<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/MTBLS14016/m_MTBLS14016_LC-MS_negative__metabolite_profiling_v2_maf.tsv</Tabular><Tabular>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14016/m_MTBLS14016_LC-MS_positive__metabolite_profiling_v2_maf.tsv</Tabular><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14016/i_Investigation.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14016/a_MTBLS14016_LC-MS_negative__metabolite_profiling.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14016/s_MTBLS14016.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14016/a_MTBLS14016_LC-MS_positive__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/MTBLS14016</ftp_download_link><metabolite_identification_protocol>&lt;p>Metabolite profiling was conducted using Metware's widely-targeted metabolomics technology, which combines high-resolution mass spectrometry (HRMS) for broad-spectrum metabolite identification with triple quadrupole mass spectrometry operating in multiple reaction monitoring (MRM) mode for precise quantification. Identification was achieved by matching the acquired MS/MS spectra against Metware's self-built standard database (MWDB) containing over 2,000 authentic compounds for human endogenous metabolites, based on accurate precursor mass (&amp;lt;5 ppm), retention time alignment with standards, MS/MS fragmentation patterns, and isotopic distribution. Quality control samples were analyzed throughout to ensure data reliability.&lt;/p></metabolite_identification_protocol><repository>MetaboLights</repository><study_status>Public</study_status><ptm_modification></ptm_modification><instrument_platform>Liquid Chromatography MS - positive</instrument_platform><instrument_platform>Liquid Chromatography MS - negative</instrument_platform><chromatography_protocol>&lt;p>Chromatographic separation was performed on a Waters ACQUITY UPLC HSS T3 C18 column (1.8 μm, 2.1 × 100 mm, Waters, Milford, MA, USA) using an ExionLC AD system (Sciex, Framingham, MA, USA). The mobile phase consisted of (A) ultrapure water with 0.1% formic acid and (B) acetonitrile with 0.1% formic acid. The gradient elution was programmed as follows: 0 min, 95:5 (A:B, v/v); 2.0 min, 80:20; 5.0 min, 40:60; 6.0 min, 1:99; 7.5 min, 1:99; 7.6 min, 95:5; and 10.0 min, 95:5. The flow rate was 0.4 mL/min, the column temperature was maintained at 40 °C, and the injection volume was 2 μL.&lt;/p></chromatography_protocol><publication>Please update the publication title.</publication><submitter_affiliation>SpecAlly Life Technology Co., Ltd.</submitter_affiliation><submitter_name>Siqi Luo</submitter_name><organism_part>blood plasma</organism_part><organism_part>blood serum</organism_part><technology_type>mass spectrometry assay</technology_type><disease></disease><extraction_protocol>&lt;p _msttexthash='32273813' _msthash='715'>Serum samples were thawed on ice and vortexed for 10 s. A 50 μL aliquot was mixed with 300 μL of extraction solution (acetonitrile:methanol = 1:4, v/v) containing internal standards. After vortexing for 3 min, the mixture was centrifuged at 12,000 rpm for 10 min at 4 °C. Then, 200 μL of supernatant was transferred to a new tube, maintained at −20 °C for 30 min, and centrifuged again at 12,000 rpm for 3 min at 4 °C. Finally, 180 μL of supernatant was collected for LC-MS analysis.&lt;/p></extraction_protocol><organism>Homo sapiens</organism><full_dataset_link>https://www.ebi.ac.uk/metabolights/MTBLS14016</full_dataset_link><author>Mao Enqiang. Ruijin Hospital, Shanghai Jiao Tong University School of Medicine. maoeq@yeah.net.</author><author>Luo Siqi. luosiqi86@163.com.</author><data_transformation_protocol>&lt;p>Mass spectrometric detection was conducted on a QTRAP® instrument (Sciex) equipped with an electrospray ionization (ESI) source. The ESI parameters were set as follows: source temperature 500 °C; ion spray voltage 5500 V (positive) and −4500 V (negative); ion source gas I, gas II, and curtain gas at 55, 60 and 25 psi, respectively; collision gas set to high. Instrument calibration was performed using 10 and 100 μmol/L polypropylene glycol solutions. Specific MRM transitions were monitored for each metabolite according to their elution period.&lt;/p></data_transformation_protocol><study_factor>Bacterial type</study_factor><submitter_email>luosiqi86@163.com</submitter_email><sample_collection_protocol>&lt;p _msttexthash='32273813' _msthash='652'>Serum samples were collected at the time of sepsis diagnosis. Residual blood samples from routine clinical testing were used to minimize additional invasive procedures. Blood smears were prepared for microbiological confirmation of CRKP or CSKP. Serum was separated and aliquoted for storage at -80 °C to preserve sample integrity for subsequent multi-omics analyses&lt;/p></sample_collection_protocol><omics_type>Metabolomics</omics_type><study_design>Metabolomics</study_design><study_design>Carbapenem-Resistant Klebsiella pneumoniae</study_design><study_design>Sepsis</study_design><curator_keywords>Metabolomics</curator_keywords><curator_keywords>Carbapenem-Resistant Klebsiella pneumoniae</curator_keywords><curator_keywords>Sepsis</curator_keywords><mass_spectrometry_protocol>&lt;p>The sample extracts were analyzed using an LC-ESI-MS/MS system (UPLC, ExionLC AD, https://sciex.com.cn/; MS, QTRAP® System, https://sciex.com/). Chromatographic separation was performed on a Waters ACQUITY UPLC HSS T3 C18 column (1.8 μm, 2.1 × 100 mm) using an ExionLC AD system (Sciex). The mobile phase consisted of (A) ultrapure water with 0.1% formic acid and (B) acetonitrile with 0.1% formic acid. The gradient elution was as follows: 0 min, 95:5 (A:B, v/v); 2.0 min, 80:20; 5.0 min, 40:60; 6.0 min, 1:99; 7.5 min, 1:99; 7.6 min, 95:5; and 10.0 min, 95:5. The flow rate was 0.4 mL/min, column temperature was maintained at 40 °C, and the injection volume was 2 μL.&lt;/p></mass_spectrometry_protocol><metabolite_name>N1,N8-diacetylspermidine</metabolite_name><metabolite_name>N'-Methyl-2-pyridone-5-carboxamide</metabolite_name><metabolite_name>2'-O-methylcytidine</metabolite_name><metabolite_name>Ile-Thr</metabolite_name><metabolite_name>4-toluenesulfonic acid</metabolite_name><metabolite_name>Corticosterone</metabolite_name><metabolite_name>Carnitine C14:2:DC</metabolite_name><metabolite_name>Phe-Ile</metabolite_name><metabolite_name>Ectoine</metabolite_name><metabolite_name>Dl-3,4-Dihydroxymandelic Acid</metabolite_name><metabolite_name>Trp-Val</metabolite_name><metabolite_name>8,8a-deoxy-oleane</metabolite_name><metabolite_name>Pantothenol</metabolite_name><metabolite_name>2-hydroxyphenylacetic acid</metabolite_name><metabolite_name>Ketoleucine</metabolite_name><metabolite_name>L-Allothreonine</metabolite_name><metabolite_name>3-Methylcrotonyl Glycine</metabolite_name><metabolite_name>Proline-Hydroxyproline</metabolite_name><metabolite_name>9(S),12(S),13(S)-TriHOME</metabolite_name><metabolite_name>AA</metabolite_name><metabolite_name>Iminodiacetic acid</metabolite_name><metabolite_name>LPC(18:1/0:0)</metabolite_name><metabolite_name>Rhamnonic acid</metabolite_name><metabolite_name>Thymoquinone</metabolite_name><metabolite_name>Methanesulfonic acid</metabolite_name><metabolite_name>N-acetyl-5-aminosalicylic acid</metabolite_name><metabolite_name>3-Hydroxyanthranilic Acid</metabolite_name><metabolite_name>Carnitine C15:DC</metabolite_name><metabolite_name>5-Hydroxy-2'-deoxyuridine</metabolite_name><metabolite_name>PGF3¦Á</metabolite_name><metabolite_name>Gly-Glu</metabolite_name><metabolite_name>Gly-Gln</metabolite_name><metabolite_name>N-Ethylglycine</metabolite_name><metabolite_name>N-Methylisoleucine</metabolite_name><metabolite_name>(¡À)18-HEPE</metabolite_name><metabolite_name>DHA</metabolite_name><metabolite_name>4-Hydroxybenzaldehyde</metabolite_name><metabolite_name>4-hydroxyphenylglyoxylate</metabolite_name><metabolite_name>FFA(16:4)</metabolite_name><metabolite_name>2-Methyl-1-Pyrroline</metabolite_name><metabolite_name>Carnitine C6-OH</metabolite_name><metabolite_name>Jasmone</metabolite_name><metabolite_name>CMPentylF</metabolite_name><metabolite_name>Ala-Phe</metabolite_name><metabolite_name>Hydroumbellic acid</metabolite_name><metabolite_name>L-Theanine</metabolite_name><metabolite_name>N-Phenylacetylglycine</metabolite_name><metabolite_name>Hydroferulic acid</metabolite_name><metabolite_name>1-Methylpiperidine-2-carboxylic acid</metabolite_name><metabolite_name>Carnitine ph-C1</metabolite_name><metabolite_name>Arachidonoyl LPA</metabolite_name><metabolite_name>Piperonylic acid</metabolite_name><metabolite_name>Aldehydo-D-altrose</metabolite_name><metabolite_name>Met-Glu</metabolite_name><metabolite_name>Hexadecylamine</metabolite_name><metabolite_name>LPE(17:0/0:0)</metabolite_name><metabolite_name>Gly-Phe-Phe</metabolite_name><metabolite_name>Proline betaine</metabolite_name><metabolite_name>3-(3-Hydroxyphenyl)Propionate Acid</metabolite_name><metabolite_name>MG(18:1/0:0/0:0)</metabolite_name><metabolite_name>1,4-Dihydro-1-Methyl-4-Oxo-3-Pyridinecarboxamide</metabolite_name><metabolite_name>LPC(20:4/0:0)</metabolite_name><metabolite_name>3-(2-Hydroxyphenyl)propanoic acid</metabolite_name><metabolite_name>Isokaurenoic acid</metabolite_name><metabolite_name>4-Amino-5-hydroxymethyl-2-methylpyrimidine</metabolite_name><metabolite_name>14(S)-HDHA</metabolite_name><metabolite_name>Pro-Glu</metabolite_name><metabolite_name>Pantothenic acid</metabolite_name><metabolite_name>Indoxylsulfuric acid</metabolite_name><metabolite_name>Salicylaldehyde</metabolite_name><metabolite_name>Glycochenodeoxycholic acid 7-sulfate</metabolite_name><metabolite_name>2-((2-(2-Hydroxyethoxy)-4-nitrophenyl)amino)ethanol</metabolite_name><metabolite_name>Sn-Glycero-3-Phosphocholine</metabolite_name><metabolite_name>Carnitine C8-OH</metabolite_name><metabolite_name>7-Ketocholesterol</metabolite_name><metabolite_name>Dodecanedioic Acid</metabolite_name><metabolite_name>Aspartic Acid</metabolite_name><metabolite_name>L-Ornithine</metabolite_name><metabolite_name>FFA(16:2)</metabolite_name><metabolite_name>Indoleacetaldehyde</metabolite_name><metabolite_name>Trp-Ile</metabolite_name><metabolite_name>Carnitine C18:0</metabolite_name><metabolite_name>Phe-Gly</metabolite_name><metabolite_name>Carnitine C18:4</metabolite_name><metabolite_name>N-¦Ã-Acetyl-N-2-Formyl-5-Methoxykynurenamine</metabolite_name><metabolite_name>Carnitine C18:3</metabolite_name><metabolite_name>Carnitine C18:2</metabolite_name><metabolite_name>Carnitine C18:1</metabolite_name><metabolite_name>Acetylvaline</metabolite_name><metabolite_name>LPA(0:0/16:0)</metabolite_name><metabolite_name>Cyclic Amp</metabolite_name><metabolite_name>Ile-Gln</metabolite_name><metabolite_name>Glyceric Acid</metabolite_name><metabolite_name>4-Methylhippuric Acid</metabolite_name><metabolite_name>Dl-2-Aminooctanoic Acid</metabolite_name><metabolite_name>N(Alpha)-Acetyl-Epsilon-(2-Propenal)Lysine</metabolite_name><metabolite_name>FFA(16:3)</metabolite_name><metabolite_name>7,8,4'-Trihydroxyisoflavone</metabolite_name><metabolite_name>2,4-Quinolinediol</metabolite_name><metabolite_name>LPC(22:5/0:0)</metabolite_name><metabolite_name>Methylguanidine</metabolite_name><metabolite_name>LPE(0:0/18:1)</metabolite_name><metabolite_name>2-Aminoisobutyric Acid</metabolite_name><metabolite_name>¦Ä-Valerolactam</metabolite_name><metabolite_name>LPA(22:6)</metabolite_name><metabolite_name>2-Pentadecanone</metabolite_name><metabolite_name>Androstenedione</metabolite_name><metabolite_name>Uridine 5-Monophosphate</metabolite_name><metabolite_name>Carnitine C3:1-2OH</metabolite_name><metabolite_name>3-Methyladenine</metabolite_name><metabolite_name>LPC(13:0/0:0)</metabolite_name><metabolite_name>Indole</metabolite_name><metabolite_name>LPE(P-16:0)</metabolite_name><metabolite_name>L-2-amino-6-oximelic acid</metabolite_name><metabolite_name>Phe-Thr</metabolite_name><metabolite_name>Ile-Glu</metabolite_name><metabolite_name>Isocitric acid</metabolite_name><metabolite_name>Glu-Met</metabolite_name><metabolite_name>Tyr-Gly</metabolite_name><metabolite_name>3-Methyloxindole</metabolite_name><metabolite_name>LPE(0:0/18:2)</metabolite_name><metabolite_name>DL-3,4-Dihydroxyphenyl glycol</metabolite_name><metabolite_name>Cyclo(Pro-Leu)</metabolite_name><metabolite_name>Tagatose</metabolite_name><metabolite_name>LPG(16:0)</metabolite_name><metabolite_name>2,6,6-Trimethyl-2-cyclohexene-1,4-dione</metabolite_name><metabolite_name>Inosine diphosphate</metabolite_name><metabolite_name>L-Thyroxine</metabolite_name><metabolite_name>Dihydroactinidiolide</metabolite_name><metabolite_name>Isogalactinol</metabolite_name><metabolite_name>Uric acid</metabolite_name><metabolite_name>FFA(16:1)</metabolite_name><metabolite_name>1,3,7-Trimethyluric Acid</metabolite_name><metabolite_name>2-Hydroxycinnamic acid</metabolite_name><metabolite_name>Pro-Ile</metabolite_name><metabolite_name>Glycoursodeoxycholic Acid</metabolite_name><metabolite_name>Carnitine C18:1-OH</metabolite_name><metabolite_name>LPE(0:0/18:3)</metabolite_name><metabolite_name>LPC(0:0/17:0)</metabolite_name><metabolite_name>1-Aminocyclobutanecarboxylic acid</metabolite_name><metabolite_name>LPG(16:1)</metabolite_name><metabolite_name>1-desoxymethylsphinganine</metabolite_name><metabolite_name>Melatonin</metabolite_name><metabolite_name>Trp-Glu</metabolite_name><metabolite_name>5-Methylcytosine</metabolite_name><metabolite_name>2-hydroxypentanedioic acid</metabolite_name><metabolite_name>2-pyrimidin-2-yl-propionic acid</metabolite_name><metabolite_name>1-Hydroxylamino-2-phenylethane</metabolite_name><metabolite_name>Trp-Gly</metabolite_name><metabolite_name>Guanidinoethyl Sulfonate</metabolite_name><metabolite_name>Traumatic acid</metabolite_name><metabolite_name>Tetradecanedioic acid</metabolite_name><metabolite_name>3,3',5-Triiodo-L-Thyronine</metabolite_name><metabolite_name>S1P(d16:1)</metabolite_name><metabolite_name>CAP-palmitate</metabolite_name><metabolite_name>L-Citronellol</metabolite_name><metabolite_name>Carnitine C4-OH</metabolite_name><metabolite_name>DL-O-tyrosine</metabolite_name><metabolite_name>S-Allyl-L-cysteine</metabolite_name><metabolite_name>2-Amino-4,6-pteridinediol</metabolite_name><metabolite_name>Carnitine C9:1-OH</metabolite_name><metabolite_name>Carnitine C3:0</metabolite_name><metabolite_name>Hexylresorcinol</metabolite_name><metabolite_name>Ile-Ile</metabolite_name><metabolite_name>Lys-Leu</metabolite_name><metabolite_name>Ethyl-dodecanoate</metabolite_name><metabolite_name>gamma-Glu-Phe</metabolite_name><metabolite_name>His-Ser</metabolite_name><metabolite_name>SPH(d18:2)</metabolite_name><metabolite_name>Dehydroepiandrosterone sulfate</metabolite_name><metabolite_name>2-Thio-PAF</metabolite_name><metabolite_name>Lysine</metabolite_name><metabolite_name>3-Indolebutyric Acid</metabolite_name><metabolite_name>Urocanic Acid</metabolite_name><metabolite_name>4-Methyl-3-nitroaniline</metabolite_name><metabolite_name>Trehalose</metabolite_name><metabolite_name>Succinic anhydride</metabolite_name><metabolite_name>Lys-Asn</metabolite_name><metabolite_name>Guanine</metabolite_name><metabolite_name>Quinmerac</metabolite_name><metabolite_name>2-Naphthol</metabolite_name><metabolite_name>Leu-Met</metabolite_name><metabolite_name>Antineoplaston A10</metabolite_name><metabolite_name>3-Methoxysalicylic Acid</metabolite_name><metabolite_name>SPH(d18:1)</metabolite_name><metabolite_name>N-Acetyl-L-Tyrosine</metabolite_name><metabolite_name>LPC(16:0/0:0)</metabolite_name><metabolite_name>N-Acetylglucosamine 1-Phosphate</metabolite_name><metabolite_name>10-Hydroxy-2-Decenoic Acid</metabolite_name><metabolite_name>Taurolithocholic acid</metabolite_name><metabolite_name>Indole-3-Carboxaldehyde</metabolite_name><metabolite_name>Acetanilide</metabolite_name><metabolite_name>Carnitine C20:1</metabolite_name><metabolite_name>7-Methylguanine</metabolite_name><metabolite_name>SPH(d18:0)</metabolite_name><metabolite_name>1-Methyladenine</metabolite_name><metabolite_name>Carnitine C20:4</metabolite_name><metabolite_name>Carnitine C20:3</metabolite_name><metabolite_name>Carnitine C20:2</metabolite_name><metabolite_name>8-Methylnonenoate</metabolite_name><metabolite_name>2-Undecanone</metabolite_name><metabolite_name>5,6-Dihydrouridine</metabolite_name><metabolite_name>Carnitine C14:2-OH</metabolite_name><metabolite_name>FFA(14:0)</metabolite_name><metabolite_name>5,6-Dihydro-5-Methyluracil</metabolite_name><metabolite_name>13(R)-HODE</metabolite_name><metabolite_name>Phe-Val</metabolite_name><metabolite_name>Multifidol</metabolite_name><metabolite_name>5-Methoxytryptophan</metabolite_name><metabolite_name>TXB2</metabolite_name><metabolite_name>2-(2-Propynyloxy)-benzenehexanoic acid</metabolite_name><metabolite_name>S-Sulfo-L-Cysteine</metabolite_name><metabolite_name>2'-Deoxyuridine</metabolite_name><metabolite_name>Carnitine C5:1</metabolite_name><metabolite_name>Carnitine C5:0</metabolite_name><metabolite_name>Orotidine</metabolite_name><metabolite_name>FFA(9:0)</metabolite_name><metabolite_name>2-Methylglutaric Acid</metabolite_name><metabolite_name>Glycochenodeoxycholic Acid</metabolite_name><metabolite_name>FFA(14:1)</metabolite_name><metabolite_name>5-nitrobenzimidazole</metabolite_name><metabolite_name>LPE(P-18:1)</metabolite_name><metabolite_name>Indole 3-carbinol</metabolite_name><metabolite_name>S-Methyl-L-Cysteine-S-oxide</metabolite_name><metabolite_name>Asp-Phe</metabolite_name><metabolite_name>Cyclo(Ala-Pro)</metabolite_name><metabolite_name>4-Hydroxyhippurate</metabolite_name><metabolite_name>Geranic acid</metabolite_name><metabolite_name>Propofol Glucuronide</metabolite_name><metabolite_name>Quinoline-2-carboxylic acid</metabolite_name><metabolite_name>Monobutyl phthalate</metabolite_name><metabolite_name>LPC(0:0/15:0)</metabolite_name><metabolite_name>6-aminonicotinamide</metabolite_name><metabolite_name>2,4-Dihydroxypteridine</metabolite_name><metabolite_name>Guanidine</metabolite_name><metabolite_name>L-Cysteic acid</metabolite_name><metabolite_name>Glutathione Oxidized</metabolite_name><metabolite_name>Myoinositol</metabolite_name><metabolite_name>L-Tryptophanamide</metabolite_name><metabolite_name>LPA(16:1)</metabolite_name><metabolite_name>Dibutyl-phthalate</metabolite_name><metabolite_name>LPE(0:0/16:0)</metabolite_name><metabolite_name>Octadec-9-ene-1,18-dioic-acid</metabolite_name><metabolite_name>Carnitine C16:1-2OH</metabolite_name><metabolite_name>Chrysin-7-O-glucuronide</metabolite_name><metabolite_name>Thymine</metabolite_name><metabolite_name>DL-Leucine</metabolite_name><metabolite_name>TriacetonaMine</metabolite_name><metabolite_name>2-(Acetylamino)-2-deoxy-A-D-glucopyranose</metabolite_name><metabolite_name>4-Hydroxy-2-Oxoglutaric Acid</metabolite_name><metabolite_name>1-Methyladenosine</metabolite_name><metabolite_name>LPS(20:0)</metabolite_name><metabolite_name>Glycohyocholic acid</metabolite_name><metabolite_name>2-Hydroxy-3,4-dimethoxybenzoic acid</metabolite_name><metabolite_name>N(6),N(6)-Dimethyl-L-lysine</metabolite_name><metabolite_name>Trolox</metabolite_name><metabolite_name>LPE(0:0/16:1)</metabolite_name><metabolite_name>9,10-DiHOME</metabolite_name><metabolite_name>Sarcosine</metabolite_name><metabolite_name>2-Hydroxy-4-(methylthio)butyric acid</metabolite_name><metabolite_name>N-Alpha-Acetyl-L-Asparagine</metabolite_name><metabolite_name>Heparin</metabolite_name><metabolite_name>Pinolenic acid</metabolite_name><metabolite_name>N-Palmitoylglycine</metabolite_name><metabolite_name>Sorbitol</metabolite_name><metabolite_name>Taurine</metabolite_name><metabolite_name>1-Naphthol</metabolite_name><metabolite_name>Propyrazol</metabolite_name><metabolite_name>1-Deoxyvaleric acid</metabolite_name><metabolite_name>LPC(17:2/0:0)</metabolite_name><metabolite_name>12-ketolithocholic acid</metabolite_name><metabolite_name>Ochratoxin A</metabolite_name><metabolite_name>Lithocholic acid</metabolite_name><metabolite_name>LPC(O-18:2)</metabolite_name><metabolite_name>Met-Trp</metabolite_name><metabolite_name>FFA(22:6)</metabolite_name><metabolite_name>3-Carboxypropyltrimethylammonium</metabolite_name><metabolite_name>Isopropyl 3-(3,4-dihydroxyphenyl)-2-hydroxypropanoate</metabolite_name><metabolite_name>Carnitine C12:1</metabolite_name><metabolite_name>2-Hydroxyethanesulfonate</metabolite_name><metabolite_name>L-Threonine</metabolite_name><metabolite_name>Carnitine C12:0</metabolite_name><metabolite_name>Carnitine C16:1-OH</metabolite_name><metabolite_name>Tridecanedioic acid</metabolite_name><metabolite_name>Gln-Gly</metabolite_name><metabolite_name>Carnitine C12:3</metabolite_name><metabolite_name>3-Amino-4-Hydroxybenzoic Acid</metabolite_name><metabolite_name>Agmatine</metabolite_name><metabolite_name>6-hydroxy-3-succinylpyridine</metabolite_name><metabolite_name>4-Aminophenol</metabolite_name><metabolite_name>Trigonelline</metabolite_name><metabolite_name>3-Ureidopropionate</metabolite_name><metabolite_name>N-Acetyl-Asp-Glu</metabolite_name><metabolite_name>LPC(16:1/0:0)</metabolite_name><metabolite_name>Leu-Leu-Leu</metabolite_name><metabolite_name>LPE(0:0/14:0)</metabolite_name><metabolite_name>Apocholic acid</metabolite_name><metabolite_name>11,12-EET</metabolite_name><metabolite_name>S1P(d18:2)</metabolite_name><metabolite_name>(E)-Guggulsterone</metabolite_name><metabolite_name>Oxaloacetic acid</metabolite_name><metabolite_name>LPC(20:2/0:0)</metabolite_name><metabolite_name>N-Propionylglycine</metabolite_name><metabolite_name>LPC(O-18:3)</metabolite_name><metabolite_name>FFA(22:7)</metabolite_name><metabolite_name>Ribonic acid</metabolite_name><metabolite_name>Meestrol</metabolite_name><metabolite_name>N6-Succinyl Adenosine</metabolite_name><metabolite_name>Carnitine C15</metabolite_name><metabolite_name>9-Fluorenone</metabolite_name><metabolite_name>FFA(12:0)</metabolite_name><metabolite_name>2-Naphthalenesulfonic acid</metabolite_name><metabolite_name>(R)-2-Hydroxy-3-phenylpropionic acid</metabolite_name><metabolite_name>2-(10-Heptadecenyl)-6-hydroxybenzoic acid</metabolite_name><metabolite_name>Val-Ile</metabolite_name><metabolite_name>LPC(0:0/22:6)</metabolite_name><metabolite_name>20-COOH-AA</metabolite_name><metabolite_name>Ammelide</metabolite_name><metabolite_name>Carnitine C6:1</metabolite_name><metabolite_name>L-Tryptophan</metabolite_name><metabolite_name>3-Hydroxyhippuric Acid</metabolite_name><metabolite_name>Carnitine C6:0</metabolite_name><metabolite_name>Triethanolamine</metabolite_name><metabolite_name>LPC(15:0/0:0)</metabolite_name><metabolite_name>FFA(22:4)</metabolite_name><metabolite_name>4-Guanidinobutyric Acid</metabolite_name><metabolite_name>8,15-DiHETE</metabolite_name><metabolite_name>Indole-4-carboxaldehyde</metabolite_name><metabolite_name>9(S)-HOTrE</metabolite_name><metabolite_name>Cholesterol</metabolite_name><metabolite_name>FFA(22:5)</metabolite_name><metabolite_name>2-Hydroxy-6-Aminopurine</metabolite_name><metabolite_name>L-2-Aminobutyric acid</metabolite_name><metabolite_name>Testosterone</metabolite_name><metabolite_name>O-Desmethylnaproxen</metabolite_name><metabolite_name>D-Ribono-1,4-lactone</metabolite_name><metabolite_name>Asn-Trp</metabolite_name><metabolite_name>Hexaethylene-glycol</metabolite_name><metabolite_name>2-methyl citric acid</metabolite_name><metabolite_name>L-Valine</metabolite_name><metabolite_name>Uracil</metabolite_name><metabolite_name>Tryptamine</metabolite_name><metabolite_name>2-Hydroxy-4-methylpentanoic acid</metabolite_name><metabolite_name>3-Indolepropionic Acid</metabolite_name><metabolite_name>2-Amino-4-methylphenol</metabolite_name><metabolite_name>LPE(0:0/22:6)</metabolite_name><metabolite_name>N-Acetylaminooctanoic acid</metabolite_name><metabolite_name>Creatine</metabolite_name><metabolite_name>1-Methyl-hydantoin</metabolite_name><metabolite_name>DL-Homocysteine</metabolite_name><metabolite_name>N,N-Bis(2-hydroxyethyl)dodecanamide</metabolite_name><metabolite_name>Carnitine C10:0</metabolite_name><metabolite_name>o-Methoxyphenyl sulfate</metabolite_name><metabolite_name>Carnitine C10:2</metabolite_name><metabolite_name>Hippuric Acid</metabolite_name><metabolite_name>Carnitine C10:1</metabolite_name><metabolite_name>Biotinamide</metabolite_name><metabolite_name>Cytosine</metabolite_name><metabolite_name>Sedoheptulose 7-Phosphate</metabolite_name><metabolite_name>Tyr-Asp</metabolite_name><metabolite_name>LPC(0:0/12:0)</metabolite_name><metabolite_name>Aleuritic Acid</metabolite_name><metabolite_name>L-Cystine</metabolite_name><metabolite_name>3-(pyrazol-1-yl)-L-alanine</metabolite_name><metabolite_name>Succinic Acid</metabolite_name><metabolite_name>Hydroxyquinoline</metabolite_name><metabolite_name>LPC(0:0/22:5)</metabolite_name><metabolite_name>3-Bromotyrosine</metabolite_name><metabolite_name>9(S)-HODE</metabolite_name><metabolite_name>3,6,9,12,15,18,21-Heptaoxatricosane-21,23-diol</metabolite_name><metabolite_name>Carnitine C11:DC</metabolite_name><metabolite_name>3-(Methylthio)-1-propanol</metabolite_name><metabolite_name>5-Hydroxyisourate</metabolite_name><metabolite_name>Carnitine C8:1</metabolite_name><metabolite_name>21-Deoxycortisol</metabolite_name><metabolite_name>Carnitine C8:0</metabolite_name><metabolite_name>Carnitine ph-C14</metabolite_name><metabolite_name>gamma-Glu-Ala</metabolite_name><metabolite_name>Hydroxyurea</metabolite_name><metabolite_name>4-Methoxysalicylic Acid</metabolite_name><metabolite_name>N-Acetyl-L-Leucine</metabolite_name><metabolite_name>S1P(d18:1)</metabolite_name><metabolite_name>Hypaphorine</metabolite_name><metabolite_name>Pyrrole-2-Carboxylic Acid</metabolite_name><metabolite_name>11¦Â-Prostaglandin F2¦Á</metabolite_name><metabolite_name>LPC(18:0/0:0)</metabolite_name><metabolite_name>LPC(O-18:0)</metabolite_name><metabolite_name>LPE(20:5/0:0)</metabolite_name><metabolite_name>Nicotinuric Acid</metabolite_name><metabolite_name>Ser-Pro</metabolite_name><metabolite_name>Quinolinic acid</metabolite_name><metabolite_name>3-phenylphenol</metabolite_name><metabolite_name>Met-Asp</metabolite_name><metabolite_name>¦Ã-Glu-Gln</metabolite_name><metabolite_name>Prostaglandin F2¦Á</metabolite_name><metabolite_name>Glycohyodeoxycholic acid</metabolite_name><metabolite_name>His-Trp</metabolite_name><metabolite_name>L-Homocystine</metabolite_name><metabolite_name>S-(5-Adenosy)-L-Homocysteine</metabolite_name><metabolite_name>N,N-Dimethylglycine</metabolite_name><metabolite_name>9,10-Epoxy-18-hydroxyoctadecanoic acid</metabolite_name><metabolite_name>Canrenone</metabolite_name><metabolite_name>2-Methylhippuric acid</metabolite_name><metabolite_name>2-Octanamidoacetic acid</metabolite_name><metabolite_name>Lys-Met</metabolite_name><metabolite_name>2-Hydroxy-3-Methyl Butanoic Acid</metabolite_name><metabolite_name>Fructose</metabolite_name><metabolite_name>(¡À)11(12)-DiHET</metabolite_name><metabolite_name>Cyromazine</metabolite_name><metabolite_name>FAHFA(8:0/10:0)</metabolite_name><metabolite_name>Norepinephrine</metabolite_name><metabolite_name>LPE(16:1/0:0)</metabolite_name><metabolite_name>N-Acetylaspartate</metabolite_name><metabolite_name>cis-EODA</metabolite_name><metabolite_name>Asp-Leu</metabolite_name><metabolite_name>3-Hydroxyphenylacetic acid</metabolite_name><metabolite_name>N-Acetyl-L-phenylalanine</metabolite_name><metabolite_name>FFA(10:0)</metabolite_name><metabolite_name>Androstenediol</metabolite_name><metabolite_name>Hydroxypiperazic acid</metabolite_name><metabolite_name>(R)-(-)-Mandelic acid</metabolite_name><metabolite_name>p-Cresol glucuronide</metabolite_name><metabolite_name>Trp-Leu</metabolite_name><metabolite_name>N¦Á-Acetyl-L-Arginine</metabolite_name><metabolite_name>Histidine</metabolite_name><metabolite_name>16-Hydroxyhexadecanoic acid</metabolite_name><metabolite_name>Imidazole-4-methanol</metabolite_name><metabolite_name>Carnitine C16:2</metabolite_name><metabolite_name>Thr-Arg</metabolite_name><metabolite_name>Diethylstilbestrol</metabolite_name><metabolite_name>Carnitine C16:1</metabolite_name><metabolite_name>3,5-Dihydroxybenzoic acid</metabolite_name><metabolite_name>Carnitine C16:0</metabolite_name><metabolite_name>FFA(20:4)</metabolite_name><metabolite_name>Aconitic Acid</metabolite_name><metabolite_name>Carnitine C16:3</metabolite_name><metabolite_name>D-Erythronolactone</metabolite_name><metabolite_name>2-Amino-3-phosphonopropionic acid</metabolite_name><metabolite_name>LPC(18:4/0:0)</metabolite_name><metabolite_name>FFA(10:1)</metabolite_name><metabolite_name>L-Citrulline</metabolite_name><metabolite_name>Carnitine C16-OH</metabolite_name><metabolite_name>alpha-Asarone</metabolite_name><metabolite_name>2-ethyl-2-hydroxybutyric acid</metabolite_name><metabolite_name>12-Hydroxydodecanoic acid</metabolite_name><metabolite_name>Gly-Val</metabolite_name><metabolite_name>N-Acetyl-D-Tryptophan</metabolite_name><metabolite_name>cyclo(leu-phe)</metabolite_name><metabolite_name>Ser-Ala</metabolite_name><metabolite_name>Diglycidyl-resorcinol</metabolite_name><metabolite_name>(3-Methoxy-4-hydroxyphenyl)ethylene glycol sulfate</metabolite_name><metabolite_name>3-Methoxyphenylacetic acid</metabolite_name><metabolite_name>N4-Acetylcytidine</metabolite_name><metabolite_name>4-Hydroxy-3-methoxybenzaldehyde</metabolite_name><metabolite_name>2-amino-4-oxovaleric acid</metabolite_name><metabolite_name>Ergothioneine</metabolite_name><metabolite_name>Ala-Ser</metabolite_name><metabolite_name>Losartan carboxylic acid</metabolite_name><metabolite_name>Tripropylamine</metabolite_name><metabolite_name>His-Phe-Ala</metabolite_name><metabolite_name>LPE(0:0/22:4)</metabolite_name><metabolite_name>O-Phospho-L-Serine</metabolite_name><metabolite_name>Cyclo(his-pro)</metabolite_name><metabolite_name>Ethionamide</metabolite_name><metabolite_name>2-Hydroxy-4-methylbenzaldehyde</metabolite_name><metabolite_name>Asn-Pro</metabolite_name><metabolite_name>1,4-Cyclohexanedicarboxylic acid</metabolite_name><metabolite_name>LPC(0:0/20:4)</metabolite_name><metabolite_name>Protocatechuic Acid</metabolite_name><metabolite_name>4-Hydroxy-3-methylbenzoic acid</metabolite_name><metabolite_name>FFA(20:2)</metabolite_name><metabolite_name>Arg-Leu</metabolite_name><metabolite_name>6¦Â-hydroxytestosterone</metabolite_name><metabolite_name>Hydroxyphenyllactic acid</metabolite_name><metabolite_name>4-Hydroxybenzoic Acid</metabolite_name><metabolite_name>N,N¡ä-dicyclohexylcarbodiimide</metabolite_name><metabolite_name>Salicylic acid</metabolite_name><metabolite_name>Erythrose</metabolite_name><metabolite_name>(R)-3-Hydroxy-tetradecanoic acid</metabolite_name><metabolite_name>2,4-diacetamino-2,4,6-triphenoxy-D-mannopyranose</metabolite_name><metabolite_name>Ile-Met</metabolite_name><metabolite_name>LPE(0:0/22:5)</metabolite_name><metabolite_name>Xanthine</metabolite_name><metabolite_name>Glu-Phe-Ala</metabolite_name><metabolite_name>Marmesin</metabolite_name><metabolite_name>(R)-(-)-2-Phenylglycinol</metabolite_name><metabolite_name>LPC(0:0/20:5)</metabolite_name><metabolite_name>L-Glutamine</metabolite_name><metabolite_name>Di-n-propyl-phthalate</metabolite_name><metabolite_name>Choline</metabolite_name><metabolite_name>Heptethylene-glycol</metabolite_name><metabolite_name>His-Leu</metabolite_name><metabolite_name>Val-Thr</metabolite_name><metabolite_name>3-(2-Naphthyl)-L-alanine</metabolite_name><metabolite_name>SDMA</metabolite_name><metabolite_name>Flavanone</metabolite_name><metabolite_name>Carnitine C10:1-OH</metabolite_name><metabolite_name>1-Aminopropan-2-ol</metabolite_name><metabolite_name>L-Isoleucine</metabolite_name><metabolite_name>3-hydroxyhexadecanoic acid</metabolite_name><metabolite_name>1-pyrroline-4-hydroxy-2-carboxylate</metabolite_name><metabolite_name>2-(((2-Ethylhexyl)oxy)carbonyl)benzoic acid</metabolite_name><metabolite_name>LPE(20:2/0:0)</metabolite_name><metabolite_name>Carnitine C14:0</metabolite_name><metabolite_name>LPE(0:0/20:3)</metabolite_name><metabolite_name>3-Hydroxypyruvic acid</metabolite_name><metabolite_name>Carnitine C14:2</metabolite_name><metabolite_name>Carnitine C14:1</metabolite_name><metabolite_name>Mandelic Acid</metabolite_name><metabolite_name>12,13-EpOME</metabolite_name><metabolite_name>Gluconic acid</metabolite_name><metabolite_name>Val-Glu</metabolite_name><metabolite_name>N-Acetylglycine</metabolite_name><metabolite_name>Ala-Lys</metabolite_name><metabolite_name>3-Amino-4-methylpentanoic acid</metabolite_name><metabolite_name>Hyp-Ser</metabolite_name><metabolite_name>LPC(20:5/0:0)</metabolite_name><metabolite_name>LPC(0:0/20:2)</metabolite_name><metabolite_name>Val-Gly</metabolite_name><metabolite_name>FFA(19:2)</metabolite_name><metabolite_name>Pro-Asn</metabolite_name><metabolite_name>Pro-Asp</metabolite_name><metabolite_name>2-Mercaptobenzothiazole</metabolite_name><metabolite_name>LPE(0:0/20:4)</metabolite_name><metabolite_name>Dehydrozingerone</metabolite_name><metabolite_name>Galacturonic acid</metabolite_name><metabolite_name>4-Methylhexanoic acid</metabolite_name><metabolite_name>3-(4-Hydroxyphenyl)-1-propanol</metabolite_name><metabolite_name>Orotic Acid</metabolite_name><metabolite_name>Isolithocholic acid</metabolite_name><metabolite_name>N-Methyl-D-Aspartic Acid</metabolite_name><metabolite_name>N-(2-hydroxyethyl)-3-pyridinecarboxamide</metabolite_name><metabolite_name>10-Formyl-Thf</metabolite_name><metabolite_name>L-3-Phenyllactic acid</metabolite_name><metabolite_name>D-urobilinogen</metabolite_name><metabolite_name>Trans-3-Hydroxycotinine</metabolite_name><metabolite_name>p-Cresol</metabolite_name><metabolite_name>Carnitine C17:1:DC</metabolite_name><metabolite_name>2-(Dimethylamino)Guanosine</metabolite_name><metabolite_name>LPE(0:0/20:5)</metabolite_name><metabolite_name>N-(2-Hydroxyethyl)pentadecanamide</metabolite_name><metabolite_name>5-hydroxyindole acetaldehyde</metabolite_name><metabolite_name>Piperidine</metabolite_name><metabolite_name>D-Ornithine</metabolite_name><metabolite_name>Azelaic Acid</metabolite_name><metabolite_name>L-2-Aminoadipic acid</metabolite_name><metabolite_name>Inositol 1-phosphate</metabolite_name><metabolite_name>Carnitine C18-OH</metabolite_name><metabolite_name>9,10-dihydroxystearic acid</metabolite_name><metabolite_name>Dethiobiotin</metabolite_name><metabolite_name>3-Guanidinopropionic acid</metabolite_name><metabolite_name>Isocytosine</metabolite_name><metabolite_name>2,3-Dihydroxybenzoic acid</metabolite_name><metabolite_name>Indole-3-carboxylic acid</metabolite_name><metabolite_name>Lactose</metabolite_name><metabolite_name>3-Aminoquinoline</metabolite_name><metabolite_name>5-Hydroxypyridine-2(1H)-one</metabolite_name><metabolite_name>2-Hydroxy-2-Methyl Butyric acid</metabolite_name><metabolite_name>P¨CHydroxyphenyl Acetic Acid</metabolite_name><metabolite_name>Methylmalonic Acid</metabolite_name><metabolite_name>1,7-Dimethylxanthine</metabolite_name><metabolite_name>Thr-Phe</metabolite_name><metabolite_name>Sorbitol 6-phosphate</metabolite_name><metabolite_name>Riboflavin</metabolite_name><metabolite_name>2-Methyl-d-erythritol 2,4-cyclodiphosphate</metabolite_name><metabolite_name>LPC(19:2/0:0)</metabolite_name><metabolite_name>3,3-Dimethylglutaric acid</metabolite_name><metabolite_name>3-(4-Fluorobenzoyl)propionic acid</metabolite_name><metabolite_name>11-Beta-hydroxyandrostenedione</metabolite_name><metabolite_name>2-Hydroxy-2-methylbutanenitrile</metabolite_name><metabolite_name>Urolithin A</metabolite_name><metabolite_name>Glu-Leu</metabolite_name><metabolite_name>LPC(0:0/18:2)</metabolite_name><metabolite_name>Indole-3-Acetic Acid</metabolite_name><metabolite_name>Lys-Val</metabolite_name><metabolite_name>Carnitine C14:1-OH</metabolite_name><metabolite_name>Glucoronic Acid</metabolite_name><metabolite_name>O-Acetyl-L-serine</metabolite_name><metabolite_name>LPC(14:1/0:0)</metabolite_name><metabolite_name>Estradiol cypionate</metabolite_name><metabolite_name>Biotin</metabolite_name><metabolite_name>L-Proline</metabolite_name><metabolite_name>Urea</metabolite_name><metabolite_name>Leu-Asn</metabolite_name><metabolite_name>Leu-Asp</metabolite_name><metabolite_name>Octadecanedioic acid</metabolite_name><metabolite_name>LPC(0:0/18:3)</metabolite_name><metabolite_name>Methyl beta-D-galactopyranoside</metabolite_name><metabolite_name>(¡À)15-HETE</metabolite_name><metabolite_name>N-MethyTrans-4-Hydroxy-Proline</metabolite_name><metabolite_name>N1-Acetylspermidine</metabolite_name><metabolite_name>5-Aminoimidazole ribonucleotide</metabolite_name><metabolite_name>3-Methylthiopropylamine</metabolite_name><metabolite_name>Piperidine acid</metabolite_name><metabolite_name>Phthalic Acid</metabolite_name><metabolite_name>FFA(17:1)</metabolite_name><metabolite_name>Val-Ala</metabolite_name><metabolite_name>(R)-2-Hydroxybutyric acid</metabolite_name><metabolite_name>Murideoxycholic acid</metabolite_name><metabolite_name>Carnitine C18:2-OH</metabolite_name><metabolite_name>LPE(22:5/0:0)</metabolite_name><metabolite_name>(4Z,7Z,10Z,13Z,16Z,19Z)-Eicosahexaenoate</metabolite_name><metabolite_name>LPC(0:0/18:0)</metabolite_name><metabolite_name>LPC(O-14:0)</metabolite_name><metabolite_name>9(S)-HpOTrE</metabolite_name><metabolite_name>Benzylcinnamate</metabolite_name><metabolite_name>Carnitine C14-OH</metabolite_name><metabolite_name>5-Hydroxytryptophol</metabolite_name><metabolite_name>Methylcysteine</metabolite_name><metabolite_name>FFA(17:2)</metabolite_name><metabolite_name>P-Coumaric Acid</metabolite_name><metabolite_name>N-Acetylcadaverine</metabolite_name><metabolite_name>P-chlorophenylalanine</metabolite_name><metabolite_name>LPE(0:0/20:2)</metabolite_name><metabolite_name>LPC(O-14:1)</metabolite_name><metabolite_name>LPC(0:0/18:1)</metabolite_name><metabolite_name>LPE(18:1/0:0)</metabolite_name><metabolite_name>Vitamin D3</metabolite_name><metabolite_name>Tyr-Ser</metabolite_name><metabolite_name>3,4-Dimethoxycinnamic acid</metabolite_name><metabolite_name>8-Azaguanine</metabolite_name><metabolite_name>N-Acetyl-L-methionine</metabolite_name><metabolite_name>S-Adenosyl-L-Methionine</metabolite_name><metabolite_name>Urobilinogen</metabolite_name><metabolite_name>3-Oxocholic acid</metabolite_name><metabolite_name>O-Phospho-L-tyrosine</metabolite_name><metabolite_name>3-Methylxanthine</metabolite_name><metabolite_name>Sebacate</metabolite_name><metabolite_name>3-Epideoxycholic acid</metabolite_name><metabolite_name>2-Aminomethylpyrimidine</metabolite_name><metabolite_name>Chaps</metabolite_name><metabolite_name>4-acetoxyphenol</metabolite_name><metabolite_name>Hexadecanedioic acid</metabolite_name><metabolite_name>2-Methyl-4-pentenoic Acid</metabolite_name><metabolite_name>Biliverdin</metabolite_name><metabolite_name>3-Amino-2-piperidinone</metabolite_name><metabolite_name>(¡À)17(18)-DiHETE</metabolite_name><metabolite_name>2,4-Di-tert-butylphenol</metabolite_name><metabolite_name>FFA(17:0)</metabolite_name><metabolite_name>Xylose</metabolite_name><metabolite_name>3-N-Methyl-L-Histidine</metabolite_name><metabolite_name>(¡À)19(20)-EpDPE(A)</metabolite_name><metabolite_name>1-Methylguanine</metabolite_name><metabolite_name>Uridine</metabolite_name><metabolite_name>LPE(20:4/0:0)</metabolite_name><metabolite_name>(2E,4E)-6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid</metabolite_name><metabolite_name>Malonic acid</metabolite_name><metabolite_name>N-Acetylthreonine</metabolite_name><metabolite_name>Dulcitol</metabolite_name><metabolite_name>2,5-Dihydroxybenzoic acid</metabolite_name><metabolite_name>Isoxanthopterin</metabolite_name><metabolite_name>Testosterone sulfate</metabolite_name><metabolite_name>LPE(22:6/0:0)</metabolite_name><metabolite_name>N-Acetyl-L-tryptophanamide</metabolite_name><metabolite_name>Carnitine C9:DC</metabolite_name><metabolite_name>Diethanolamine</metabolite_name><metabolite_name>LPC(0:0/16:2)</metabolite_name><metabolite_name>5-F2t-IsoP</metabolite_name><metabolite_name>Gly-His</metabolite_name><metabolite_name>Thiamine</metabolite_name><metabolite_name>2,4-Pyridinedicarboxylic acid</metabolite_name><metabolite_name>N-Methyl-¦Á-aminoisobutyric acid</metabolite_name><metabolite_name>Ile-Ser</metabolite_name><metabolite_name>Phosphatidylethanolamine lyso alkenyl 16:0</metabolite_name><metabolite_name>1,6-anhydro-¦Â-D-glucose</metabolite_name><metabolite_name>12,13-DiHOME</metabolite_name><metabolite_name>Allose</metabolite_name><metabolite_name>His-Ile</metabolite_name><metabolite_name>3-Iodo-L-Tyrosine</metabolite_name><metabolite_name>L-Tyrosine</metabolite_name><metabolite_name>Subericacid</metabolite_name><metabolite_name>Argininosuccinic acid</metabolite_name><metabolite_name>Sulfoacetic acid</metabolite_name><metabolite_name>L-Asparagine Anhydrous</metabolite_name><metabolite_name>3-Hydroxycinnamic acid</metabolite_name><metabolite_name>Phe-Pro</metabolite_name><metabolite_name>N6-(2-Hydroxyethyl)adenosine</metabolite_name><metabolite_name>3-Hydroxybutanoic acid</metabolite_name><metabolite_name>Sucrose</metabolite_name><metabolite_name>Terephthalic Acid</metabolite_name><metabolite_name>Mannose</metabolite_name><metabolite_name>Glucose</metabolite_name><metabolite_name>N6-Acetyl-L-Lysine</metabolite_name><metabolite_name>FFA(15:1)</metabolite_name><metabolite_name>D-Glucaro-1,4-lactone</metabolite_name><metabolite_name>LPC(O-16:0)</metabolite_name><metabolite_name>Spermidine</metabolite_name><metabolite_name>Cortexolone</metabolite_name><metabolite_name>Triethylamine</metabolite_name><metabolite_name>1-acetylindole</metabolite_name><metabolite_name>2,6-Di-tert-butyl-4-(hydroxymethyl)phenol</metabolite_name><metabolite_name>Leu-Ala</metabolite_name><metabolite_name>LPC(0:0/16:0)</metabolite_name><metabolite_name>PC(O-1:0/O-16:0)</metabolite_name><metabolite_name>3-(imidazol-4-yl)propionic acid</metabolite_name><metabolite_name>Folinic acid</metabolite_name><metabolite_name>2-Dodecylbenzenesulfonic acid</metabolite_name><metabolite_name>1-Hydroxy-2-Naphthoate</metabolite_name><metabolite_name>Ile-His</metabolite_name><metabolite_name>2-Methyllactic acid</metabolite_name><metabolite_name>LPC(O-16:1)</metabolite_name><metabolite_name>LPC(0:0/16:1)</metabolite_name><metabolite_name>LPC(12:0/0:0)</metabolite_name><metabolite_name>Thr-Gln</metabolite_name><metabolite_name>Vanillylamine</metabolite_name><metabolite_name>AMC Arachidonoyl Amide</metabolite_name><metabolite_name>2-hydroxyhexadecanoic acid</metabolite_name><metabolite_name>L-lyxose</metabolite_name><metabolite_name>3-Methoxycatechol</metabolite_name><metabolite_name>3-Indole carboxylic acid glucuronide</metabolite_name><metabolite_name>Octadecanamide</metabolite_name><metabolite_name>Ritalinic acid</metabolite_name><metabolite_name>Carnitine C2:0</metabolite_name><metabolite_name>Creatine phosphate</metabolite_name><metabolite_name>FFA(15:0)</metabolite_name><metabolite_name>Butylamine</metabolite_name><metabolite_name>MG(0:0/16:0/0:0)</metabolite_name><metabolite_name>(¡À)-Camphoric acid</metabolite_name><metabolite_name>Pimelic acid</metabolite_name><metabolite_name>LPS(18:0)</metabolite_name><metabolite_name>2,2-Dimethylpentanoic acid</metabolite_name><metabolite_name>Cyclamic acid</metabolite_name><metabolite_name>Tert-Butylhydroquinone</metabolite_name><metabolite_name>Glycolithocholic acid</metabolite_name><metabolite_name>Val-Asp</metabolite_name><metabolite_name>(¡À)7(8)-DiHDPE(A)</metabolite_name><metabolite_name>Thr-Glu</metabolite_name><metabolite_name>LPA(16:0/0:0)</metabolite_name><metabolite_name>Gamma-Mercholic Acid</metabolite_name><metabolite_name>Cyclo(Phe-Pro)</metabolite_name><metabolite_name>7-ketolithocholic acid</metabolite_name><metabolite_name>LPG(0:0/18:2)</metabolite_name><metabolite_name>Theobromine</metabolite_name><metabolite_name>Cortisol</metabolite_name><metabolite_name>Methylparaben</metabolite_name><metabolite_name>Val-Arg</metabolite_name><metabolite_name>LPE(20:3/0:0)</metabolite_name><metabolite_name>Urobilin</metabolite_name><metabolite_name>2-Benzylmalate</metabolite_name><metabolite_name>Leu-Leu</metabolite_name><metabolite_name>Acetaminophen sulfate</metabolite_name><metabolite_name>Betaine</metabolite_name><metabolite_name>L-Ascorbyl 6-palmitate</metabolite_name><metabolite_name>L-Alanine</metabolite_name><metabolite_name>LPE(O-18:2)</metabolite_name><metabolite_name>Asn-Ser</metabolite_name><metabolite_name>Palmitoylethanolamide£¨PEA£©</metabolite_name><metabolite_name>16-Hydroxyestrone</metabolite_name><metabolite_name>Norethindrone acetate</metabolite_name><metabolite_name>N-(3-Indolylacetyl)-L-alanine</metabolite_name><metabolite_name>LPE(22:4/0:0)</metabolite_name><metabolite_name>1-Aminocyclopropane-1-carboxylic acid</metabolite_name><metabolite_name>Carnitine C12-OH</metabolite_name><metabolite_name>Pro-Ser</metabolite_name><metabolite_name>2-Furoylglycine</metabolite_name><metabolite_name>Indole-3-lactic acid</metabolite_name><metabolite_name>Isoquinoline</metabolite_name><metabolite_name>DL-2-hydroxystearic acid</metabolite_name><metabolite_name>Coniferol</metabolite_name><metabolite_name>Phenoxyacetic acid</metabolite_name><metabolite_name>Carnitine C18:1:2DC</metabolite_name><metabolite_name>Azelaoyl PAF</metabolite_name><metabolite_name>2-Carboxybenzaldehyde</metabolite_name><metabolite_name>4-Hydroxytryptamine</metabolite_name><metabolite_name>1-Methylhistidine</metabolite_name><metabolite_name>Genipin</metabolite_name><metabolite_name>N-Phenylanthranilic acid</metabolite_name><metabolite_name>2-Aminoethanesulfinic Acid</metabolite_name><metabolite_name>N-Myristoylglycine</metabolite_name><metabolite_name>¦Ã-Aminobutyric Acid</metabolite_name><metabolite_name>Arg-Ile</metabolite_name><metabolite_name>Val-Leu</metabolite_name><metabolite_name>LPC(17:0/0:0)</metabolite_name><metabolite_name>3-methyl-4-pentenoic acid</metabolite_name><metabolite_name>Leu-Arg</metabolite_name><metabolite_name>N-Methylalanine</metabolite_name><metabolite_name>S-methyl-L-thiocitrulline</metabolite_name><metabolite_name>LPC(0:0/14:0)</metabolite_name><metabolite_name>Glycocholic Acid</metabolite_name><metabolite_name>Carnitine C5-OH</metabolite_name><metabolite_name>Hyodeoxycholic acid</metabolite_name><metabolite_name>LPC(16:2/0:0)</metabolite_name><metabolite_name>ST-638</metabolite_name><metabolite_name>cyclo(pro-pro)</metabolite_name><metabolite_name>Progesterone</metabolite_name><metabolite_name>Lactic acid</metabolite_name><metabolite_name>Phe-His</metabolite_name><metabolite_name>LPC(0:0/14:1)</metabolite_name><metabolite_name>Allantoin</metabolite_name><metabolite_name>Ile-Asp</metabolite_name><metabolite_name>1-Aminopentadecane</metabolite_name><metabolite_name>4-Amino-3-hydroxybutyric acid</metabolite_name><metabolite_name>Ile-Asn</metabolite_name><metabolite_name>Carnitine C7:1</metabolite_name><metabolite_name>Ethylsalicylate</metabolite_name><metabolite_name>4-(Hydroxyamino)quinoline 1-oxide</metabolite_name><metabolite_name>dihydrotachysterol</metabolite_name><metabolite_name>L-Homoserine</metabolite_name><metabolite_name>SPH(d16:1)</metabolite_name><metabolite_name>6-Diazo-5-oxo-L-norleucine</metabolite_name><metabolite_name>2-Hydroxyadipic acid</metabolite_name><metabolite_name>10-Hydroxystearic Acid</metabolite_name><metabolite_name>Phe-Trp</metabolite_name><metabolite_name>Taurochenodesoxycholic Acid</metabolite_name><metabolite_name>Uridine triphosphate (UTP)</metabolite_name><metabolite_name>3-Hydroxy-L-phenylalanine</metabolite_name><metabolite_name>LPC(18:3/0:0)</metabolite_name><metabolite_name>Indole-5-carboxylic acid</metabolite_name><metabolite_name>Cys-Arg</metabolite_name><metabolite_name>1-Aminocyclohexanecarboxylic acid</metabolite_name><metabolite_name>Tetraethylene-glycol</metabolite_name><metabolite_name>2'-Deoxyinosine</metabolite_name><metabolite_name>Guanidineacetic Acid</metabolite_name><metabolite_name>N-lactoyl-phenylalanine</metabolite_name><metabolite_name>Porphobilinogen</metabolite_name><metabolite_name>Tyrosol</metabolite_name><metabolite_name>N-oleoyl-L-serine</metabolite_name><metabolite_name>Leu-Thr</metabolite_name><metabolite_name>Gemfibrozil</metabolite_name><metabolite_name>2,4-Dihydroxypyridine</metabolite_name><metabolite_name>N¦Á-Acetyl-L-glutamine</metabolite_name><metabolite_name>Acetaminophen Glucuronide</metabolite_name><metabolite_name>(¡À)9-HETE</metabolite_name><metabolite_name>Lactulose</metabolite_name><metabolite_name>Methyltrienolone</metabolite_name><metabolite_name>Rhapontigenin</metabolite_name><metabolite_name>Trimethylamine-N-Oxide</metabolite_name><metabolite_name>N-Formylglycine</metabolite_name><metabolite_name>Carnitine C13:1</metabolite_name><metabolite_name>Linoleamide</metabolite_name><metabolite_name>Carnitine C13:0</metabolite_name><metabolite_name>L-Norleucine</metabolite_name><metabolite_name>D-Alloisoleucine</metabolite_name><metabolite_name>3-Methyladipic acid</metabolite_name><metabolite_name>alpha-Methyl-m-tyrosine</metabolite_name><metabolite_name>5,6-Dimethylbenzimidazole</metabolite_name><metabolite_name>N-Acetyl-D-Glucosamine</metabolite_name><metabolite_name>Glu-Gln</metabolite_name><metabolite_name>cyclo(gly-glu)</metabolite_name><metabolite_name>D-Xylulose 5-phosphate</metabolite_name><metabolite_name>L-Homoarginine</metabolite_name><metabolite_name>7-ketodeoxycholic acid</metabolite_name><metabolite_name>9-oxoODE</metabolite_name><metabolite_name>Cycloleucine</metabolite_name><metabolite_name>Phe-Leu</metabolite_name><metabolite_name>LPE(0:0/15:0)</metabolite_name><metabolite_name>L-Homocitrulline</metabolite_name><metabolite_name>Carnitine C24:5</metabolite_name><metabolite_name>Heterodendrin</metabolite_name><metabolite_name>Cys-Pro</metabolite_name><metabolite_name>Glu-Gly</metabolite_name><metabolite_name>6-O-methylguanine</metabolite_name><metabolite_name>Hexanoyl Glycine</metabolite_name><metabolite_name>Ile-Pro-Ile</metabolite_name><metabolite_name>Carnitine C9:1</metabolite_name><metabolite_name>Carnitine C9:0</metabolite_name><metabolite_name>Carnitine C4:DC</metabolite_name><metabolite_name>2-Deoxy-D-ribofuranose 5-phosphate</metabolite_name><metabolite_name>4-Ethyloctanoic acid</metabolite_name><metabolite_name>LXB4</metabolite_name><metabolite_name>Citric Acid</metabolite_name><metabolite_name>18¦Â-Glycyrrhetinic acid</metabolite_name><metabolite_name>Methylstearate</metabolite_name><metabolite_name>Ile-Leu</metabolite_name><metabolite_name>5'-Deoxy-5'-(Methylthio) Adenosine</metabolite_name><metabolite_name>LPE(18:3/0:0)</metabolite_name><metabolite_name>2-Acetyl-5-methylfuran</metabolite_name><metabolite_name>Ser-Val</metabolite_name><metabolite_name>2,6-Xylenol</metabolite_name><metabolite_name>Adipic Acid</metabolite_name><metabolite_name>Lys-Ala</metabolite_name><metabolite_name>16-Dehydroprogesterone</metabolite_name><metabolite_name>(¡À)12-HEPE</metabolite_name><metabolite_name>3-keto Petromyzonol</metabolite_name><metabolite_name>Asn-Hyp</metabolite_name><metabolite_name>Hypoxanthine</metabolite_name><metabolite_name>Prostaglandin A1 ethyl ester</metabolite_name><metabolite_name>N6-methyladenosine</metabolite_name><metabolite_name>Gly-Trp</metabolite_name><metabolite_name>2,6-Pyridinedicarboxylic acid</metabolite_name><metabolite_name>L-Arginine</metabolite_name><metabolite_name>cis-Citral</metabolite_name><metabolite_name>Leu-Phe</metabolite_name><metabolite_name>LPE(18:2/0:0)</metabolite_name><metabolite_name>Ethylazine</metabolite_name><metabolite_name>N-acetyl-D-Lactosamine</metabolite_name><metabolite_name>11-Carbonyl-beta-acetyl-boswellic acid</metabolite_name><metabolite_name>Phe-Asp</metabolite_name><metabolite_name>Carnitine C12:1-OH</metabolite_name><metabolite_name>Arabinose</metabolite_name><metabolite_name>Phe-Asn</metabolite_name><metabolite_name>3-Methylequuric acid</metabolite_name><metabolite_name>2,6-Diamino-5-hydroxyhexanoic acid</metabolite_name><metabolite_name>L-Cysteine</metabolite_name><metabolite_name>cyclo(glu-glu)</metabolite_name><metabolite_name>N6,N6,N6-Trimethyl-L-lysine</metabolite_name><metabolite_name>L-Gulose</metabolite_name><metabolite_name>5-Hydroxyindole</metabolite_name><metabolite_name>Triethylene glycol-monomethyl ether</metabolite_name><metabolite_name>5-Methyluridine</metabolite_name><metabolite_name>Oxindole</metabolite_name><metabolite_name>LY223982</metabolite_name><metabolite_name>Caftaric acid</metabolite_name><metabolite_name>FFA(11:0)</metabolite_name><metabolite_name>Adenine</metabolite_name><metabolite_name>Glu-Ile</metabolite_name><metabolite_name>Lythramine</metabolite_name><metabolite_name>Cortisone</metabolite_name><metabolite_name>Gly-Phe</metabolite_name><metabolite_name>Carnitine C22:3</metabolite_name><metabolite_name>2-Deoxyribose 1-Phosphate</metabolite_name><metabolite_name>2-Amino-5-methyl-4-phenylthiazole</metabolite_name><metabolite_name>4-Acetylaminobenzoic acid</metabolite_name><metabolite_name>L-Serine</metabolite_name><metabolite_name>Furfural diacetal</metabolite_name><metabolite_name>Carnitine C22:4</metabolite_name><metabolite_name>Ile-Arg</metabolite_name><metabolite_name>Lumichrome</metabolite_name><metabolite_name>N-Tetradecanoyl-L-homoserine lactone</metabolite_name><metabolite_name>2-Pyrrolidinone</metabolite_name><metabolite_name>Leu-Ile</metabolite_name><metabolite_name>10-deoxyformamycin</metabolite_name><metabolite_name>N-acetyl-D-phenylalanine</metabolite_name><metabolite_name>2-Pentyl-3-phenyl-2-propenal</metabolite_name><metabolite_name>3,4-Dimethylbenzoic acid</metabolite_name><metabolite_name>LPC(18:2/0:0)</metabolite_name><metabolite_name>Cholic acid</metabolite_name><metabolite_name>Pregnenolone</metabolite_name><metabolite_name>LPE(14:0/0:0)</metabolite_name><metabolite_name>LPE(16:0/0:0)</metabolite_name><metabolite_name>2-Methylhexanoic acid</metabolite_name><metabolite_name>Lys-Gly</metabolite_name><metabolite_name>20beta-Dihydroprogesterone</metabolite_name><metabolite_name>Ala-Glu</metabolite_name><metabolite_name>5-Aminovaleric Acid</metabolite_name><metabolite_name>Ellagic acid</metabolite_name><metabolite_name>Ureidosuccinic acid</metabolite_name><metabolite_name>3-Hydroxy-3-Methyl Butyric Acid</metabolite_name><metabolite_name>Caffeine</metabolite_name><metabolite_name>(1R,6S)-6-amino-5-oxocyclohexyl-2-ene-1-carboxylic-acid-ester</metabolite_name><metabolite_name>Pyridine-3,4-dicarboxylic acid</metabolite_name><metabolite_name>4-Hydroxy-3-methoxyphenylacetic acid</metabolite_name><metabolite_name>N-Methyl-L-Glutamate</metabolite_name><metabolite_name>4-tert-Octylphenol</metabolite_name><metabolite_name>Methyl Indole-3-Acetate</metabolite_name><metabolite_name>L-Methionine</metabolite_name><metabolite_name>alpha-CEHC</metabolite_name><metabolite_name>(¡À)12-HETE</metabolite_name><metabolite_name>N-Amidino-L-Aspartate</metabolite_name><metabolite_name>N-Acetylhistamine</metabolite_name><metabolite_name>Methyldopa</metabolite_name><metabolite_name>Nicotinamide</metabolite_name><metabolite_name>2-Hydroxycaprylic acid</metabolite_name><metabolite_name>LPE(17:1/0:0)</metabolite_name><metabolite_name>Ile-Ala</metabolite_name><metabolite_name>Colneleic acid</metabolite_name><metabolite_name>Theophylline</metabolite_name><metabolite_name>6-Aminocaproic Acid</metabolite_name><metabolite_name>2-Hexadecanoylthio-1-ethylphosphorylcholine</metabolite_name><metabolite_name>Cyclo(Pro-Val)</metabolite_name><metabolite_name>Bovinic acid</metabolite_name><metabolite_name>Lys-Thr</metabolite_name><metabolite_name>N-Acetylornithine</metabolite_name><metabolite_name>Salidroside</metabolite_name><metabolite_name>3-Hydroxy-3-Methylpentane-1,5-Dioic Acid</metabolite_name><metabolite_name>6-Hydroxyflavone (6-HF)</metabolite_name><metabolite_name>Acrylamide</metabolite_name><metabolite_name>Ser-Phe-Ala</metabolite_name><metabolite_name>Pyroglutamic acid</metabolite_name><metabolite_name>Mannitol</metabolite_name><metabolite_name>Carnitine C17:1</metabolite_name><metabolite_name>Carnitine C17:0</metabolite_name><metabolite_name>Cyclocreatine</metabolite_name><metabolite_name>Pyridoxamine</metabolite_name><metabolite_name>Menadiol-Diacetate</metabolite_name><metabolite_name>Asp-Ile</metabolite_name><metabolite_name>Indirubin 3'-monooxime</metabolite_name><metabolite_name>LPC(17:1/0:0)</metabolite_name><metabolite_name>4-Methoxysalicylaldehyde</metabolite_name><metabolite_name>Elenaic acid</metabolite_name><metabolite_name>Quinic acid</metabolite_name><metabolite_name>¦¢-Pseudouridine</metabolite_name><metabolite_name>20,26-dihydroxyecdysone</metabolite_name><metabolite_name>Methyl-cinnamate</metabolite_name><metabolite_name>N-Acetyl-L-Glutamic Acid</metabolite_name><metabolite_name>2-Hydroxybutanoic Acid</metabolite_name><metabolite_name>N-Acetyl-L-alanine</metabolite_name><metabolite_name>L-Norvaline</metabolite_name><metabolite_name>7-(alpha-D-glucosyl)-N(6)-isopentenyladenine</metabolite_name><metabolite_name>Acetylcholine</metabolite_name><metabolite_name>Cyclo(Phe-Glu)</metabolite_name><metabolite_name>Val-Lys</metabolite_name><metabolite_name>Carnitine C15:1:DC</metabolite_name><metabolite_name>Phenyl 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Acid</metabolite_name><metabolite_name>Oxypurinol</metabolite_name><metabolite_name>Phe-Phe</metabolite_name><metabolite_name>gamma-CEHC</metabolite_name><metabolite_name>Talose</metabolite_name><metabolite_name>LPC(14:0/0:0)</metabolite_name><metabolite_name>Pterine</metabolite_name><metabolite_name>Hexadecanamide</metabolite_name><metabolite_name>CAY-10550</metabolite_name><metabolite_name>D-Glucuronolactone</metabolite_name><metabolite_name>LPA(0:0/18:1)</metabolite_name><metabolite_name>Meleagrin</metabolite_name><metabolite_name>FFA(18:2)</metabolite_name><metabolite_name>Gly-Tyr</metabolite_name><metabolite_name>O-Acetyl-L-homoserine</metabolite_name><metabolite_name>5-chloroindole-2-carboxylic acid</metabolite_name><metabolite_name>2-Amino-2-methyl-1,3-propanediol</metabolite_name><metabolite_name>Medroxyprogesterone</metabolite_name><metabolite_name>Carnitine C15:1</metabolite_name><metabolite_name>2-amino-6-oxohexanoic acid</metabolite_name><metabolite_name>12-HHT</metabolite_name><metabolite_name>Pyrrolidine</metabolite_name><metabolite_name>Glu-Cit</metabolite_name><metabolite_name>Cyclopentylglycine</metabolite_name><metabolite_name>Indole-3-phosphate</metabolite_name><metabolite_name>Epinephrine</metabolite_name><metabolite_name>Asp-Val</metabolite_name><metabolite_name>2,22-Dideoxy-3-dehydroecdysone</metabolite_name><metabolite_name>Triethyl-phosphate</metabolite_name><metabolite_name>2-Butyl-3-(4-hydroxybenzoyl)benzofuran</metabolite_name><metabolite_name>Imidazoleacetic acid</metabolite_name><metabolite_name>2',4'-Dihydroxyacetophenone</metabolite_name><metabolite_name>11-deoxy-16,16-dimethyl-PGE2</metabolite_name><metabolite_name>Carnitine-2-methyl-C4</metabolite_name><metabolite_name>Tartaric acid</metabolite_name><metabolite_name>FFA(18:3)</metabolite_name><metabolite_name>3-Amino-5-hydroxybenzoic acid</metabolite_name><metabolite_name>Deoxycholic acid</metabolite_name><metabolite_name>N1-Acetylspermine</metabolite_name><metabolite_name>Phenylhydroxylamine</metabolite_name><metabolite_name>Erythrulose</metabolite_name><metabolite_name>Glycodeoxycholic acid</metabolite_name><metabolite_name>Phe-Ala</metabolite_name><metabolite_name>Leu-Gly</metabolite_name><metabolite_name>CMPF</metabolite_name><metabolite_name>N-acetyl-beta-alanine</metabolite_name></additional><is_claimable>false</is_claimable><name>Serum Proteomic and Metabolomic Profiling of Sepsis Patients Reveals a Diagnostic Model and Mechanistic Insights into Carbapenem-Resistant Klebsiella pneumoniae Infection</name><description>&lt;p>Serum Proteomic and Metabolomic Profiling of Sepsis Patients Reveals a Diagnostic Model and Mechanistic Insights into Carbapenem-Resistant Klebsiella pneumoniae Infection&lt;/p></description><dates><publication>2026-05-18</publication><submission>2026-03-10</submission></dates><accession>MTBLS14016</accession><cross_references/></HashMap>