name>MOPS</metabolite_name><metabolite_name>3-[4-Hydroxy-3-(3-methyl-2-butenyl)phenyl]-2-propenal</metabolite_name><metabolite_name>Triclabendazole</metabolite_name><metabolite_name>Phenylacetic acid</metabolite_name><metabolite_name>Caproic acid</metabolite_name><metabolite_name>Dihydroxyacetone phosphate</metabolite_name><metabolite_name>Merafloxacin</metabolite_name><metabolite_name>Thiamine pyrophosphate (TPP)</metabolite_name><metabolite_name>Palmitic acid</metabolite_name><metabolite_name>sn-Glycerol 3-phosphate</metabolite_name><metabolite_name>Raltitrexed</metabolite_name><metabolite_name>Histidine</metabolite_name><metabolite_name>PA(19:0/20:0)</metabolite_name><metabolite_name>cis-5-Tetradecenoylcarnitine</metabolite_name><metabolite_name>Phosphonoacetate</metabolite_name><metabolite_name>Tyramine</metabolite_name><metabolite_name>Palmitoylcarnitine (Car(16:0))</metabolite_name><metabolite_name>L-Citrulline</metabolite_name><metabolite_name>Propionic acid</metabolite_name><metabolite_name>Allopurinol-1-ribonucleoside</metabolite_name><metabolite_name>PE(14:0/22:5(7Z,10Z,13Z,16Z,19Z))</metabolite_name><metabolite_name>Glyco-beta-muricholic acid</metabolite_name><metabolite_name>Amlexanox</metabolite_name><metabolite_name>Propionylcarnitine (Car(3:0))</metabolite_name><metabolite_name>Cortisone acetate</metabolite_name><metabolite_name>Gly-Val</metabolite_name><metabolite_name>4'-Hydroxywarfarin</metabolite_name><metabolite_name>Octanoylcarnitine (Car(8:0))</metabolite_name><metabolite_name>PC(35:3)</metabolite_name><metabolite_name>Ser-Ala</metabolite_name><metabolite_name>Docosahexaenoic acid (DHA)</metabolite_name><metabolite_name>Gatifloxacin</metabolite_name><metabolite_name>Melezitose</metabolite_name><metabolite_name>PG(18:0/16:1(9Z))</metabolite_name><metabolite_name>Bifemelane</metabolite_name><metabolite_name>Glycerophosphocholine</metabolite_name><metabolite_name>Azetidine-2-carboxylic acid</metabolite_name><metabolite_name>Ergothioneine</metabolite_name><metabolite_name>alpha-Hederin</metabolite_name><metabolite_name>Varenicline</metabolite_name><metabolite_name>3-Methoxy-4-hydroxyphenylethyleneglycol</metabolite_name><metabolite_name>Hexenoylcarnitine</metabolite_name><metabolite_name>Formylmethionine</metabolite_name><metabolite_name>Propazine</metabolite_name><metabolite_name>Thr-Leu</metabolite_name><metabolite_name>Indoleacetic acid</metabolite_name><metabolite_name>Hydroxyphenylacetylglycine</metabolite_name><metabolite_name>3-Hydroxyoctanoic acid</metabolite_name><metabolite_name>Kynurenine</metabolite_name><metabolite_name>Diethylcarbamazine</metabolite_name><metabolite_name>SM(d17:1/24:1(15Z))</metabolite_name><metabolite_name>Edaravone</metabolite_name><metabolite_name>Hydroxyphenyllactic acid</metabolite_name><metabolite_name>Leucyl-Cysteine</metabolite_name><metabolite_name>N-Lactoylphenylalanine</metabolite_name><metabolite_name>Adenosine 3',5'-cyclic phosphate (cAMP)</metabolite_name><metabolite_name>L-Alanyl-L-leucine</metabolite_name><metabolite_name>Alanine</metabolite_name><metabolite_name>2-Methylguanosine</metabolite_name><metabolite_name>gamma-Glutamylglutamine</metabolite_name><metabolite_name>N-Acetylhistidine</metabolite_name><metabolite_name>Levulinic acid</metabolite_name><metabolite_name>Aristolodione</metabolite_name><metabolite_name>Glutamylalanine</metabolite_name><metabolite_name>Tryptophan</metabolite_name><metabolite_name>PG(18:1/18:1(9Z))</metabolite_name><metabolite_name>Mannitol 1-phosphate</metabolite_name><metabolite_name>Meprobamate</metabolite_name><metabolite_name>Xanthine</metabolite_name><metabolite_name>Fructose 6-phosphate</metabolite_name><metabolite_name>(+/-)-2,8-Epithio-cis-p-menthane</metabolite_name><metabolite_name>Choline</metabolite_name><metabolite_name>PC(16:0/20:4)</metabolite_name><metabolite_name>N,N'-Diphenyl-p-phenylenediamine</metabolite_name><metabolite_name>Asparagine</metabolite_name><metabolite_name>Avasimibe</metabolite_name><metabolite_name>Leucylphenylalanine</metabolite_name><metabolite_name>4-Hydroxychalcone</metabolite_name><metabolite_name>Tridecenoylcarnitine</metabolite_name><metabolite_name>Rhusflavanone</metabolite_name><metabolite_name>2-Methylundecanal</metabolite_name><metabolite_name>Arg-Phe</metabolite_name><metabolite_name>PG(16:0/18:1)</metabolite_name><metabolite_name>4-Dimethylaminopyridine</metabolite_name><metabolite_name>S-Methylmethionine</metabolite_name><metabolite_name>5-Hydroxymethyluracil</metabolite_name><metabolite_name>Aldosterone</metabolite_name><metabolite_name>DG(18:3(6Z,9Z,12Z)/15:0/0:0)</metabolite_name><metabolite_name>N-Carbamoylsarcosine</metabolite_name><metabolite_name>3-Hydroxypyruvic acid</metabolite_name><metabolite_name>Maleic acid</metabolite_name><metabolite_name>Adenosine monophosphate (AMP)</metabolite_name><metabolite_name>3'-Deoxyoleacein</metabolite_name><metabolite_name>Gluconic acid</metabolite_name><metabolite_name>Azomycin</metabolite_name><metabolite_name>o-Tyrosine</metabolite_name><metabolite_name>2-Aminopurine</metabolite_name><metabolite_name>3-Amino-4-methylpentanoic acid</metabolite_name><metabolite_name>Indoxyl sulfate</metabolite_name><metabolite_name>Glufosinate</metabolite_name><metabolite_name>PG(16:0/18:0)</metabolite_name><metabolite_name>Phosphorylcholine</metabolite_name><metabolite_name>N1-Methyl-2-pyridone-5-carboxamide</metabolite_name><metabolite_name>Val-Gly</metabolite_name><metabolite_name>S-Adenosylhomocysteine</metabolite_name><metabolite_name>PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/P-16:0)</metabolite_name><metabolite_name>2-Methoxy-3-methyl-9H-carbazole</metabolite_name><metabolite_name>2-Hydroxy-2-methylbutyric acid</metabolite_name><metabolite_name>HMMNI</metabolite_name><metabolite_name>Hexanoylcarnitine (Car(6:0))</metabolite_name><metabolite_name>sn-Glycerol 1-phosphate</metabolite_name><metabolite_name>Isonicotinamide</metabolite_name><metabolite_name>Pyruvaldehyde</metabolite_name><metabolite_name>Epigallocatechin</metabolite_name><metabolite_name>2-Oxoadipic acid</metabolite_name><metabolite_name>Gemcitabine</metabolite_name><metabolite_name>3-Hydroxystigmast-5-en-7-one</metabolite_name><metabolite_name>Phthalic anhydride</metabolite_name><metabolite_name>Leucine</metabolite_name><metabolite_name>Dihydrothymine</metabolite_name><metabolite_name>Piperidine</metabolite_name><metabolite_name>Piperlongumine</metabolite_name><metabolite_name>Lacto-N-triaose</metabolite_name><metabolite_name>Arg-Ala</metabolite_name><metabolite_name>2-Linoleoyl-1-palmitoyl-sn-glycero-3-phosphoethanolamine</metabolite_name><metabolite_name>LPI(18:0)</metabolite_name><metabolite_name>Xylitol</metabolite_name><metabolite_name>3-Hydroxy-N6,N6,N6-trimethyl-L-lysine</metabolite_name><metabolite_name>Lactose</metabolite_name><metabolite_name>Biotinyl-5'-AMP</metabolite_name><metabolite_name>2'-Deoxyguanosine 5'-monophosphate (dGMP)</metabolite_name><metabolite_name>1,7-Dimethylxanthine</metabolite_name><metabolite_name>LPC(20:4)</metabolite_name><metabolite_name>Acamprosate (calcium)</metabolite_name><metabolite_name>Thr-Phe</metabolite_name><metabolite_name>Phosphoglycolic acid</metabolite_name><metabolite_name>Ramipril</metabolite_name><metabolite_name>MeAIB</metabolite_name><metabolite_name>3,3-Dimethylglutaric acid</metabolite_name><metabolite_name>Prolyl-Tyrosine</metabolite_name><metabolite_name>Limonin</metabolite_name><metabolite_name>Cephalosporin C</metabolite_name><metabolite_name>Deoxyinosine</metabolite_name><metabolite_name>cis-Melilotoside</metabolite_name><metabolite_name>2-Ketocaproic acid</metabolite_name><metabolite_name>Thiolutin</metabolite_name><metabolite_name>Nicotinate D-ribonucleoside</metabolite_name><metabolite_name>CMP-2-aminoethylphosphonate</metabolite_name><metabolite_name>beta-Carboline</metabolite_name><metabolite_name>Physapubescin</metabolite_name><metabolite_name>Isomalt</metabolite_name><metabolite_name>Phenol</metabolite_name><metabolite_name>Enoxacin (hydrate)</metabolite_name><metabolite_name>Syringic acid</metabolite_name><metabolite_name>Nicotinamide adenine dinucleotide phosphate (NADP)</metabolite_name><metabolite_name>N-Acetylaspartic acid</metabolite_name><metabolite_name>Mesaconic acid</metabolite_name><metabolite_name>PE(P-18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z))</metabolite_name><metabolite_name>L-Fucitol</metabolite_name><metabolite_name>Glucosamine</metabolite_name><metabolite_name>7-Hydroxy-3-oxo-cholest-4-en-26-oic acid</metabolite_name><metabolite_name>Arabinono-1,4-lactone</metabolite_name><metabolite_name>Glycine</metabolite_name><metabolite_name>lactitol</metabolite_name><metabolite_name>PC(20:3(5Z,8Z,11Z)/14:0)</metabolite_name><metabolite_name>Glu-Arg</metabolite_name><metabolite_name>Oleic acid</metabolite_name><metabolite_name>Glutaric acid</metabolite_name><metabolite_name>IMIPRAMINE</metabolite_name><metabolite_name>Ascofuranone</metabolite_name><metabolite_name>Propafenone</metabolite_name><metabolite_name>Adenylsuccinic acid</metabolite_name><metabolite_name>(3beta,23E)-3-Hydroxy-27-norcycloart-23-en-25-one</metabolite_name><metabolite_name>astilbin</metabolite_name><metabolite_name>DMPO</metabolite_name><metabolite_name>Pseudouridine</metabolite_name><metabolite_name>Butyrylcarnitine (Car(4:0))</metabolite_name><metabolite_name>PC(18:3(6Z,9Z,12Z)/15:0)</metabolite_name><metabolite_name>Terephthalic-Acid</metabolite_name><metabolite_name>Capsazepine</metabolite_name><metabolite_name>PC(P-34:0)</metabolite_name><metabolite_name>Ginkgolide A</metabolite_name><metabolite_name>PC(18:0/14:0)</metabolite_name><metabolite_name>PS(20:3(8Z,11Z,14Z)/20:1(11Z))</metabolite_name><metabolite_name>LysoPE(16:1(9Z)/0:0)</metabolite_name><metabolite_name>2-Hydroxypalmitic acid</metabolite_name><metabolite_name>Tridecanoylcarnitine</metabolite_name><metabolite_name>PC(16:0/P-16:0)</metabolite_name><metabolite_name>Thiacloprid</metabolite_name><metabolite_name>LysoPE(22:0/0:0)</metabolite_name><metabolite_name>3-Hydroxyhexadecanoylcarnitine</metabolite_name><metabolite_name>SM(d18:1/24:0)</metabolite_name><metabolite_name>Tyrosylalanine</metabolite_name><metabolite_name>5,6-Dihydroxyindole</metabolite_name><metabolite_name>Guanosine</metabolite_name><metabolite_name>Bisdemethoxycurcumin</metabolite_name><metabolite_name>Ribothymidine</metabolite_name><metabolite_name>3-Hydroxydecanoic acid</metabolite_name><metabolite_name>PC(15:0/20:1(11Z))</metabolite_name><metabolite_name>3-Oxocholic acid</metabolite_name><metabolite_name>LysoPC(18:1(11Z))</metabolite_name><metabolite_name>Mesotrione</metabolite_name><metabolite_name>Glyceric acid</metabolite_name><metabolite_name>Methyl beta-D-glucopyranoside</metabolite_name><metabolite_name>Tebuconazole</metabolite_name><metabolite_name>Biliverdin</metabolite_name><metabolite_name>2-Aminoisobutyric acid</metabolite_name><metabolite_name>PC(14:1(9Z)/P-16:0)</metabolite_name><metabolite_name>GDP-4-dehydro-6-deoxy-D-mannose</metabolite_name><metabolite_name>Xylose</metabolite_name><metabolite_name>Palmitoyl sphingomyelin</metabolite_name><metabolite_name>PC(18:0/16:0)</metabolite_name><metabolite_name>KINETIN</metabolite_name><metabolite_name>PC(10:0/10:0)</metabolite_name><metabolite_name>L-Thyronine</metabolite_name><metabolite_name>1-Methylguanine</metabolite_name><metabolite_name>Pyrophosphate</metabolite_name><metabolite_name>Uridine</metabolite_name><metabolite_name>Calcipotriol</metabolite_name><metabolite_name>8-Acetylegelolide</metabolite_name><metabolite_name>2,2'-Dithiodipyridine</metabolite_name><metabolite_name>Pindolol</metabolite_name><metabolite_name>4-Hydroxyphenylacetaldehyde</metabolite_name><metabolite_name>1-oleoyl-2-myristoyl-sn-glycero-3-phosphocholine</metabolite_name><metabolite_name>8-Hydroxymianserin</metabolite_name><metabolite_name>Malonic acid</metabolite_name><metabolite_name>2-Hydroxyadenine</metabolite_name><metabolite_name>Proline</metabolite_name><metabolite_name>PC(18:2(9Z,12Z)/15:0)</metabolite_name><metabolite_name>Valyl-Proline</metabolite_name><metabolite_name>3-Sulfinoalanine</metabolite_name><metabolite_name>Chlorambucil</metabolite_name><metabolite_name>Nelarabine</metabolite_name><metabolite_name>Decanoylcarnitine (Car(10:0))</metabolite_name><metabolite_name>Beclomethasone</metabolite_name><metabolite_name>Pyroquilon</metabolite_name><metabolite_name>Prolyl-Valine</metabolite_name><metabolite_name>Glutarylcarnitine</metabolite_name><metabolite_name>3-Nitrotyrosine</metabolite_name><metabolite_name>Fomesafen</metabolite_name><metabolite_name>Malonyl-CoA</metabolite_name><metabolite_name>Gly-His</metabolite_name><metabolite_name>Thiamine</metabolite_name><metabolite_name>Probenecid</metabolite_name><metabolite_name>N-Oxalylglycine</metabolite_name><metabolite_name>Nomifensine</metabolite_name><metabolite_name>Fructose 2-phosphate</metabolite_name><metabolite_name>Galactitol</metabolite_name><metabolite_name>Glycoursodeoxycholic acid</metabolite_name><metabolite_name>Chenodeoxycholic acid 3-glucuronide</metabolite_name><metabolite_name>PC(18:1(9E)/18:1(9E))</metabolite_name><metabolite_name>Glucitol 6-phosphate</metabolite_name><metabolite_name>PC(15:0/14:1(9Z))</metabolite_name><metabolite_name>Chlordiazepoxide</metabolite_name><metabolite_name>Phe-Lys</metabolite_name><metabolite_name>2,4-Dihydroxybutanoic acid</metabolite_name><metabolite_name>Isoquercitrin</metabolite_name><metabolite_name>Homogentisic acid</metabolite_name><metabolite_name>PE(P-18:0/22:4(7Z,10Z,13Z,16Z))</metabolite_name><metabolite_name>SM(d18:0/20:0)</metabolite_name><metabolite_name>Sulfamerazine</metabolite_name><metabolite_name>Cyclic adenosine diphosphate-ribose (cADPR)</metabolite_name><metabolite_name>Fumaric acid</metabolite_name><metabolite_name>4-(Nitrosoamino)-1-(3-pyridinyl)-1-butanone</metabolite_name><metabolite_name>Argininosuccinic acid</metabolite_name><metabolite_name>Thelephoric acid</metabolite_name><metabolite_name>Hypotaurine</metabolite_name><metabolite_name>10,13-dimethyl-17-oxo-3-sulfooxy-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene</metabolite_name><metabolite_name>Phe-Pro</metabolite_name><metabolite_name>Sucrose</metabolite_name><metabolite_name>Daltogen</metabolite_name><metabolite_name>Glucose</metabolite_name><metabolite_name>Dodecyl gallate</metabolite_name><metabolite_name>N6-Acetyllysine</metabolite_name><metabolite_name>8-Isobutanoylneosolaniol</metabolite_name><metabolite_name>2-Aminonaphthalene</metabolite_name><metabolite_name>Taurocholic acid</metabolite_name><metabolite_name>PC(40:6)</metabolite_name><metabolite_name>Spectinomycin</metabolite_name><metabolite_name>Urocanic acid</metabolite_name><metabolite_name>Ribitol</metabolite_name><metabolite_name>Aspartylphenylalanine</metabolite_name><metabolite_name>N-Formyl-L-aspartate</metabolite_name><metabolite_name>Entacapone</metabolite_name><metabolite_name>Olodaterol</metabolite_name><metabolite_name>Tolmetin</metabolite_name><metabolite_name>Curcumenol</metabolite_name><metabolite_name>Octanol</metabolite_name><metabolite_name>Nicotinamide adenine dinucleotide (NAD)</metabolite_name><metabolite_name>2-Amino-5-phenylpyridine</metabolite_name><metabolite_name>Ceftriaxone</metabolite_name><metabolite_name>Tetraethylene glycol</metabolite_name><metabolite_name>4-(Hydroxymethyl)benzenediazonium(1+)</metabolite_name><metabolite_name>LPS(18:1)</metabolite_name><metabolite_name>5'-Methylthioadenosine</metabolite_name><metabolite_name>Oxacillin</metabolite_name><metabolite_name>Hydroxyacetone</metabolite_name><metabolite_name>Cer(d18:1/16:0)</metabolite_name><metabolite_name>DEHP</metabolite_name><metabolite_name>Zoniporide</metabolite_name><metabolite_name>Mianserin</metabolite_name><metabolite_name>Alfacalcidol</metabolite_name><metabolite_name>Creatinine</metabolite_name><metabolite_name>Ethylphosphonic acid</metabolite_name><metabolite_name>4-Methoxy-5-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-1,3-benzenediol</metabolite_name><metabolite_name>DEOXYRIBOSE</metabolite_name><metabolite_name>Aspartate</metabolite_name><metabolite_name>Guanosine 5'-diphosphate (GDP)</metabolite_name><metabolite_name>2,2-Dimethylsuccinic acid</metabolite_name><metabolite_name>Adenosine 2',3'-cyclic phosphate</metabolite_name><metabolite_name>6-Phosphogluconic acid</metabolite_name><metabolite_name>LPS(18:0)</metabolite_name><metabolite_name>Cyproheptadine</metabolite_name><metabolite_name>Verbasoside</metabolite_name><metabolite_name>Cefazolin</metabolite_name><metabolite_name>5-Aminopentanoic acid</metabolite_name><metabolite_name>Valine</metabolite_name><metabolite_name>Stachydrine</metabolite_name><metabolite_name>Tiglylcarnitine (Car(5:1))</metabolite_name><metabolite_name>3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid</metabolite_name><metabolite_name>Dimethadione</metabolite_name><metabolite_name>Mardepodect</metabolite_name><metabolite_name>Hexaethylene glycol</metabolite_name><metabolite_name>Dictamnine</metabolite_name><metabolite_name>Deoxycholic acid 3-glucuronide</metabolite_name><metabolite_name>PE(P-18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z))</metabolite_name><metabolite_name>Theobromine</metabolite_name><metabolite_name>1-(beta-D-Ribofuranosyl)-1,4-dihydronicotinamide</metabolite_name><metabolite_name>Urobilin</metabolite_name><metabolite_name>gamma-Glutamylvaline</metabolite_name><metabolite_name>Leu-Leu</metabolite_name><metabolite_name>5-Fluorouridine</metabolite_name><metabolite_name>2-(Phenylethenyl)-1,3-dioxolane</metabolite_name><metabolite_name>Luminol</metabolite_name><metabolite_name>Harmol</metabolite_name><metabolite_name>Cer(d18:1/18:0)</metabolite_name><metabolite_name>Daminozide</metabolite_name><metabolite_name>Lotaustralin</metabolite_name><metabolite_name>2-Hydroxy-3-methylbutyric acid</metabolite_name><metabolite_name>Glyco-gamma-muricholic acid</metabolite_name><metabolite_name>Cytidine</metabolite_name><metabolite_name>beta-Cryptoxanthin</metabolite_name><metabolite_name>Succinamide</metabolite_name><metabolite_name>Isoquinoline</metabolite_name><metabolite_name>alpha-C-Mannosyltryptophan</metabolite_name><metabolite_name>LPE(14:0)</metabolite_name><metabolite_name>5-Methyl DL-glutamate</metabolite_name><metabolite_name>H-Val-Ala-OH</metabolite_name><metabolite_name>3-(2,3,4-Trimethoxyphenyl)propanoic acid</metabolite_name><metabolite_name>1-Methylhistidine</metabolite_name><metabolite_name>Dodecanoic acid</metabolite_name><metabolite_name>Isoleucyl-Threonine</metabolite_name><metabolite_name>10-Hydroxydecanoic acid</metabolite_name><metabolite_name>PC(18:1(9Z)/18:1(9Z))</metabolite_name><metabolite_name>3-Hydroxybutyrylcarnitine (Car(4:0-O))</metabolite_name><metabolite_name>LPC(17:0/0:0)</metabolite_name><metabolite_name>Glycerophosphoethanolamine</metabolite_name><metabolite_name>Cadaverine</metabolite_name><metabolite_name>Metoprolol</metabolite_name><metabolite_name>2-Hydroxyethanesulfonic acid</metabolite_name><metabolite_name>Ofloxacin N-oxide</metabolite_name><metabolite_name>2-Naphthalenethiol</metabolite_name><metabolite_name>Glycochenodeoxycholic acid</metabolite_name><metabolite_name>Clofarabine</metabolite_name><metabolite_name>13(S)-HODE</metabolite_name><metabolite_name>N2-(3-Hydroxysuccinoyl)arginine</metabolite_name><metabolite_name>Hyodeoxycholic acid</metabolite_name><metabolite_name>Tetradecadienoylcarnitine</metabolite_name><metabolite_name>N-Acetylalanine</metabolite_name><metabolite_name>Dichlorprop</metabolite_name><metabolite_name>2-Methylbenzoxazole</metabolite_name><metabolite_name>LysoPE(0:0/18:0)</metabolite_name><metabolite_name>Embelin</metabolite_name><metabolite_name>PE(P-18:0/18:1(9Z))</metabolite_name><metabolite_name>3,4-Dihydroxyphenylacetic acid</metabolite_name><metabolite_name>1,5-Anhydroglucitol</metabolite_name><metabolite_name>Bistris</metabolite_name><metabolite_name>2-methylcitrate</metabolite_name><metabolite_name>SM(d18:1/20:0)</metabolite_name><metabolite_name>Syringin</metabolite_name><metabolite_name>Riluzole</metabolite_name><metabolite_name>Pralidoxime</metabolite_name><metabolite_name>Tandutinib</metabolite_name><metabolite_name>PS(15:0/20:3(8Z,11Z,14Z))</metabolite_name><metabolite_name>5-Hydroxyvalproic acid</metabolite_name><metabolite_name>5-Hydroxytryptophan</metabolite_name><metabolite_name>Adenosine 3'-monophosphate</metabolite_name><metabolite_name>beta-Alanine</metabolite_name><metabolite_name>2,3-Dihydroxy-2-methylbutanoic acid</metabolite_name><metabolite_name>Phe-Trp</metabolite_name><metabolite_name>Netilmicin</metabolite_name><metabolite_name>1-Methylpyrrolidine</metabolite_name><metabolite_name>Monoethylglycinexylidide (MEGX)</metabolite_name><metabolite_name>N-Acetylcarnosine</metabolite_name><metabolite_name>Etofylline</metabolite_name><metabolite_name>Methionine</metabolite_name><metabolite_name>Sinapine</metabolite_name><metabolite_name>Nalbuphine</metabolite_name><metabolite_name>Lauroylcarnitine</metabolite_name><metabolite_name>9-Oxooctadecanoic acid</metabolite_name><metabolite_name>Fostriecin</metabolite_name><metabolite_name>Brinzolamide</metabolite_name><metabolite_name>4-Hydroxyproline</metabolite_name><metabolite_name>Cholesteryl sulfate</metabolite_name><metabolite_name>Gabapentin</metabolite_name><metabolite_name>Isovalerylcarnitine (Car(5:0))</metabolite_name><metabolite_name>Citrinin</metabolite_name><metabolite_name>alpha-Chaconine</metabolite_name><metabolite_name>Carnosine</metabolite_name><metabolite_name>3-[1-(3-Aminopropyl)-1H-indol-3-yl]-4-(1-methyl-1H-indol-3-yl)-1H-pyrrole-2,5-dione</metabolite_name><metabolite_name>N-Formylglycine</metabolite_name><metabolite_name>gamma-Glutamylglutamic acid</metabolite_name><metabolite_name>Trierucin</metabolite_name><metabolite_name>Vigabatrin</metabolite_name><metabolite_name>Flurtamone</metabolite_name><metabolite_name>Phosphate</metabolite_name><metabolite_name>Hexamethylquercetagetin</metabolite_name><metabolite_name>S-Formylglutathione</metabolite_name><metabolite_name>Dihydromethysticin</metabolite_name><metabolite_name>Pentadecanoic acid</metabolite_name><metabolite_name>Aspirin</metabolite_name><metabolite_name>Galactinol</metabolite_name><metabolite_name>Hydroxyprolyl-Proline</metabolite_name><metabolite_name>3-Methyl-4-nitrophenol</metabolite_name><metabolite_name>Guanosine 5'-monophosphate (GMP)</metabolite_name><metabolite_name>20-Deoxynarasin</metabolite_name><metabolite_name>Phe-Leu</metabolite_name><metabolite_name>Bisindolylmaleimide I</metabolite_name><metabolite_name>Flurandrenolide</metabolite_name><metabolite_name>(5alpha,8beta,9beta)-5,9-Epoxy-3,6-megastigmadien-8-ol</metabolite_name><metabolite_name>Pipericine</metabolite_name><metabolite_name>Glu-Glu</metabolite_name><metabolite_name>D-4'-Phosphopantothenate</metabolite_name><metabolite_name>Indolelactic acid</metabolite_name><metabolite_name>Norleucine</metabolite_name><metabolite_name>Ribulose 5-phosphate</metabolite_name><metabolite_name>5-Hydroxytryptophol (5HTOL)</metabolite_name><metabolite_name>Maltotetraose</metabolite_name><metabolite_name>Aprobarbital</metabolite_name><metabolite_name>Mesoporphyrin IX</metabolite_name><metabolite_name>Xanthotoxol</metabolite_name><metabolite_name>Triethylene glycol monobutyl ether</metabolite_name><metabolite_name>Arachidonoylcarnitine (Car(20:4))</metabolite_name><metabolite_name>Oleoylcarnitine</metabolite_name><metabolite_name>Imidazol-1-yl-acetic acid</metabolite_name><metabolite_name>Fenpropimorph</metabolite_name><metabolite_name>Dimetridazole</metabolite_name><metabolite_name>2-Acetylpyrazine</metabolite_name><metabolite_name>matairesinol</metabolite_name><metabolite_name>Tyrosine</metabolite_name><metabolite_name>Ile-Leu</metabolite_name><metabolite_name>Acetylcarnitine (Car(2:0))</metabolite_name><metabolite_name>3-Ureidopropionic acid</metabolite_name><metabolite_name>12-Methyltridecanoic acid</metabolite_name><metabolite_name>PE(18:4(6Z,9Z,12Z,15Z)/P-18:1(9Z))</metabolite_name><metabolite_name>Bilobalide</metabolite_name><metabolite_name>Taurocyamine</metabolite_name><metabolite_name>Hydroxychloroquine</metabolite_name><metabolite_name>Myristic acid</metabolite_name><metabolite_name>Arabitol</metabolite_name><metabolite_name>Hypoxanthine</metabolite_name><metabolite_name>Homoserine</metabolite_name><metabolite_name>gamma-Linolenic acid</metabolite_name><metabolite_name>Furaltadone</metabolite_name><metabolite_name>Hippuric acid</metabolite_name><metabolite_name>alpha-Linolenic acid</metabolite_name><metabolite_name>Rocuronium</metabolite_name><metabolite_name>Levallorphan</metabolite_name><metabolite_name>Pivagabine</metabolite_name><metabolite_name>Uridine 5'-monophosphate (UMP)</metabolite_name><metabolite_name>LPE(18:1(9Z)/0:0)</metabolite_name><metabolite_name>N-Acetylaspartylglutamate (NAAG)</metabolite_name><metabolite_name>beta-Guanidinopropionic acid</metabolite_name><metabolite_name>N8-Acetylspermidine</metabolite_name><metabolite_name>Methocarbamol</metabolite_name><metabolite_name>Tauro-gamma-muricholic acid</metabolite_name><metabolite_name>PC(20:3(5Z,8Z,11Z)/18:0)</metabolite_name><metabolite_name>Glucono-1,5-lactone</metabolite_name><metabolite_name>5-Hydroxyindole</metabolite_name><metabolite_name>2-Hydroxybutyric acid</metabolite_name><metabolite_name>PC(18:4(6Z,9Z,12Z,15Z)/20:3(8Z,11Z,14Z))</metabolite_name><metabolite_name>Ophthalmic acid</metabolite_name><metabolite_name>LPI(20:4)</metabolite_name><metabolite_name>Phe-Tyr</metabolite_name><metabolite_name>S-(Hydroxymethyl)glutathione</metabolite_name><metabolite_name>2-Ethyl-2-hydroxybutyric acid</metabolite_name><metabolite_name>Adenine</metabolite_name><metabolite_name>Glu-Val-Phe</metabolite_name><metabolite_name>zapotin</metabolite_name><metabolite_name>Timonacic</metabolite_name><metabolite_name>Gly-Phe</metabolite_name><metabolite_name>Dodecenoylcarnitine</metabolite_name><metabolite_name>Hydroquinidine</metabolite_name><metabolite_name>Alloimperatorin</metabolite_name><metabolite_name>Inosine</metabolite_name><metabolite_name>Purine</metabolite_name><metabolite_name>Lumichrome</metabolite_name><metabolite_name>D-Phenylalanine</metabolite_name><metabolite_name>Celerin</metabolite_name><metabolite_name>Methylimidazoleacetic acid</metabolite_name><metabolite_name>PC(22:4(7Z,10Z,13Z,16Z)/P-18:1(9Z))</metabolite_name><metabolite_name>Ouabain</metabolite_name><metabolite_name>Leu-Ile</metabolite_name><metabolite_name>Adenosine 5'-diphosphate (ADP)</metabolite_name><metabolite_name>LPC(18:2/0:0)</metabolite_name><metabolite_name>Histidinol</metabolite_name><metabolite_name>Carnosol</metabolite_name><metabolite_name>Ala-Gly</metabolite_name><metabolite_name>PC(P-16:0/0:0)</metabolite_name><metabolite_name>N-Acetylmethionine</metabolite_name><metabolite_name>3-AMINO-2-PIPERIDONE</metabolite_name><metabolite_name>1-Isothiocyanato-8-(methylthio)octane</metabolite_name><metabolite_name>Cellobiose</metabolite_name><metabolite_name>Ala-Glu</metabolite_name><metabolite_name>Pirimicarb</metabolite_name><metabolite_name>Melibiose</metabolite_name><metabolite_name>Anserine</metabolite_name><metabolite_name>Lysyl-Glycine</metabolite_name><metabolite_name>SM(d16:1/24:1(15Z))</metabolite_name><metabolite_name>(Dimethoxymethyl)benzene</metabolite_name><metabolite_name>Ala-Gln</metabolite_name><metabolite_name>Metharbital</metabolite_name><metabolite_name>2-Aminopyridine</metabolite_name><metabolite_name>Flibanserin</metabolite_name><metabolite_name>Dexrazoxane</metabolite_name><metabolite_name>Maltotriose</metabolite_name><metabolite_name>Valproic acid</metabolite_name><metabolite_name>Leptomycin B</metabolite_name><metabolite_name>Anagrelide</metabolite_name><metabolite_name>CDP-Ethanolamine</metabolite_name><metabolite_name>N5-acetyl-l-ornithine</metabolite_name><metabolite_name>5-Hydroxypyrazinamide</metabolite_name><metabolite_name>Dihydrouracil</metabolite_name><metabolite_name>Theaflavin</metabolite_name><metabolite_name>Ranitidine</metabolite_name><metabolite_name>PE(18:4(6Z,9Z,12Z,15Z)/18:0)</metabolite_name><metabolite_name>ISOPALMITIC ACID</metabolite_name><metabolite_name>Nicotinamide</metabolite_name><metabolite_name>L-Valyl-L-phenylalanine</metabolite_name><metabolite_name>Metronidazole</metabolite_name><metabolite_name>Theophylline</metabolite_name><metabolite_name>PC(14:0/14:0)</metabolite_name><metabolite_name>Ferulic acid 4-O-glucuronide</metabolite_name><metabolite_name>7-Ketodeoxycholic acid</metabolite_name><metabolite_name>Turanose</metabolite_name><metabolite_name>PE(18:0/18:2)</metabolite_name><metabolite_name>Picolinic acid</metabolite_name><metabolite_name>Dynasore</metabolite_name><metabolite_name>myo-Inositol</metabolite_name><metabolite_name>Mannitol</metabolite_name><metabolite_name>Pyroglutamic acid</metabolite_name><metabolite_name>Glucose 1-phosphate</metabolite_name><metabolite_name>Uridine 5'-diphosphate (UDP)</metabolite_name><metabolite_name>Betaine aldehyde</metabolite_name><metabolite_name>1-Myristoyl-sn-glycero-3-phosphocholine (LPC(14:0/0:0))</metabolite_name><metabolite_name>Derenofylline</metabolite_name><metabolite_name>Isomaltose</metabolite_name><metabolite_name>pomiferin</metabolite_name><metabolite_name>4-Hydroxybenzyl cyanide</metabolite_name><metabolite_name>EDTA</metabolite_name><metabolite_name>PE(P-18:1(9Z)/20:4(5Z,8Z,11Z,14Z))</metabolite_name><metabolite_name>S-Adenosylmethionine</metabolite_name><metabolite_name>N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide</metabolite_name><metabolite_name>PC(34:4)</metabolite_name><metabolite_name>ADP-ribose</metabolite_name><metabolite_name>Deoxyguanosine</metabolite_name><metabolite_name>Nylidrin</metabolite_name><metabolite_name>S-Acetyldihydrolipoamide-E</metabolite_name><metabolite_name>Allixin</metabolite_name><metabolite_name>(+)-(1R,2R)-1,2-Diphenylethane-1,2-diol</metabolite_name><metabolite_name>Acetylcholine</metabolite_name><metabolite_name>Tauro-beta-muricholic acid</metabolite_name><metabolite_name>Valerylcarnitine</metabolite_name><metabolite_name>Lactate</metabolite_name><metabolite_name>Sph(t18:0)</metabolite_name><metabolite_name>6-Ketoestriol</metabolite_name><metabolite_name>Thymidine</metabolite_name><metabolite_name>2-Hydroxyhexanoic acid</metabolite_name><metabolite_name>Ursodeoxycholic acid</metabolite_name><metabolite_name>Isocaproic acid</metabolite_name><metabolite_name>Pantetheine</metabolite_name><metabolite_name>Malic acid</metabolite_name><metabolite_name>3-Phosphoglyceric acid</metabolite_name><metabolite_name>Proscillaridin A</metabolite_name><metabolite_name>PC(14:0/16:0)</metabolite_name><metabolite_name>Docebenone</metabolite_name><metabolite_name>PE(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))</metabolite_name><metabolite_name>PC(15:0/22:4(7Z,10Z,13Z,16Z))</metabolite_name><metabolite_name>Benzaldehyde</metabolite_name><metabolite_name>Pyrimethamine</metabolite_name><metabolite_name>Cidofovir</metabolite_name><metabolite_name>Maltose</metabolite_name><metabolite_name>Theanine</metabolite_name><metabolite_name>Bufalin</metabolite_name><metabolite_name>3-Methyl-3H-imidazo[4,5-f]quinoxalin-2-amine</metabolite_name><metabolite_name>Prolyl-Histidine</metabolite_name><metabolite_name>Histamine</metabolite_name><metabolite_name>3-Hydorxy-3-methylglutaric acid</metabolite_name><metabolite_name>Furcelleran</metabolite_name><metabolite_name>Oxypurinol</metabolite_name><metabolite_name>Azathioprine</metabolite_name><metabolite_name>Racanisodamine</metabolite_name><metabolite_name>2-Piperidone</metabolite_name><metabolite_name>Diglycine</metabolite_name><metabolite_name>SM(d18:1/22:0)</metabolite_name><metabolite_name>N-Hydroxy-4-aminobiphenyl</metabolite_name><metabolite_name>Prolyl-Threonine</metabolite_name><metabolite_name>Flunarizine</metabolite_name><metabolite_name>Taurodeoxycholic acid</metabolite_name><metabolite_name>1-Methylcytosine</metabolite_name><metabolite_name>4-Aminobutyric acid (GABA)</metabolite_name><metabolite_name>Azelaic acid</metabolite_name><metabolite_name>Proparacaine</metabolite_name><metabolite_name>1-Isothiocyanatobutane</metabolite_name><metabolite_name>1,3-Dimethyluracil</metabolite_name><metabolite_name>N1-Methyl-4-pyridone-3-carboxamide</metabolite_name><metabolite_name>Pyrrolidine</metabolite_name><metabolite_name>cirsimaritin</metabolite_name><metabolite_name>PE(22:2(13Z,16Z)/P-16:0)</metabolite_name><metabolite_name>L-?Leucyl-?L-?alanine</metabolite_name><metabolite_name>Imidazoleacetic acid</metabolite_name><metabolite_name>2,5-Furandicarboxylic acid</metabolite_name><metabolite_name>alpha-(1,2-Dihydroxyethyl)-1,2,3,4-tetrahydro-7-hydroxy-9-methoxy-3,4-dioxocyclopenta[c][1]benzopyran-6-acetaldehyde</metabolite_name><metabolite_name>Deoxycholic acid</metabolite_name><metabolite_name>Ganoderic acid DM</metabolite_name><metabolite_name>Glycodeoxycholic acid</metabolite_name><metabolite_name>Mukoline</metabolite_name><metabolite_name>Phe-Ala</metabolite_name><metabolite_name>Daidzein</metabolite_name></additional><is_claimable>false</is_claimable><name>Non-targeted LC–MS metabolomics of human left atrial appendage tissue with high vs low myocardial micro(nano)plastic burden</name><description>&lt;p>Non-targeted metabolomics profiling was performed on human left atrial appendage tissue obtained from cardiac surgery patients. Samples were grouped by myocardial nanoplastic (NP) burden (High vs Low). Polar metabolites were analyzed by UHPLC–Orbitrap MS in both positive and negative ionization modes. Derived spectral data are provided as mzXML files for each sample and 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