The principles of qualitative and quantitative metabolomics are as follows: In qualitative analysis, the molecular weight of a metabolite is first determined by the mass-to-charge ratio (m/z) of its parent ion in the primary mass spectrum.The principles of qualitative and quantitative metabolomics are as follows: In qualitative analysis, the molecular weight of a metabolite is first determined by the mass-to-charge ratio (m/z) of its parent ion in the primary mass spectrum. The molecular formula is then predicted using information such as mass deviation (ppm) and adduct ions, followed by matching against databases (e.g., HMDB, KEGG). Ultimately, only metabolites with a coefficient of variation (CV) less than 30% in QC samples are retained as reliable qualitative results for subsequent analysis. In quantitative analysis, chromatographic peaks detected in samples are integrated using data processing software, where the peak area of each feature corresponds to the relative quantification value of the respective metabolite. Quantitative results are normalized by total peak area, yielding final quantitative values.
It should be noted that current metabolite databases do not distinguish between species, so identified metabolites may include compounds not present in the sample. During subsequent data mining, detailed information about each metabolite can be further verified via commonly used websites such as HMDB (https://hmdb.ca/), KEGG (https://www.kegg.jp/), and PubChem (https://pubchem.ncbi.nlm.nih.gov/).
"],"repository":["MetaboLights"],"study_status":["Public"],"ptm_modification":[""],"instrument_platform":["Liquid Chromatography MS - negative - reverse-phase","Liquid Chromatography MS - positive - reverse-phase"],"chromatography_protocol":["Chromatographic conditions: Separation was performed on a Thermo Vanquish Flex UPLC system using a Phenomenex Kinetex C18 column (2.6 μm, 2.1 × 100 mm). Mobile phase A consisted of 100% water with 0.01% acetic acid, and mobile phase B consisted of 50% acetonitrile and 50% isopropanol. Column temperature was maintained at 25 °C, autosampler temperature at 4 °C, and injection volume was 2 μL.
"],"publication":["The influence of canine parvovirus infection on the metabolome of captive Chinese and Malaysia pangolins."],"submitter_affiliation":["South China Agricultural University"],"submitter_name":["Jingling Yu"],"organism_part":["solvent","feces"],"technology_type":["mass spectrometry assay"],"disease":[""],"extraction_protocol":["Each fecal sample (20 mg) was randomly collected, placed on dry ice, and homogenized at 60 Hz for 60 seconds using liquid nitrogen. Then, 200 μL of pre-cooled water was added to a 2 mL grinding tube containing steel beads, and the mixture was ground at 60 Hz for 60 seconds. Subsequently, 800 μL of methanol/acetonitrile (1:1, v/v) was added, followed by vortexing for 30 seconds and ultrasonication at 4°C for 10 minutes. After incubation at -20°C for 1 hour, the sample was centrifuged at 13,000 rpm and 4°C for 15 minutes to precipitate proteins. A 720 μL aliquot of the supernatant was transferred to a 1.5 mL centrifuge tube and concentrated to dryness under vacuum at 4°C. The residue was reconstituted with 100 μL of acetonitrile/water (1:1, v/v), vortexed for 30 seconds, and ultrasonicated at 4°C for 10 minutes. After centrifugation for 15 minutes, the supernatant was transferred to a sample vial with an insert and stored at 4°C for UPLC-HRMS analysis.
"],"organism":["blank sample","Manis javanica"],"full_dataset_link":["https://www.ebi.ac.uk/metabolights/MTBLS15426"],"author":["Jingling Yu. South China Agricultural University. biggirl20022020@outlook.com.","Han Mingzheng. South China Agricultural University. 582085438@qq.com."],"data_transformation_protocol":["The acquired MS data pretreatments including peak picking, peak grouping, retention time correction, second peak grouping, and annotation of isotopes and adducts was performed using XCMS software. LC−MS raw data files were converted into mzXML format and then processed by the XCMS, CAMERA and metaX toolbox implemented with the R software. Each ion was identified by combining retention time (RT) and m/z data. Intensities of each peaks were recorded and a three dimensional matrix containing arbitrarily assigned peak indices (retention time-m/z pairs), sample names (observations) and ion intensity information (variables) was generated.
The online KEGG, HMDB database was used to annotate the metabolites by matching the exact molecular mass data (m/z) of samples with those from database. If a mass difference between observed and the database value was less than 10 ppm, the metabolite would be annotated and the molecular formula of metabolites would further be identified and validated by the isotopic distribution measurements. We also used a in-house fragment spectrum library of metabolites to validate the metabolite identidification.
Statistical analysis was primarily conducted using R (v4.0). Metabolite data underwent three key processing steps: first, data filtering to remove samples with over 80% missing values or quality control (QC) samples with over 50% missing data; second, data imputation using the K-nearest neighbor (KNN) method; and third, data standardization via Probabilistic quotient normalization (PQN).Cluster heatmaps were generated with the R package pheatmap. Principal component analysis (PCA) and significant differential metabolite analysis were performed using the R package metaX. Partial least squares discriminant analysis (PLSDA) was carried out with the R package ropls, and variable importance in projection (VIP) values for each variable were calculated. Correlation analysis was conducted using Pearson's correlation coefficient from the R package cor. The final significant differential metabolites were identified based on three criteria: P-value <0.05 from t-test, fold change >1.2, and VIP ≥1 from PLSDA analysis.Kyoto Encyclopedia of Genes and Genomes (KEGG) pathway enrichment analysis was performed using hypergeometric tests, with P-value <0.05 indicating significant enrichment. Metabolite set enrichment analysis was conducted using GSEA (v4.1.0), and KEGG pathways with |NES| >1, a nominal P-value <0.05 and FDR<0.25 were considered significantly different between the two groups. Network diagrams were constructed based on the pathways of the metabolites to illustrate their interactions.
"],"study_factor":["Gender"],"submitter_email":["biggirl20022020@outlook.com"],"sample_collection_protocol":["The pangolin samples analyzed in this study were rescued by local government officials and members of the public in Guangdong Province and transported to the Guangdong Provincial Wildlife Rescue and Testing Center. Each animal was quarantined for at least one month, and injured or ill individuals were treated until apparent recovery. The criteria for healthy controls were active, good appetite, normal stool, absence of parasites or trauma, and stable weight. CPV-infected individuals presented with clinical symptoms such as diarrhea, vomiting, and loss of appetite, and the fecal samples were positive for CPV.
This study included 28 adult Chinese pangolins (weighing 3.1-5.96 kg) and 26 adult Malaysian pangolins (weighing 2.94-8.87 kg). Six individuals of similar body length and weight were selected from each species, with three assigned to the CPV-infected group and three to the healthy control group. Fresh fecal samples were collected from these individuals for subsequent experimental analysis.
"],"omics_type":["Metabolomics"],"study_design":["Thermo Scientific Vanquish UHPLC System","pooled quality control sample","Metabolomics","blank sample","untargeted analysis","Q Exactive PLUS/Orbitrap Exploris 120/Orbitrap Exploris 480","solvent blank","solvent","feces","experimental sample","Manis javanica"],"curator_keywords":["Thermo Scientific Vanquish UHPLC System","pooled quality control sample","Metabolomics","blank sample","untargeted analysis","Q Exactive PLUS/Orbitrap Exploris 120/Orbitrap Exploris 480","solvent blank","solvent","feces","experimental sample","Manis javanica"],"mass_spectrometry_protocol":["Mass spectrometric conditions: Data acquisition was performed in full-scan mode with polarity switching for samples, while quality control (QC) samples were analyzed using full-scan and segmented data-dependent acquisition (DDA). Detailed parameters: Sheath gas flow rate: 50 Arb, Aux gas flow rate: 15 Arb, Capillary temperature: 350 °C, Spray voltage: 3.5 kV (positive) or –2.8 kV (negative).
"],"metabolite_name":["Dihydroguaiaretic acid","Phenylpyruvate","1-alpha-linolenoyl-2-alpha-linolenoyl-phosphatidylcholine","cis-3-Hexenyl pyruvate","[9]-Gingerol","Pyrocatechol","3-Oxocholest-4-en-26-oate","Methyl linolenate","O-Methylarmepavine","Humulinic acid A","Piceatannol","N-Dihydroferuloyltyramine","N-Acetyldopamine","N-Stearoyl Glutamic acid","Schidigeragenin C","Cer(t18:0/20:3(6,8,11)-OH(5))","Schidigeragenin B","4-Hydroxyphenylacetic acid sulfate","12-Oxo-20-trihydroxy-leukotriene B4","Methyl 8-[3-(2-hydroxyoctyl)oxiran-2-yl]octanoate","gamma-Glutamylhydroxyproline","Indole-3-methyl acetate","N-palmitoylglycine","3-Methyl-5-propyl-2-furannonanoic acid","Caplamin","Auxin b","2,2',4,4'-Tetrahydroxybenzophenone","Methyl cis-p-coumarate 3-(3,7-dimethyl-2,6-octadienyl)","Prostaglandin H2","3beta-Hydroxypregn-5-en-20-one sulfate","Citrulline","PE(P-16:0/18:2(9Z,12Z))","Glycolate","3-oxo-palmitate","2,6-Dimethoxyphenol","Clusin","Carboprost","Andre(M327T314_2_C_1)","1,4-Dihydro-2-methylbenzoicacid","4-Hydroxybenzaldehyde","Naringenin chalcone","Pregnanolone sulfate","N2-Acetylornithine","4-Phenylbutanoylcarnitine","Bebeerine","Oxalic acid(M89T396_1)","Sulfolithocholic acid","[12]-Gingerol","Epoxymurin B","Hypophyllanthin","Terpinyl isobutyrate","Glycerol 1-dodecanoate 2-tetradecanoate 3-octanoate","N-Stearoyl Alanine","2-Hydroxy-6-tridecylbenzoic acid","3-(2-Hydroxyphenyl)propanoic acid","5-Hydroxyhexanoic acid","Cynandione A","1-16:0-2-18:2-phosphatidylinositol","N-Acetylneuraminic acid","Cer(d18:0/20:32OH(5,6))","10-Undecenoic acid","1,7-bis-(4-Hydroxy-3-methoxyphenyl)-heptane-3,5-diol","N-(1-Deoxy-1-fructosyl)alanine","Allolithocholic acid","N-Eicosapentaenoyl Glycine","Glyceraldehyde","Pristanic acid","Ursocholic acid","Leu-Val","Glutamylphenylalanine","Erucic acid","5-Hydroxyferulic acid","Malabaricano","2-Oxindole-3-acetic acid","2-Hydroxydecanoic acid","Estradiol-17beta","Dimethisterone","Acetylglycine","Phe-Gly","N-Palmitoyl GABA","Ethyl vanillin isobutyrate","trans-2-Octenoic acid","3-Methylolphenol","Glycylhydroxyproline","1,2-dibutyrin","Ethylhexyl salicylate","Linoleoylglycine","Oxalic acid(M89T646_1)","Mono(1-ethylhexyl) phthalate","Cer(d18:0/20:3O(5,6))","N-Docosahexaenoyl GABA","Docosapentaenoic acid (DPA)","3-(4-Hydroxy-3-methoxyphenyl)-2-methylpropionic acid","CE(PGF2alpha)","Chenodeoxycholic acid","Ornithine","trans-11-Eicosenoic acid","4-Acetamidobutyric acid","Torvoside G","Camphoric acid","N-Docosahexaenoyl Valine","3-Hydroxybenzoic acid","(1r,3r)-1-Aminocyclopentane-1,3-dicarboxylic acid","Lotusine [M]","Androsterone glucuronide","2-(14,15-Epoxyeicosatrienoyl) Glycerol","cis-11.14-Eicosadienoic acid","Prostaglandin A2","2-O-Acetylarbutin","Coclaurine","Cubebinin","Carboprost methyl","N-Linoleoyl Leucine","12-Oxo-10,11-dihydrophyto-15-enoate","2,3-Diethyl-6-hexoxycarbonylbenzoic acid","Taurolithocholate","Bassic acid","Spirostane-3,6-dione","3-Ketopetromyzonol sulfate","3alpha,17alpha,21-Trihydroxy-5beta-pregnan-20-one","5'-O-methylthymidine","2-Methoxy-4-propylphenol","Citronellyl acetate","Pinostrobin chalcone","Dihydroresveratrol","Monooctyl phthalate","2-Hydroxypropyl 2-isopropyl-5-methylcyclohexyl carbonate","ent-16b,19-Kauranediol 19-acetate","Uric acid","Linoleic acid","N-Lauroyl Tyrosine","2,2'-Dihydroxy-4-methoxybenzophenone","3-Hydroxytetradecanedioic acid","Cholyl-dopa","3-Hydroxybutyric acid","(2xi,20beta)-2,20-Dihydroxy-3-oxo-12-ursen-28-oic acid","3-Decenoic acid","Benzoic acid","6-Oxotetradecanoic acid","Stearidonic acid","1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoserine","Ala-Leu","21-Deoxycortisone","Tetradecanedioic acid","13Z,16Z-Docosadienoic acid","2,7-Dimethyl-2,4-octadienedioic acid","Methyl farnesoate","(2R)-6-Oxo-2-piperidinecarboxylic acid","Phytanic acid","Pinosylvin","9,12,13-TriHOME","Terephthalic acid","Isodeoxycholic acid","N-Undecanoylglycine","3-Mercaptohexyl hexanoate","N-Eicosapentaenoyl Aspartic acid","Valeric acid","1-acyl-sn-glycero-3-phosphoglycerol (n-C16:0)","1-(9Z-tetradecenoyl)-glycero-3-phosphate","Dehydroepiandrosterone sulfate","Tetrahydropersin","22,23-Dihydroxycampesterol","Glyyunnansapogenin B","4-Ethyl-1,2-dimethoxybenzene","Butyllactate","N-Octanoyl-homoserine lactone","Salutaridinol","Melibiitol","Nirtetralin","[(3,7-Dimethyl-6-octenyl)oxy]acetaldehyde","3-Methylbutyl 2-furanbutanoate","2-Methylbutyrylglycine","N-oleoyl-glutamate","8-Hydroxyoctanoic acid","N-Lauroyl Leucine","tetracosatetraenoate","9HOT","5-Hydroxysebacate","1-Monolinolenoyl-rac-glycerol","Malabaricone B","10-Dehydrogingerdione","3-Oxoheptanoylcarnitine","2',5'-Dihydroxychalcone","3-nonenoylglycine","19-Oxoandrost-4-ene-3,17-dione","Diisopropyl adipate","cis-4-Octenedioic acid","2-Hydroxyoctanoic acid","N-Linoleoyl Histidine","N-Acetylisoleucine","2-Aminoheptanedioic acid","Desaminotyrosine","19-Hydroxy-4-androstene-3,17-dione","Glycylleucine","Monoketocholic acid","2'-O-Methylisoliquiritigenin","Di-n-hexyl phthalate","cis-9-Palmitoleic acid","CE(PGD1)","Stercurensin","N-Lauroyl Isoleucine","Tetracosapentaenoic acid (24:5n-6)","[2-[[2,2-Dimethylpropyl(nonyl)carbamoyl]amino]cyclohexyl] 3-[[2,2,5,5-tetramethyl-1,3-dioxane-4-carbonyl]amino]propanoate","3alpha,7alpha,24trihydroxy-5beta-cholestan-27-al","Cer(d17:1/20:4OH(15S))","Crataegolic acid","Methyl-[10]-shogaol","Hydroxyisocaproic acid","valyl-glutamate","Glutamylvaline","17-alpha-hydroxypregnenolone sulfate","Benzylparaben","Levonorgestrel","Cholyltyrosine(M570T379_1)","3-Methylbutyl 2-oxopropanoate","4-Hydroxyhexadecenoylcarnitine","Medicagenic acid","E-Guggulsterone","Coronin","4-Androsten-3beta,17beta-diol 17-sulfate","Glucocaffeic acid","n-acetylmuramyl-l-alanine","3-Nonanon-1-yl acetate","Indole-3-carboxaldehyde","2-Aminoethyl oleate","Stearic acid","8HPETE","3-Hydroxy-1-phenyl-1-octadecanone","N-(1-Hydroxyethyl)octadecanamide","3,3-Bis(carboxymethyl)hexadecanedioic acid","Dibutyl adipate","Aspartyl-Valine","Adrenosterone","Glutamate","17alpha-Dihydroequilin","ebelactone B","H-Asp(OBzl)-OH","2,3-Methylene suberic acid","Hydroquinone","methyl phenylglyoxalate","Geranic acid","Dibutyl malate","Chenodeoxycholic acid 3-sulfate","3-Methoxy-4-hydroxyphenylglycolaldehyde","7-[2-(1,2-Dihydroxy-3-oxooctyl)-3,5-dihydroxycyclopentyl]hept-5-enoic acid","Oxalic acid dibutyl ester","10,11-dihydro-20-trihydroxy-leukotriene B4","Monobutyl phthalate","Cer(d18:0/18:2(10E,12Z)+=O(9))","N-Docosahexaenoyl Proline","Asiatic acid","Vanillyl alcohol","11-Ketoprogesterone","Cer(d18:0/22:6OH(17))","Menthyl valerate","Dinonyl phthalate","3-Methyl-5-pentyl-2-furanheptanoic acid","Taurochenodeoxycholate","7-Methyluric acid","Lanceolatin C","Epoxymurin-A","Gypsogenin 3-O-b-glucuronide","Chavicol O-beta-glucopyranoside","[3,4,5,6-Tetrahydroxy-1-oxohexan-2-yl] 2-aminopropanoate","3-Sulfodeoxycholic acid","3beta-Hydroxy-5-cholestenoic acid (3-HCOA)","3-Methylbutyl 3-hydroxy-2-methylidenebutanoate","N-Linoleoyl Methionine","2-Hydroxy-4-methoxybenzophenone","3'-Hydroxy-N-methyl-coclaurine","4-Hydroxybenzyl alcohol","Acetyl tributyl citrate","Thymine","N-Stearoyl Aspartic acid","Docosanedioic acid","6-Hydroxy-3-oxotetradecenoic acid","1-Methyluric acid","isopentenyladenine-9-N-glucoside","Pelargonic acid","N-Docosahexaenoyl Aspartic acid","2-[(4,5-Dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)methylidene]undecanoic acid","N-Stearoyl Valine","Qing Hau Sau","N-Linoleoyl Threonine","11-Hydroperoxyoctadeca-9,12-dienoic acid","4-Hydroxyphenylacetic acid","Sarcosine","Bilobol","Ethyl 3-hydroxydodecanoate","16-Hydroxypalmitic acid","Taurine","Oxalic acid(M89T470_1)","N-Acetylgalactosamine","alpha-Terpineol butanoate","Licochalcone A","2'-Hydroxy-4',6'-dimethoxychalcone","3,5-Hexadienyl butyrate","Lithocholic acid","Maclurin","8-O-Methyloblongine [M]","17beta-Estradiol 17-(beta-glucuronide)","10-Hydroxy-3-oxooctadecatrienoic acid","Bornyl butyrate","FAHFA(18:0/6-O-16:0)","2-Hydroxyphenylacetic acid sulfate","trans-2-Hydroxycinnamate","Tridecanedioic acid","Glycochenodeoxycholate 7-sulfate","4,4'-Dihydroxystilbene","Myristoleic acid","Sulfoglycolithocholate","Isoliquiritigenin","3-O-beta-Galactopyranuronosyl-galactose","Pyrraline","1,2-dioctanoylglycerol","1-Hydroxypropan-2-yl 2-isopropyl-5-methylcyclohexyl carbonate","Di-n-decyl phthalate","trans-Vaccenic acid","Pentadeca-5,8-dienoylcarnitine","2-Amino-3-oxoadipate","3-(Acetyloxy)-2-hydroxypropyl octadecanoate","Perilloside C","cis-11-Eicosenoic acid","Sapienic acid","Momorcharaside B","5-oxo-prolyl-valine","Undecanoic acid","16,17-Didehydropregnenolone","17beta-Hydroxysteroid","Clinprost","11-Dehydro-2,3-dinor-txb2","9-Pentadecenoic acid","5a-Dihydrotestosterone sulfate","2-Aminobutyric acid","Dehydrolithocholic acid","Carbocyclic thromboxane A2","3,5-Dihydroxyphenylvaleric acid","Cholesterol glucuronide","Segesterone(M327T314_2_E_1)","Cubebininolide","Acetyltaurine","N-Eicosapentaenoyl Tryptophan","Glucosyl 2,6-Dimethyl-2,5-heptadienoate","beta-aspartyl-leucine","6-Pentadecylsalicylic acid","2,3-dinor-thromboxane B2","Carthamoside A1","1-heneicosanoyl-glycero-3-phosphate","Prolylhydroxyproline","hexadeca-7,10,13-trienoate","2-Propenoic acid, 2-(((2-methoxyphenyl)acetyl)amino)-","Pantothenate","10-Nitrooctadec-9-enoylcarnitine","Gitogenin","Decadienedioic acid","Cer(d18:0/22:5O(16,17))","Niranthin","[6]-Gingerol","Eicosapentaenoic acid","Uracil","11-Dehydrocorticosterone","Sebiferenic acid","FAHFA(16:0/7-O-18:0)","Fragransin B2","5-Aminolevulinic acid","Caprylic acid","Diisodecyl phthalate","DHAP(10:0)","Cer(d17:1/PGJ2)","NAE(18:2)","N-[(3a,5b,7b)-7-hydroxy-24-oxo-3-(sulfooxy)cholan-24-yl]-Glycine","Cholesterol sulfate","Ciprostene","Deoxycholylphenylalanine(M538T468_A_1)","Octyl gallate","soyasapogenol-B-23-O-beta-glucoside","10-(2,3-Dihydroxypropoxy)-10-oxodecanoic acid","N-Linoleoyl Lysine","Phenprobamate","3-Methoxy-2-(4-methylbenzoyl)-4H-1-benzopyran-4-one","9-Hydroxyoctadecanoic acid","12-Ketolithocholic acid","7,8-Dihydroxyflavone","Madasiatic acid","3alpha,7alpha,12alpha,24tetrahydroxy-5beta-cholestan-27-al","Phyltetralin","2-Dehydro-O-desmethylangolensin","Margaroylglycine","3-Hydroxylauric acid","Fragransin C1","3-Methyl-5-pentyl-2-furanpropanoic acid","Sabadelin","Plastoquinone 3","Adipic acid","Cer(d20:1/20:32OH(5,6))","Adrenic acid","2-(20-Hydroxyicosa-5,14-dienoylamino)acetic acid","3-Methylthiopropionic acid","5,6-Epoxy-18R-HEPE","N-Acetylmuramoyl-Ala","5-Heptyl-3-methyl-2-furanpentanoic acid","10-Hydroxystearate","cis-Cyclo(aspartylphenylalanyl)","N-Eicosapentaenoyl Glutamic acid","Homovanillic acid","4-carboxyglutamate","N-arachidonoyl-proline","Methylgingerol","2-Methyl-3-hydroxybutyric acid","alpha-Amylcinnamyl formate","Arachidonic acid (AA)","6-Acetamidohexanoic acid","2-Methylhippuric acid","2-[4-(sulfooxy)phenyl]acetic acid","2-Hydroxy-3-oxo-12-oleanen-28-oic acid","1,1'-[1,11-Undecanediylbis(oxy)]bisbenzene","2,2'-Iminodiacetic acid","N-Eicosapentaenoyl Leucine","Methyl 2-(10-heptadecenyl)-6-hydroxybenzoate","Cer(d20:1/20:3O(11S,12R))","Heptadecanoic acid","Hydroxyprolyl-Tyrosine","Xanthoangelol C","xi-5-Hydroxydodecanoic acid","Dimethylglycine","3-Hydroxyphenylacetic acid","N-Eicosapentaenoyl Proline","Phenylacetic acid","Caproic acid","phenylalanine methyl ester","Deoxyqinghaosu","N-arachidonoyl-serine","Palmitic acid","2-[2-(4-hydroxy-3-methoxyphenyl)ethyl]tetrahydro-6-(4-hydroxy-3,5-dimethoxyphenyl)-2H-pyran-4-ol","omega-Muricholic acid","3-hydroxytyrosol","13,14-dihydro-prostaglandin F1alpha","soyasapogenol B-3-O-beta-glucoside","Deoxycholylalanine","Cer(d20:1/20:5OH(12))","TUCARESOL","Arctigenic acid","Cyclohexyl propan-2-yl carbonate","N-Oleoyl GABA","3,4-Methylenesebacic acid","4-Hydroxycinnamic acid","Saccharopine","N-oleoyl-leucine","FAHFA(16:0/9-O-18:0)","Phenethyl salicylate","11-Hydroxy-9,15,16-trioxooctadecanoic acid","5-hydroxyphenylpropionylglycine","Propionic acid","12-Hydroxydodecanoic acid","2-hydroxyphenylpropionylglycine","Glyco-beta-muricholic acid","1-Methyl-2-oxopropyl butyrate","Gly-Val","3, 5-Tetradecadiencarnitine","1b,3a,12a-Trihydroxy-5b-cholanoic acid","Monomenthyl glutarate","5,6-DHET","Docosahexaenoic acid (DHA)","10-Nonadecenoic acid","Ethyl 2-(methylthio)acetate","Corchorifatty acid A","(3a,5b,7a,12a)-24-[(carboxymethyl)amino]-1,12-dihydroxy-24-oxocholan-3-yl-b-Glucopyranosiduronic acid","2-(4-Allyl-2-methoxyphenoxy)-1-(4-hydroxy-3-methoxyphenyl)-1-propanol","2-Hydroxyglutaric acid diethyl ester","Methyl levulinate","Methyl 3-(methylthio)propanoate","8-hydroxy-3-oxohexadecadienoic acid","tetracosa-6,9,12,15,18,21-hexaenoate","methylsalicylate-2-O-beta-glucoside","Benzoxazine-6-carboxylic acid","3-Methylglutaric acid","Methionyl-Serine","Royal jelly acid","N-methyl-phenylalanine","Diethyl malate","10,16-Dihydroxyhexadecanoic acid","3-Hydroxyoctanoic acid","12HHT","Ginsenoyne B","Androstane-3,17-diol 17-sulfate","Pamaqueside","Hydroxyphenyllactic acid","gibberellin A17","Dihydroclusin","Notoginsenoside R10","9-Hydroxydecanoic acid","Salicylic acid","Alanine","CE(14:0)","N-Acetylhistidine","4-Hydroxyphenylacetylglutamic acid","Levulinic acid","CE(5-iso PGF2VI)","N-Lactoylisoleucine","Pinane thromboxane A2","1-(gamma-Glutamylamino)cyclopropanecarboxylic acid","6a,12a-Dihydroxylithocholic acid","1-Carboxyethylisoleucine","2-n-Propyl-4-oxopentanoic acid","16alpha-Hydroxyestrone","5beta-Pregnane-3alpha,17alpha,20alpha-triol","18-(3-Ethylcycloprop-1-en-1-yl)-14-hydroxyoctadeca-4,7,10,12,16-pentaenoylcarnitine","Cibaric acid","Furfuryl isovalerate","Menthyl isovalerate","O-arachidonyl-carnitine","LysoPI(18:1(9Z)/0:0)","beta-aspartyl-alanine","3alpha-Corosolic acid","LysoPE(P-18:1(9Z)/0:0)","14-Methylhexadecanoicacid","METHYL 4-FORMYLBENZOATE","2,4,7-Decatrienoic acid","Adenosine monophosphate (AMP)","11-Hydroxyeicosatetraenoate glyceryl ester","Cer(d18:0/18:2(9Z,11E)+=O(13))","Glycerol 1,2-didodecanoate 3-tetradecanoate","Dibenzyl carbonate","3b,4b,7a,12a-Tetrahydroxy-5b-cholanoic acid","Isobutyrylglycine","Galeon","3-oxo-myristate","Daurisoline","3-Amino-4-methylpentanoic acid","Benzyl salicylate","Palmitoylcarnitine","Val-Gly","Undecanedioic acid","Corydaline","Annocherin A","[4]-Gingerol","Cer(d18:0/20:3O(11S,12R))","1-icosanoyl-sn-glycerol 3-phosphate","1-Palmitoyl-2-linoleoyl-3-acetyl-rac-glycerol","3a,6b,7b,12a-Tetrahydroxy-5b-cholanoic acid","Bornyl acetate","Heptadecanoyl carnitine","Isolithocholic acid","O-Ethylcubebin","N-Myristoyl Tyrosine","Arlacel A","Convallamarogenin","Isoliensinine","12-Keto-leukotriene B4","Cer(d17:1/PGF1alpha)","Urocortisol","Nerolidyl acetate","1,2-dipalmitoyl-phosphatidylserine","4-Acetoxy-4-androstene-3,17-dione","Fenoprofen","gamma-glutamyl-valine","Tridecyl phloretate","Corosolic acid","N-arachidonoyl-phenylalanine","Ethyl 3-oxohexanoate","3,4,5-Trimethoxycinnamic acid","16,16-Dimethylprostaglandin E2","Indole-3-carboxylic acid","5,6-Dihydroxyprostaglandin F1a","[6]-Gingerdiol 3,5-diacetate","3-hydroxyoct-1-enoylglycine","Estrone","Cer(d20:1/20:4OH(5S))","ent-6,16-Kauradien-19-oic acid","Tetracosanedioic acid","Cer(d18:1/18:1O(9S,10R))","Cer(d20:1/20:3O(14R,15S))","13HOT","Cer(d18:0/22:6OH(14))","Linalyl isobutyrate","(4Z,9a)-9-(3-Methyl-2-butenoyloxy)-4,10(14)-oplopadien-3-one","Deoxyinosine","Glu-Leu","Urolithin A","2,4-Dihydroxychalcone","Octyl 2-furoate","N-(3-Methylbutyl)acetamide","1-(11Z-eicosenoyl)-glycero-3-phosphate","1-Hydroxy-2,5,12,15-heneicosatetraen-4-one","Androstenediol 3-sulfate","N-Acetylvaline","Dimethyl [1,1'-biphenyl]-4,4'-dicarboxylate","7-Oxodehydroepiandrosterone 3-acetate","N-trans-Feruloyl-4-O-methyldopamine","Prostaglandin E2 methyl ester","8-nonenoylglycine","[4]-Gingerdiol 3,5-diacetate","Vulpecholate","estradiol alone","(S,S,Z)-dinor-12-oxo-phytodienoate","alpha-Muricholic acid","Alliospiroside D","1-Methylxanthine","[10]-Gingerol","Phenol","Leu-Asp","Octadecanedioic acid","4,4'-Dihydroxy-3,3'-dimethoxy-9,9'-epoxylignan","3-Hydroxyanthranilic acid","Methyl-alpha-aminoisobutyric acid","3-hydroxyundecanoic acid","Octanoylglucuronide","Nordihydrocapsiate","Ethyl levulinate","2-Phenyl-1,3-propanediol monocarbamate","N-palmitoyl-alanine","Dimethylmatairesinol","Deoxycholylisoleucine","4-Hydroxyderricin","7-Hydroxy-3-oxo-cholest-4-en-26-oic acid","LysoPE(P-16:0/0:0)","Glycine","cis-4-Decenedioic acid","Chenodeoxycholylisoleucine","Val-Ala","Liensinine","Oleic acid","3-hydroxyphenylpropionylglycine","Glutaric acid","2-Hydroxy-3-phenylpropenoate","Menthyl acetate","Menthyl acetoacetate","Methyl hippurate","Glutamylhydroxyproline","2-[Acetamido(benzoyl)amino]pentanedioic acid","2-Methylglutaric acid","3-Hydroxyphenyllactate","Cer(d18:0/18:1O(9S,10R))","Arjunolic acid","Ethyl (E,Z)-decadienoate","Gentisaldehyde","nortestosterone laurate","3-Hydroxytetradec-4-enedioylcarnitine","2-Hydroxypalmitic acid","Tridecanoylcarnitine","Detca","2-Methylbutyl 3-hydroxy-2-methylidenebutanoate","hydroxysyringaresinol","Isovaleric acid","gemeprost","3-Hydroxydecanoic acid","3-hydroxynonanoate","Androst-4-ene-3,6,17-trione","Quillaic acid","2-keto-4-hydroxybutanoate","Dihydrocortisol","20a,20b-Dihomo-9-oxo-11R,15S-dihydroxy-5Z,13E-prostadienoic acid","testosterone sulfate","3-Oxocholic acid","Estradiol-17alpha 3-glucuronoside","3-Methylxanthine","Epomuricenin B","Prostaglandin F2alpha","Di-n-pentyl phthalate","Dioscoretine","Euscaphic acid","Hexadecanedioic acid","7alpha,12alpha-Dihydroxy-3-oxochol-4-enoate(M403T382_1)","N-Myristoyl Glutamic acid","N-Stearoyl tyrosine","2-Aminoisobutyric acid","2,4-Di-tert-butylphenol","Deoxycholyl-dopa","Stearoylglycine","2-Aminoadipate 6-semialdehyde","Serylmethionine","6-Hydroxyluteolin 7-glucoside","Cer(d20:1/20:3O(8,9))","Uridine","Oblongine [M]","9-Methyluric acid","Eicosanedioic acid","N-Linoleoyl Isoleucine","Capsiate","Hydroxyprogesterone caproate","alpha-Terpinyl glucoside","2-Hydroxyadenine","3-Hydroxymyristic acid","Indole-3-carbinol","Proline","1-Octen-3-yl glucoside","Crispane","16-B1-phytoprostane","Agavoside B","3-Hydroxypropionic acid (beta-lactic acid)","Polyoxyethylene (600) monoricinoleate","Mono-(2-ethyl-5-carboxypentyl) phthalate","Citronellol glucoside","cis-[8]-Shogaol","[7]-Gingerol","3-Hydroxylinoleoylcarnitine","[6]-Gingerdiol 3-acetate","Glycoursodeoxycholic acid","7alpha,25-Dihydroxycholesterol","Suberylglycine","N-Acetyltryptophan","5-Cholesten-3beta-25-diol-3-sulfate","aldehydo-colitose","12,13-DiHOME","N-Eicosapentaenoyl Valine","kaempferol 7-O-neohesperidoside","4-Androsten-3beta,17beta-diol 3-sulfate","13-Hydroperoxyoctadeca-9,11-dienoic acid","Gingerenone B","2,3-Dinor-6-keto-prostaglandin F1 a","Melevodopa","Dihydroconiferyl alcohol","Gingerenone C","3-Oxodecanoate","cis-Sabinene hydrate acetate","Gibberellin A80","7-[3-Hydroxy-2-[3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxocyclopentyl]hept-2-enoic acid","Dimethylbenzyl carbinyl hexanoate","Isocarbacyclin","Sucrose","Oxalic acid(M89T429_3_1)","Docosahexaenoic acid ethyl ester","Mannose","5alpha-Pregnan-20alpha-ol-3-one","Dodecyl gallate","LPE(16:0)","Curcumin I","Tetracosahexaenic acid","N6-Acetyllysine","p-Hydroxyphenethyl trans-ferulate","Gibberellin A125","Prostalene","Hexyl acrylate","Asparagoside B","Sorbitan laurate","N-Formylphenylalanine","Gibberellin A94","4-(2-Aminophenyl)-2-formamido-4-oxobutanoic acid","10-Hydroperoxydocosahexaenoic acid","11-Methoxynoryangonin","geranyl beta-glucopyranoside","Gibberellin A99","Licarin C","1-Acetoxy-2-hydroxy-5,12,15-heneicosatrien-4-one","13-(3-Methyl-5-pentylfuran-2-yl)tridecanoylcarnitine","O-lauroyl-carnitine","N-Acetylglucosamine","Suberic acid","CE(PGE1)","Dihydrocapsiate","Gibberellin A66","Caffeoylferuloylspermidine","Cer(d18:0/20:3O(14R,15S))","1-Hydroxy-1-phenyl-3-octadecanone","2-Phenylethyl octanoate","7-Oxononane-1,1,9-tricarbaldehyde","Hydroxyacetone","Hexyl salicylic acid","Gibberellin A102","FAHFA(18:0/7-O-16:0)","1,3-Butyleneglycol dimethacrylate","9-Hydroxy-10-undecenoic acid","aspartyl-leucine","Gibberellin A70","Monomenthyl succinate","7alpha-Methyl-17-ethinyl-19-nortestosterone","Aspartate","2,4-Dihydroxy-6-(8-pentadecenyl)benzoic acid","Hexadecatrienoic acid","Pimelic acid","Licoagrochalcone B","7alpha,12alpha,26-trihydroxycholest-4-en-3-one","Valine","Carboxy-ibuprofen","1-O-Myristoyl-2-acetyl-glycerol","3'-Methoxy-[6]-Gingerdiol 3,5-diacetate","Tripoxyrollin","3,4-dimethylidenenonanedioylcarnitine","Homocysteic acid","Deoxycholyltyrosine","Nepetalinic acid","Pregabalin","Bilirubin","9-Oxo-10(E),12(E)-octadecadienoic acid","Leu-Leu","Cer(d20:1/20:5OH(18))","3,4-Methylene suberic acid","7-Sulfocholic acid","Coprine","NAE(16:0)","Cer(d18:0/18:3(9,11,15)-OH(13))","2,3-Dimethylsuccinic acid","Capsicoside A1","Heliannone A","1-Phenyl-1,3-octadecanedione","1-Aminocyclopropane-1-carboxylic acid","Adenine(M134T76_1)","4-(Ethoxymethyl)-2-methoxyphenol","Hexadecyl ferulate","N-palmitoyl-threonine","Propyleneglycol diacetate","Taurodeoxycholic acid 3-glucuronide","Glyco-gamma-muricholic acid","2-Hydroxy-3-methylpentanoic acid","Caffeic acid 3-glucoside","N-Stearoyl Methionine","Mycophenolate","8HETrE","N-Myristoyl Valine","17beta-Dihydroequilin","5-[4-Hydroxy-2-[3-hydroxyoct-1-enyl]oxan-3-yl]pent-3-enoic acid","N-Methylporphyroxine","Isoamyl p-anisate","2-Aminoadipic acid","N-oleoyl-tyrosine","Leoligin","Yakuchinone A","N-(4-Aminobenzoyl)-L-glutamic acid","tripropionin","3-Hydroxyisovaleric acid","Cer(d16:1/20:32OH(5,6))","FAHFA(16:0/6-O-18:0)","N-Linoleoyl Tyrosine","Misoprostol","Dodecanoic acid","1,5-Dibutyl methyl hydroxycitrate","LysoPE(P-18:0/0:0)","6-Methyldodecanoylcarnitine","10-Hydroxydecanoic acid","2-[2-(4-Hydroxy-3-meyhoxyphenyl)ethyl]tetrahydro-6-(4,5-dihydroxy-3-methoxyphenyl)-2H-pyran-4-ol","Taxiresinol","5beta-Cholanic acid","2-Hydroxyestrone","1,2,4,5-Tetramethoxybenzene","N-palmitoyl-serine","2-Hydroxyethanesulfonic acid","5-Pentyl-2-furanoctanoic acid","Octadecyl ferulate","5-Isoxazoleacetic acid, 4,5-dihydro-3-(4-hydroxyphenyl)-, methyl ester","24-Methylcholestanol ferulate","Oleoylethanolamide","4-hydroxyoct-1-enoylglycine","Rockogenin","13(S)-HODE","Creatinine(M112T45_1)","3-Methylcatechol","Hyodeoxycholic acid","Mono-(2-ethyl-5-hydroxyhexyl) phthalate","3-Carbamoyl-2-phenylpropionic acid","Tetracosapentenoic acid","Cholenic acid","8-Decene-4,6-diyn-1-yl 3-methylbutanoate","ROSIN","ent-17-Oxo-15-kauren-19-oic acid","13-Oxo-9,11-tridecadienoic acid","7-(4-Hydroxy-3-methoxyphenyl)-5-methoxy-1-phenyl-3-heptanone","sinapoyltyramine","Progesterone","Ethisterone","Isonicotinic acid","2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(4-hydroxy-3-methoxyphenyl)-1-propanol","Sodium (4-methoxybenzoyloxy)acetate","Ile-Asp","3,4-Dihydroxyphenylacetic acid","3-carboxy-4-methyl-5-pentyl-2-furanpropanoic acid","Menthyl O-beta-glucoside","3-Hydroxyhippuric acid","2-Methylvaleric acid","Formylanthranilic acid","3-hydroxyhexadecanoate","xi-7-Hydroxyhexadecanedioic acid","norcholate","4-cholesten-7¦Á,12¦Á,24-triol-3-one","N2-Acetyllysine","4OH-Stil-2-O-glu","Glycerol 1,3-didodecanoate 2-decanoate","17-Hydroxydocosa-4,7,10,13,15,19-hexaenoylcarnitine","[4]-Isogingerol","5-Hydroxyvalproic acid","alpha-Methyl-4-carboxyphenylglycine","5-Hydroxytryptophan","2-(4-Hydroxy-3-phenoxyphenyl)propanoic acid","Furfuryl octanoate","N-Linoleoyl GABA","beta-Alanine","N-Formylmethionine","2,3-Dihydroxy-2-methylbutanoic acid","Cholesteryl palmitate","Cadinene-gamma","Cer(d18:0/18:3(10,12,15)-OH(9))","3-Indoleacrylic acid","Dimethyl succinate","Succinate","Tetranorprostanedioic acid","Cer(d18:0/20:3O(8,9))","2,3-Dihydroxypropyl octanoate","3-Hydroxynonyl acetate","4-Anilino-4-oxobutanoic acid","24-Nor Ursodeoxycholic Acid","9-Oxooctadecanoic acid","7-[3-(3-Hydroxy-4-phenylpent-1-enyl)-7-oxabicyclo[2.2.1]heptan-2-yl]hept-5-enoic acid","4-hydroxy-3-methoxybenzoic acid ethyl ester","[8]-Dehydrogingerdione","3-Hydroxysebacic acid(M217T283_A_1)","N-Oleoyl Isoleucine","Betamipron","[3,17-Dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-1-yl] propanoate","4-Hydroxyproline","Hydrangeic acid","2,3-Dinor-6,15-dioxo-13,14-dihydroprostaglandin F1alpha","1-(2-Furanyl)-1-pentanone","1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione","1-Nonadecanoyl-glycero-3-phosphoserine","4-O-alpha-Glucopyranuronosyl-galactose","6-Ethylchenodeoxycholic acid","Methyl N,N-dimethylanthranilate","17-hydroxyprogesterone caproate(M443T437_1)","3-(3-Hydroxyphenyl)-3-hydroxypropanoic acid","9,12-Octadecadiynoic acid","Diethylene glycol dimethacrylate","N-palmitoyl-aspartate","4,4'-Dihydroxy-2',6'-dimethoxychalcone","3-Methyladipic acid","Pentadecanoic acid","5-(4-Carboxybutylperoxy)pentanoic acid","3-Heptadeca-1,3-dienyloxirene-2-carboxylic acid","Nordihydroguaiaretic acid","Phenylacetylglycine","Cer(d18:0/20:4OH(5S))","Hydroxyprolyl-Proline","tetracosa-9,12,15,18,21-pentenoate","Ferulic acid","3-Phenylpropanoic acid","Asiminenin A","Estrone glucuronide","3alpha,7alpha-Dihydroxy-5beta-cholestanate","Isoamyl 2-furoate","Cer(d18:0/LTE4)","N-Linoleoyl Valine","Indole-3-propionic acid","N-Acetylmannosamine","Actinidic acid","Taurodeoxycholate","Chenodeoxycholylalanine","Fragransol A","Indolelactic acid","3alpha,7alpha,12alpha,25-Tetrahydroxy-5beta-cholestane-24-one","cellobiotol","10-Acetoxy-8-heptadecene-4,6-diyn-3-ol","Taurocholate","Gibberellin A45","Guaicyl phenylacetate","16beta-OH-Dhea sulfate","Cortol","N-Myristoyl Leucine","N-palmitoyl-glutamate","Diethyl 2-methyl-3-oxosuccinate","Bisnorcholic acid","Barringtogenol C","Isosteviol","Estradiol dipropionate","beta-Muricholic acid","Octyl phenylacetate","3-Hydroxyarachidonoylcarnitine","Arachidonoyl Serinol","3-(3-Hydroxyphenyl)propanoic acid","p-Methylhippuric acid","Dimethylmalonic acid","3-Amino-3-(4-hydroxyphenyl)propanoic acid","12-Methyltridecanoic acid","Linalool 3-glucoside","A-Homo-3a-oxa-5beta-olean-12-en-3-one-28-oic acid","16-Dehydroprogesterone","Cer(d18:1/6:0)","Myristic acid","2,4,6,8,10,12-Docosahexaenoic acid, ethyl ester","4-Hydroxyestrone","Homoserine","gamma-Linolenic acid","alpha-Linolenic acid","Glyceryl palmitoleate","5-Oxohexanoic acid","Formylkynurenine","Gibberellin A23","Gibberellin A22","2-Arachidonoylglycerol","6-hydroxyphenylpropionylglycine","Ethyl 3-mercaptopropanoic acid","Cer(d20:1/20:4OH(15S))","LPE(18:1(9Z)/0:0)","Gibberellin A20","N-Methyl-14-O-demethylepiporphyroxine","Bis(2-propylheptyl) phthalate","Gibberellin A15","16-Hydroxy-9,12,14-octadecatrienoic acid","3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestanoate","7,18-Dihydroxykaurenolide","Resveratrol","Cymegesolate","4,7,10,13-Hexadecatetraenoic acid","2-Hydroxybutyric acid","Cholylmethionine","Methionine(M148T49_1)","7-nonenoylglycine","m-Methylhippuric acid","Schidigerasaponin C2","5-Oxo-6-trans-leukotriene B4","2-Ethyl-2-hydroxybutyric acid","alpha-Methylphenylalanine","19-Methoxypomolic acid 3-arabinoside","Neochlorogenin","Kanzonol R","TetraHCA","Cavipetin C","1-Carboxyethylleucine","20-Cooh ltb4","5HETE","16-Ketoestradiol","Gly-Phe","Moracin B","Moracin F","N-Eicosapentaenoyl Isoleucine","Kanzonol O","Kanzonol N","4-Hydroxyphenacyl alcohol","Kanzonol M","flavokawin","Lumichrome","Hydroxyprolyl-Glutamate","9,10,18-Trihydroxystearate","1H-Indol-3-yl 2-hydroxyacetate","Methylimidazoleacetic acid","Dihydroxyacetone","12,15-Epoxy-13,14-dimethyleicosa-12,14,16-trienoic acid","Cortolone","Cholic acid glucuronide","N5-acetylornithine","Cholic acid","[10]-Dehydrogingerdione","Matsutakic acid A","Cer(d16:1/PGF1alpha)","2-[3-(sulfooxy)phenyl]acetic acid","Ethylmalonic acid","Dieporeticenin","hispidin","Amyl 2-furoate","Iriflophenone","N-Docosahexaenoyl Alanine","Allocholic acid","N-[2-(3,4-Dimethoxyphenyl)ethyl]-3,4-dimethoxycinnamic acid amide","Misoprostol acid","4-Hydroxybenzoic acid","xi-5-Hydroxydecanoic acid","15-HETE","Valproic acid","Geranyl tiglate","Sebacic acid","5-[2-Aminopropyl]-2-hydroxybenzoic acid","Diethyl malonate","2-O-beta-Glucopyranuronosyl-mannose","2-Hydroxystearic acid","Prostaglandin F2alpha methyl ester","Chenodeoxycholylleucine","13(S)-HpOTrE","Monoisononyl phthalate","7-Ketodeoxycholic acid","3-Phenoxybenzoic acid","Yangambin","Menthyl (R,S)-3-hydroxybutyrate","Annosquamosin A","[6]-Gingerdiol 5-acetate","Acaciabiuronic acid","Diisobutyl phthalate","Acetomenaphthone","Cosahexaenoic acid","Methyl n-acetylanthranilate","Pyroglutamic acid","2,5-Bis(3,4,5-trimethoxyphenyl)tetrahydrofuran","Chenodeoxycholic acid sulfate","1-(linoleoyl)-sn-glycero-3-phosphoethanolamine","Melilotigenin","3,3',4,4'-Tetrahydroxy-2-methoxychalcone","5-Hydroxy-1-(3-hydroxy-4-methoxyphenyl)decan-3-one","N-Myristoyl Threonine","Dodecanedioic acid","Benzoic acid, 4-[[(2,5-dihydroxyphenyl)methyl]amino]-, methyl ester","PC(18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z))","gamma-Glutamyl-beta-phenyl-beta-alanine","Isomaltose","16-Hydroxy-3-oxo-12-oleanen-28-oic acid","Isogingerenone B","N-palmitoyl-valine","2-isopropoxyphenol","5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenyl-3-heptanone","3-Hydroxyisoheptanoic acid","Triethylene glycol dimethacrylate","2-Hydroxyisobutyric acid","Tauro-beta-muricholic acid","4-Isopropoxyphenol","Cer(d18:0/18:1O(12,13))","Lactate","(4Z,9a)-9-Angeloyloxy-4,10(14)-oplopadien-3-one","Velaresol","2'-Hydroxy-4,4',6'-trimethoxychalcone","Thymidine","2-Hydroxyhexanoic acid","3,4-Dihydroxyphenylvaleric acid","N-Stearoyl phenylalanine","Ursodeoxycholic acid","Isocaproic acid","ent-15-Oxo-16-kauren-19-oic acid","Isotaxiresinol","Methylmalonic acid","N-Tigloylglycine","Malic acid","3-Oxododecanoic acid","[14]-Gingerol","1-Arachidonoylglycerol","Adipoylglycine","Glaucamine","farnesyl acetate","Erucamide","5beta-Cyprinolsulfate","2-(3-Phenylpropoxyimino)butanoic acid","5-methoxytryptophan","Nordeoxycholic acid","Theanine","Lauroyl peroxide","Adipate semialdehyde","N-Acetyltyrosine","Lucyin A","Nonadecanoic acid","Isocorydine","11-Hydroxyyangonin","12-Hydroxystearic acid","4-Methoxybenzyl alcohol","androsterone sulfate","Methyl-[10]-gingerol","Soyasaponin III","Raffinose","Taurodehydrocholic acid","4-Aminobutyric acid (GABA)","Azelaic acid","N-arachidonoyl-glutamate","Bufalin (Drug)","Cer(d17:1/20:4OH(18R))","hexadecatetra-4,7,10,13-enoate","16alpha-Hydroxy DHEA 3-sulfate","3-hydroxyheptanoic acid","Reticuline","2b,3a,7a,12a-Tetrahydroxy-5b-cholanoic acid","Nicotinate","Dodecyl-beta-maltoside","Curcumin II","N-Myristoyl Isoleucine","Methyl Arachidonate","2-(3-Hydroxy-1H-indol-2-yl)acetic acid","3-(3-Methyl-5-pentylfuran-2-yl)propanoylcarnitine","Deoxycholic acid","alanyl-aspartate","Helichysetin","Oxypinnatanine","2-Methylpropyl 3-hydroxy-2-methylidenebutanoate","N-Linoleoyl Serine","3',4'-Dihydroxychalcone","Methyl-4-hydroxybenzoate sulfate","Isatin","2-Hydroxyphenylacetic acid","3,7,12-trihydroxycoprostanate","resolvin D5","Dityrosine","N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]-N-nitrosoacetamide","Arbaprostil"],"additional_accession":[]},"is_claimable":false,"name":"The influence of canine parvovirus infection on the metabolome of captive Chinese and Malaysia pangolins","description":"Canine parvovirus (CPV) infection poses a serious threat to pangolins, but the characteristics of the host response at the metabolic level remain unclear. In this study, we used non-targeted fecal metabolomics to systematically analyze differences in fecal metabolites in the Malaysian pangolin and the Chinese pangolin before and after CPV infection. The results indicated that CPV infection significantly altered the fecal metabolic profiles of both pangolin species. In the Malaysian pangolin, post-infection differential metabolites were primarily enriched in lipid metabolic pathways, such as α-linolenic acid and arachidonic acid metabolism, as well as inflammation-related pathways, including ferroptosis and necrotic apoptosis. Whereas the Chinese pangolin exhibited not only lipid metabolism dysregulation but also amino acid metabolic reprogramming and bile acid metabolism dysregulation. There were significant differences in metabolic responses between the two species, with the Malaysian pangolin characterized by lipid metabolism abnormalities, while the Chinese pangolin showed a greater focus on amino acid and bile acid metabolism. This study revealed the specific metabolic response of pangolins infected with CPV, provided potential fecal metabolic biomarkers for the early identification of CPV infection in pangolins, and provided a new theoretical basis for disease monitoring and intervention in pangolin conservation medicine.","dates":{"publication":"2026-08-22","submission":"2026-08-22"},"accession":"MTBLS15426","cross_references":{"HMDB":["HMDB0000122","HMDB0000055","HMDB0000975","HMDB0003282","HMDB0062473","HMDB0000660","HMDB0028929","HMDB0000048","HMDB0246950","HMDB0004988","HMDB0014581","HMDB0062702","HMDB0240732","HMDB0011756","HMDB0000062","HMDB0000364","HMDB0000687","HMDB0003334","HMDB0001200","HMDB0004193","HMDB0001645","HMDB0000450","HMDB0000467","HMDB0241347","HMDB0013248","HMDB0000413","HMDB0013253","HMDB0000043","HMDB0000132","HMDB0000157","HMDB0000182","HMDB0041947","HMDB0000159","HMDB0000292","HMDB0003355","HMDB0241206","HMDB0000050","HMDB0028911","HMDB0000696","HMDB0031641","HMDB0000158","HMDB0243946","HMDB0000034","HMDB0062769","HMDB0028920","HMDB0000172","HMDB0002039","HMDB0011174","HMDB0001325","HMDB0013287","HMDB0001414","HMDB0029130","HMDB0000097","HMDB0000562","HMDB0000197","HMDB0002064","HMDB0014855","HMDB0001390","HMDB0033244","HMDB0028932","HMDB0000512","HMDB0011177","HMDB0032567","HMDB0002284","HMDB0000036","HMDB0241308","HMDB0000030","HMDB0000177","HMDB0010383","HMDB0061918","HMDB0000929","HMDB0011749","HMDB0001123","HMDB0001539","HMDB0004194","HMDB0002322","HMDB0000234","HMDB0000244","HMDB0013302","HMDB0253028","HMDB0250930","HMDB0003134","HMDB0241313","HMDB0005066","HMDB0304810","HMDB0005079","HMDB0241783","HMDB0028941","HMDB0253025","HMDB0000594","HMDB0000309","HMDB0000068","HMDB0000870","HMDB0013624","HMDB0000819","HMDB0001250","HMDB0029000","HMDB0000210","HMDB0012451","HMDB0006773","HMDB0000933","HMDB0006050","HMDB0001940","HMDB0005028","HMDB0000722","HMDB0038804","HMDB0028935","HMDB0003550","HMDB0241735","HMDB0244096","HMDB0000878","HMDB0008038","HMDB0014449","HMDB0000900","HMDB0002719","HMDB0031079","HMDB0242423","HMDB0255152","HMDB0242401","HMDB0240746","HMDB0012558","HMDB0012560","HMDB0062686","HMDB0062712","HMDB0006228","HMDB0030996","HMDB0013652","HMDB0013659","HMDB0028942","HMDB0001421","HMDB0038057","HMDB0304197","HMDB0242400","HMDB0242391","HMDB0242413","HMDB0033583","HMDB0036941","HMDB0012555","HMDB0250169","HMDB0242379","HMDB0041315","HMDB0033458","HMDB0001276","HMDB0002189","HMDB0038063","HMDB0038656","HMDB0036849","HMDB0062794","HMDB0012167","HMDB0257918","HMDB0250953","HMDB0032783","HMDB0036312","HMDB0034196","HMDB0060725","HMDB0038180","HMDB0003069","HMDB0012454","HMDB0006852","HMDB0303099","HMDB0033825","HMDB0302776","HMDB0006002","HMDB0241948","HMDB0032680","HMDB0253286","HMDB0031840","HMDB0006849","HMDB0304095","HMDB0001231","HMDB0034199","HMDB0001043","HMDB0040165","HMDB0289918","HMDB0289917","HMDB0302523","HMDB0302758","HMDB0031080","HMDB0041497","HMDB0241436","HMDB0039425","HMDB0037717","HMDB0303983","HMDB0012562","HMDB0000350","HMDB0011662","HMDB0039133","HMDB0062417","HMDB0030995","HMDB0013649","HMDB0037701","HMDB0029863","HMDB0244154","HMDB0004668","HMDB0035845","HMDB0242377","HMDB0006528","HMDB0013243","HMDB0240262","HMDB0013631","HMDB0029131","HMDB0040640","HMDB0006327","HMDB0001976","HMDB0255161","HMDB0010382","HMDB0003876","HMDB0040748","HMDB0012165","HMDB0040764","HMDB0289923","HMDB0290058","HMDB0290057","HMDB0000712","HMDB0260381","HMDB0241917","HMDB0242090","HMDB0035500","HMDB0034349","HMDB0257877","HMDB0033634","HMDB0260195","HMDB0247207","HMDB0289855","HMDB0289873","HMDB0290028","HMDB0290065","HMDB0242371","HMDB0242422","HMDB0251339","HMDB0254570","HMDB0000474","HMDB0241982","HMDB0241565","HMDB0000253","HMDB0029113","HMDB0243971","HMDB0000424","HMDB0004026","HMDB0032145","HMDB0001161","HMDB0037820","HMDB0290006","HMDB0290005","HMDB0290092","HMDB0290091","HMDB0290165","HMDB0242373","HMDB0030507","HMDB0039530","HMDB0255898","HMDB0302124","HMDB0030482","HMDB0010386","HMDB0035585","HMDB0244664","HMDB0001244","HMDB0038521","HMDB0248080","HMDB0241769","HMDB0001203","HMDB0035862","HMDB0034293","HMDB0249591","HMDB0289884","HMDB0289883","HMDB0290117","HMDB0303029","HMDB0033677","HMDB0061700","HMDB0062339","HMDB0241778","HMDB0004236","HMDB0258859","HMDB0000328","HMDB0062742","HMDB0039020","HMDB0248132","HMDB0033243","HMDB0241692","HMDB0001337","HMDB0030425","HMDB0062336","HMDB0000207","HMDB0035300","HMDB0028998","HMDB0060055","HMDB0029091","HMDB0002815","HMDB0013633","HMDB0010210","HMDB0032033","HMDB0260116","HMDB0000308","HMDB0000391","HMDB0000460","HMDB0010370","HMDB0289852","HMDB0289856","HMDB0290015","HMDB0290139","HMDB0290110","HMDB0290109","HMDB0251720","HMDB0028914","HMDB0028951","HMDB0241999","HMDB0032488","HMDB0010369","HMDB0037391","HMDB0007972","HMDB0244668","HMDB0094649","HMDB0040587","HMDB0241604","HMDB0039021","HMDB0258442","HMDB0246975","HMDB0013625","HMDB0002027","HMDB0302027","HMDB0289874","HMDB0000678","HMDB0061701","HMDB0257364","HMDB0033464","HMDB0060054","HMDB0031410","HMDB0012559","HMDB0304028","HMDB0302668","HMDB0304950","HMDB0246261","HMDB0302566","HMDB0000520","HMDB0001968","HMDB0303873","HMDB0248273","HMDB0038256","HMDB0242033","HMDB0030326","HMDB0013279","HMDB0242047","HMDB0241926","HMDB0242188","HMDB0256808","HMDB0010410","HMDB0000927","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