Metabolites were identified by spectral matching against three public mass spectral databases: HMDB (Human Metabolome Database; http://www.hmdb.ca/), Metlin (https://metlin.scripps.edu/), and KEGG (Kyoto Encyclopedia of Genes and Genomes; https://www.kegg.jp/kegg/pathway.html). Identification was based on matching of precursor m/z and MS/MS spectra with mass error tolerance of ±5 ppm. Significantly differentially abundant metabolites (DAMs) between control and straw-treatment groups were identified using the following criteria: (1) Variable importance in projection (VIP) > 1.0 from orthogonal partial least squares discriminant analysis (OPLS-DA); (2) Unadjusted Student's t-test p-value < 0.05; (3) Model validity was assessed using 7-fold cross-validation and 200 permutation tests; models with permuted R²Y and Q² lower than the original, and negative Q² regression intercept were considered valid. Metabolite identifications were classified according to Metabolomics Standards Initiative (MSI) confidence levels: Level 1 (confirmed with authentic standard), Level 2 (putative annotation based on spectral similarity to databases), or Level 3 (putative annotation with partial structure elucidation). Pathway analysis was performed using KEGG database and scipy.stats package in Python, with pathways reaching p < 0.05 in both transcriptomics and metabolomics datasets regarded as jointly significant.
"],"repository":["MetaboLights"],"study_status":["Public"],"ptm_modification":[""],"instrument_platform":["Liquid Chromatography MS - negative - reverse-phase","Liquid Chromatography MS - positive - reverse-phase"],"chromatography_protocol":["Chromatographic separation was performed using a UHPLC system (Thermo Fisher Scientific, Waltham, MA, USA) equipped with a Waters HSS T3 column (100 mm × 2.1 mm i.d., 1.8 μm). The column temperature was maintained at 40 °C. Mobile phase A consisted of 0.1% formic acid in water/methanol (95:5, v/v), and mobile phase B consisted of 0.1% formic acid in acetonitrile/methanol/water (47.5:47.5:5, v/v/v). Separation was achieved using the following gradient program: 0–1 min: 2% B; 1–9 min: 2–95% B (linear); 9–10 min: 95–100% B; 10–12 min: 100% B; 12–13 min: 100–2% B. Flow rate was 0.40 mL/min. Injection volume was 3 μL.
"],"publication":["Bacterial cells harvested at peak enzyme activity were subjected to untargeted metabolomic profiling to evaluate metabolic changes during straw degradation compared to control (CK) groups. Samples were extracted using pre-chilled methanol–water (4:1, v/v) and analyzed on a UHPLC-Q Exactive HF-X system operating in both positive and negative ionisation modes. Metabolites were identified by database matching against HMDB, KEGG, and Metlin. Downstream analyses integrated metabolomic findings with t arrow_drop_downmore."],"submitter_affiliation":["inner mongolia university"],"submitter_name":["Dieu Anh"],"organism_part":["culture supernatant"],"technology_type":["mass spectrometry assay"],"disease":[""],"extraction_protocol":["Each bacterial pellet (50 mg) was extracted in 400 μL of pre-chilled methanol–water (4:1, v/v) containing 0.02 mg/mL L-2-chlorophenylalanine as internal standard. Samples were homogenised at low temperature using a high-throughput tissue disruptor (Wonbio-96c, Shanghai Wanbo Biotechnology Co., Ltd.), vortexed, and ultrasonicated on ice for 30 min. After incubation at −20 °C for 30 min, samples were centrifuged at 13,000 × g for 15 min at 4 °C. Supernatants were transferred to LC-MS vials and stored at −20 °C until analysis. Quality control (QC) samples were prepared by pooling equal volumes of supernatant from all study samples (CK and straw groups combined), then divided into aliquots and processed in parallel with study samples.
"],"organism":["Bacillus siamensis"],"full_dataset_link":["https://www.ebi.ac.uk/metabolights/MTBLS15412"],"author":["zhao xiaoqing. inner monggolia university. dieuanh5683@gmail.com.","xiaoqing zhao."],"data_transformation_protocol":["Raw MS data files were processed using Progenesis QI (Waters Corporation, Milford, USA). Mass features were extracted with mass tolerance of ±5 ppm and retention time tolerance of ±0.5 min. Peak alignment and gap-filling were performed using automated alignment algorithm. Quality control was performed by filtering features with coefficient of variation (CV) in QC samples > 30%, which were subsequently excluded from further analysis. Intensity data were normalised using total ion chromatogram (TIC) normalisation based on sample quality peaks. The resulting feature matrix contained approximately 800–1200 metabolite features across 15 study samples (6 CK, 6 straw-treated, 3 QC replicates). Data were uploaded to MajorBio Cloud Platform (cloud.majorbio.com) for downstream preprocessing, including removal of features with >80% missing values, retention of features with abundance ≥80% above background noise, and log10 transformation of QC-normalised features.
"],"study_factor":["Treatment"],"submitter_email":["3211468209@qq.com"],"sample_collection_protocol":["Six cultures of Bacillus siamensis LSZ23 were used for untargeted metabolomic profiling, consisting of three control (CK) replicates and three straw-treatment (straw) replicates. Cells were harvested at peak cellulase activity, immediately centrifuged at 5,000 × g for 10 min at 4 °C, and washed twice with ice-cold phosphate-buffered saline (PBS). Bacterial pellets were then snap-frozen in liquid nitrogen and stored at −80 °C until metabolite extraction.
"],"omics_type":["Metabolomics"],"study_design":["ultra-performance liquid chromatography-mass spectrometry","Metabolomics","not applicable","Thermo Scientific Orbitrap Exploris 240","untargeted analysis","quality control sample","Bacillus siamensis","biodegradation","Multiomics","Thermo Fisher Scientific Vanquish UHPLC","culture supernatant","experimental sample"],"curator_keywords":["ultra-performance liquid chromatography-mass spectrometry","Metabolomics","not applicable","Thermo Scientific Orbitrap Exploris 240","untargeted analysis","quality control sample","Bacillus siamensis","biodegradation","Multiomics","Thermo Fisher Scientific Vanquish UHPLC","culture supernatant","experimental sample"],"mass_spectrometry_protocol":["Mass spectrometry was performed using a Q Exactive HF-X orbitrap mass spectrometer (Thermo Fisher Scientific) operated in both positive and negative electrospray ionisation (ESI) modes with the following parameters: Positive ionisation mode: Spray voltage: 3500 V; Negative ionisation mode: Spray voltage: 3000 V; Sheath gas flow rate: 40 arb; Auxiliary gas flow rate: 13 arb; Ion transfer tube temperature: 450 °C; Scan range: m/z 70–1050; Resolving power: 120,000 at m/z 200 (full MS); Data acquisition mode: Full MS with data-dependent acquisition (DDA); Collision energy: stepped 20, 40, 60 eV for MS/MS fragmentation.
"],"metabolite_name":["Hordatine A Glucoside","Leptine I","Adenosine Diphosphate Ribose","N-Acetyl-Dl-Valine","Syringic Acid","Tripeptide","Argininosuccinic Acid","Phenylacetylglutamine","Ethalfluralin","L-Rhamnulose","Sacubitril","Piceatannol","Tectorigenin","Deoxycholic Acid","Ketoleucine","N-Oleoyl Alanine","(25R)-3Beta,4Beta-Dihydroxycholest-5-En-26-Oate(1-)","Prolyl-Asparagine","Chenodeoxycholylglutamine","Citrulline","N-Isobutyryl-L-Cysteine","Cinncassiol D2 Glucoside","11-Oxohexadecanoic Acid","N-Formyl-L-Methionine","(S)-Isocorydine","(2R)-(4-Chlorophenyl)[3-(Trifluoromethyl)Phenoxy]Ethanoic Acid","4(1H)-Pyridinone, 2-Ethyl-3-Hydroxy-1-(2-Hydroxyethyl)-","Capryloylglycine","1-Oleoylglycerophosphoserine","Neopterin","Tanabalin","Emulphor","18-Carboxy Dinor Leukotriene B4","Meta-O-Dealkylated Flecainide Lactam","Asn-Ile","Kinetensin 4-7","Prostaglandin E2","N-Acetyl-5-Aminosalicylic Acid","Kinetensin 4-8","P-Anisic Acid","N-Oleoyl-L-Serine","Apigenin-4'-Glucoside","Ciceritol","Phomopsin A","3-Methoxytyrosine","Maltitol","4-Hydroxy-2-Nonenal-[Cys-Gly] Conjugate","5,8,11-Eicosatrienoic Acid","2-(Bis(2-(2,6-Dioxomorpholino)Ethyl)Amino)Acetic Acid","Cyclo(Glycylglycylleucylleucylleucylprolylprolylphenylalanyl)","Trans-4-Aminocyclohexanecarboxylic Acid","Licoricesaponin F3","Isoferulic Acid","Kapporphin","Glutaminylproline","Gamma-Glutamyltyrosine","2-Hydroxypalmitic Acid","N-Eicosapentaenoyl Serine","Met-Glu","Alpha-Acetyldigoxin","Cytidine, 2'-Deoxy-2',2'-Difluoro-N-(1-Oxo-2-Propylpentyl)-","N-Methyl-L-Glutamic Acid","Lpa(15:0)","Palmitaldehyde","2-Amino-3-Methylsuccinic Acid","Levetiracetam","Corchoroside B","12-O-D-Glucuronoside-13-Hydroxyoctadec-9Z-Enoate","1,25-Dihydroxy-16-Ene-Vitamin D3","Benzoylphenylalanyl-Alanyl-Proline","D-Lyxose","Glyceraldehyde","Prolyl-Gamma-Glutamate","Leu-Val","8-Hydroxyacyclovir","8-Amino-7-Oxononanoic Acid","Pgp(Pgf1Alpha/16:0)","Hexadecanedioic Acid","Benzocaine","Thr-Met","Malonic Acid","Indoleacetaldehyde","4-(Phosphonomethyl)Piperidine-2-Carboxylic Acid","Succinyladenosine","Phytosulfokine A","Acetylglycine","N-(2,3-Dihydroxypropyl)Valine","Lactosamine","N-Feruloyltyramine","Tyr-Thr","Phe-Glu","Creatinine Nitrite Nitrate","Oxaceprol","3-(3-Amino-3-Carboxypropyl)Uridine","Chymostatin","Bicisate","Ile-Gln","Glyceric Acid","Dihydrotachysterol","Gancaonin R","N-(Gamma-Glutamyl)Ethanolamine","Gly-Ile","Mometasone","N-Acetylaspartic Acid","Mahaleboside","Elemicin","(R)-Byakangelicinn 2'-(3-Methylbutanoate)","Soyasaponin Ii","Glucotricin","Noroxyhydrastinine","Fluvoxamine","Danshensu","Lysyl-Aspartyl-Glutamyl-Leucine","Isovalerylcarnitine","Tepraloxydim","4-(4-Hydroxyphenyl)-2-Butanone O-[2-Galloyl-6-P-Coumaroylglucoside]","(4R,5S,7R,11X)-11,12-Dihydroxy-1(10)-Spirovetiven-2-One 12-Glucoside","Paramethadione","Contignasterol","Isobiflorin","Wander","Adarotene","Gamma-Cehc","4-Coumaroylshikimate","Tyr-Glu","Phe-Thr","Vitamin D3 Palmitate","Ile-Glu","Glu-Met","Asp-Glu","Oenin","Tyr-Gly","Glycyllysylarginine","Pectenotoxin 2 Secoacid","Sialorphin","1-Phenyl-1,3-Docosanedione","Leucyl-Aspartate","N-Lauroylglycine","4-Megastigmene-6A,9R-Diol 9-[Apiosyl-(1->6)-Glucoside]","Phenylalanyl-Prolyl-Arginine Nitrile","N(6),O(2)-Dimethyladenosine","Versetamide","Deoxythymidine Diphosphate-L-Rhamnose","Polyglycerol Esters Of Fatty Acids","Cyasterone","5-Hydroxy-7-(4-Hydroxyphenyl)-1-Phenyl-3-Heptanone","Acetaminophen Sulfate","Pro-Ile","Dihydroxylysinonorleucine","Prunetrin","Tacrolimus","Fenoverine","Dauricine","Oleoyl Glycine","Glycylprolylhydroxyproline","Desglucocoroloside","Deoxyguanylic Acid","Viridin","Cyclic Adp-Ribose","N-((Tetrahydro-5-Oxo-2-Furanyl)Carbonyl)-L-Histidyl-L-Prolinamide","Monobutyl Phthalate","Violacein","Trp-Glu","Tetramethylquercetin 3-Rutinoside","Chlorpenthixol","Bryo 1","Cyclopassifloside Ii","18-Nitrooctadeca-9,12-Dienoic Acid","(2E,4E,7E)-Nona-2,4,7-Trienedioylcarnitine","Quinolinic Acid","(5Z,8Z,13E,15S)-11,12,15-Trihydroxyicosa-5,8,13-Trienoylcarnitine","Folcepri","Enkephalin L","Cytosine-5-Carboxylic Acid","Norethindrone Acetate","Pc(6 Keto-Pgf1Alpha/24:1(15Z))","Ile-Ile","Normorphine 3-Glucuronide","N-Acetyl-L-Aspartic Acid","Gibberellin A8","Caudatin","Gibberellin A7","Cyanoketone","Dimp","Limocitrol 3-Glucoside","Sesamose","Alpha-D-Xylopyranosyl-(1->6)-Beta-D-Glucopyranosyl-(1->4)-D-Glucose","Maslinic Acid 3-O-B-D-Glucoside","Libenzapril","Pa(Pge1/I-19:0)","O-Succinyl-L-Homoserine","Furost-5-Ene-3Beta,22,26-Triol","16-Hydroxyhexadecanoylcarnitine","Melibiitol","(3R)-3-Hydroxydodecanoic Acid","5-Chloro-2'-Deoxyuridine","Morellin","Protoporphyrinogen Ix","Rutaretin 9-Rutinoside","Bms-275183","Cyclocalopin D","Pomaglumetad Methionil","N-(1-Carboxy-3-Carboxanilidopropyl)Alanylproline","P-Toluenesulfonic Acid","Leu-Met","16-Acetylgitoxin","Rifampicin","N-Acetylserine","Moreollin","N-Acetyl-L-Tyrosine","Ixabepilone","Methyl Salicylate","9H-Pyrido[3,4-B]Indole-3-Carboxylic Acid","Xanthosine","Dimethyl-3-Hydroxypyrid-4-One","Kaempferol 3-[Glucosyl-(1->3)-Rhamnosyl-(1->2)-[Rhamnosyl-(1->6)-Galactoside]]","Alpha-Amino-3-Hydroxy-5-Methyl-4-Isoxazolepropionic Acid","Latrunculin A","Latrunculin B","Asp-Ala","Suberic Acid","6-Phosphogluconic Acid","15-Hydroxyicosanoic Acid","Udp-N-Acetyl-D-Galactosamine","Trisjuglone","Pg(14:0/15:0)","Prostaglandin K1","2,6-Dihydroxybenzoic Acid","Pg(5-Iso Pgf2Vi/20:1(11Z))","4-Pyridoxic Acid","N-Myristoyl Proline","5-Methoxytryptophan","Hygromycin B","Acrimarine N","Pa(Txb2/A-21:0)","2-Methylglutaric Acid","(2E)-3-Methylpent-2-Enedioylcarnitine","Warfarin","10-Hydroxydecanoic Acid","18-Carboxy-Dinor-Lte4","3-Mercapto-3-Methylbutyl Formate","Corymboside","Clethodim","Pc(Pgj2/Dime(13,5))","Oxoglutaric Acid","15-(4-Iodophenyl)-3,3-Dimethylpentadecanoic Acid","2',5,6-Trimethoxyflavone","4-Acetamidobutanoic Acid","Triclabendazole Sulfoxide","Thiamphenicol Glycinate","Itaconic Acid","Beclomethasone 17-Monopropionate","1-(3-Methyl-2-Butenoyl)-6-Apiosylglucose","6''-Acetylliquiritin","Genistein","Cadabicine Methyl Ether","Dihydrozeatin-O-Glucoside","Etiopurpurin","Phenylpyruvic Acid","(22R,23R)-22,23-Dihydroxy-Campest-4-En-3-One","Prostaglandin-C2","Secologanate","5,6,7,8-Tetrahydromethanopterin","Menthol","Tryptophyl-Serine","Cis-3-Hexen-1-Ol","3-Methyl-2-Oxovaleric Acid","Taurochenodeoxycholate-3-Sulfate","3Alpha,7Alpha-Dihydroxycoprostanic Acid","Lactic Acid","Vicenin 2","Glycerol 3-Phosphate","1,2,3,10-Tetramethoxy-7-(Methylamino)-6,7-Dihydro-5H-Benzo[A]Heptalen-9-One","Trp-Thr","N-Linoleoyl Threonine","5'-Deoxy-5-Fluorouridine","Franguloside","Pgf2Alpha-Ea","Tetraazacyclododecanetetraacetic Acid","Zearalenol","Campest-4-En-3,6-Dione","Seryllysine","Taurine","Gamma-Glu-Leu","Epothilone C","Angiotensin Iii","3-Phosphoglycerate","Janthitrem B","Zalcitabine","Trans-Zeatin","S-Prenyl-L-Cysteine","1-[(4-Amino-3-Methylphenyl)Methyl]-5-(2,2-Diphenylacetyl)-6,7-Dihydro-4H-Imidazo[4,5-C]Pyridine-6-Carboxylic Acid","2-Formamidobenzoic Acid","12-Hydroxydodecanoylcarnitine","Hydroxytetradecenoylcarnitine","L-Threonine","Ricinoleic Acid","6-Oxopiperidine-2-Carboxylic Acid","Glutaconic Acid","8-Hydroxy-5Z,9E,11Z,14Z-Eicosatetraenoic Acid","Demethylphylloquinol","Fenugreekine","Acorafloxacin","Phloionolic Acid","Dihydroouabain","N-Stearoyl Glutamine","8-Hydroxyguanosine","Alpha-Linolenoyl Ethanolamide","Ethyl 3-Aminobenzoate","5Alpha-Cyprinol","Prednisone","Stearaldehyde","Pip(5-Iso Pgf2Vi/16:0)","Oxazolo[5,4-B]Pyridine","Trifolirhizin","Leukotriene E4","Leu-Lys","4-Oxoproline","Deoxyloganin","N-(3-Acetamidopropyl)Pyrrolidin-2-One","Sn-38","Salicin","Hordatine B","6-Hydroxynicotinic Acid","Hordatine A","Desacetoxyvindoline","6-Dehydrotestosterone Glucuronide","N2-Acetyl-L-Ornithine","Cryptotanshinone","Imidazoleacetic Acid Riboside","Laccaic Acid D","Ampicilloyl","Soyasapogenol D","Meclizine","Isopropylmaleic Acid","Val-Ile","3',4',5'-Trimethoxyflavonol","(S)-Homostachydrine","L-Tryptophan","N6-Galacturonyl-L-Lysine","Val-Phe-Val-Tyr","Pgp(Pgf1Alpha/I-21:0)","Swertiajaponin","N-Eicosapentaenoyl Tryptophan","Jesaconitine","4(1H)-Pyridinone, 3-Hydroxy-1-(3-Hydroxypropyl)-2-Methyl-","Lpg(15:0)","Nicotinamide Adenine Dinucleotide","Asp-Pro","Ab-Meca","Prolylhydroxyproline","3B-Hydroxy-17-(1H-1,2,3-Triazol-1-Yl)Androsta-5,16-Diene","3-Methyldioxyindole","6-Ethylchenodeoxycholic Acid","N-Linoleoyl Gaba","Tilmicosin","3-Methylhippuric Acid","Cassiaside B","D-Xylonic Acid","Asn-Phe","4Alpha-Carboxy-5Alpha-Cholesta-8,24-Dien-3Beta-Ol","N-Succinyl-L,L-2,6-Diaminopimelate","5-Hydroxyindole-3-Acetic Acid","Nicotinamide Riboside","9,10-Dihydroxystearic Acid","Pe(5-Iso Pgf2Vi/14:1(9Z))","N2-Galacturonyl-L-Lysine","Alkergot","Tricin 5-Glucoside","N-Oleoyl Leucine","Jaceosidin","Eribulin","(3A,5B)-24-Oxo-24-[(2-Sulfoethyl)Amino]Cholan-3-Yl-B-D-Glucopyranosiduronic Acid","Rivenprost","Succinic Acid","Starch, Acetate","Momordol","Trifluoroacetyl-L-Lysyl-L-Alaninanilide","4-Hydroxymandelic Acid","S-(9-Deoxy-Delta9,12-Pgd2)-Glutathione","Lucidenic Acid M","Tricin 7-Glucuronoside","Cerebroside B","Quinagolida","Hemorphin-4","Lps(15:0)","N1-(5-Phospho-D-Ribosyl)-Amp","Gluconolactone","Npc","Dihydro-4,4-Dimethyl-2,3-Furandione","Equilenin","2'',6''-O-Diacetyloninin","Triterpenoids","3-Methoxyphenol Sulfate","24,24-Difluoro-1Alpha,25-Dihydroxyvitamin D3","Trinexapac-Ethyl","Atn-161","Dg(Lte4/A-25:0/0:0)","Pc(Dime(11,5)/20:5(5Z,8Z,11Z,14Z,16E)-Oh(18R))","Hydrocortisone 17-Butyrate","Lpe(15:0)","Dakh Peptide","Delphinidin 3-Sambubioside","2-Hydroxydocosanoylcarnitine","Fad","(E)-3-Hydroxy Tamoxifen O-|A-D-Glucuronide","Cyclo(Glycylleucylvalylleucylprolylseryl)","Artesunic Acid","Azilsartan","Mangicrocin","Trypsinogen","Cinchonidine","Pyroglutamyl-Glutamyl-Proline Amide","Hydroxyprolyl-Tyrosine","Glycochenodeoxycholic Acid 3-Glucuronide","Sulfolithocholylglycine","Asp-Leu","Doisynoestrol","13E-Tetranor-16-Carboxy-Lte4","4-Hydroxy-5-Phenyltetrahydro-1,3-Oxazin-2-One","Oxoadipic Acid","Tyrosol Glucuronide","Glucose 6-Phosphate","Estriol 3-Sulfate 16-Glucuronide","9-(4-Fluoro-3-(Hydroxymethyl)Butyl)Guanine","Raltitrexed","Sarcodon Scabrosus Depsipeptide","(3-Aminopropyl)(N-Butyl)Phosphinic Acid","Octenoyl-L-Carnitine","Petunidin 3-Rhamnoside","2-N-Propyl-4-Oxopentanoic Acid","N-Acetyl-L-Glutamate 5-Semialdehyde","Thr-Tyr","Pa(Pgf2Alpha/12:0)","Quinaprilat","Alpha-Cyano-4-Hydroxycinnamic Acid","L-Beta-Aspartyl-L-Phenylalanine","Lpg(17:0)","Nafazatrom","N-Acetyl-D-Tryptophan","Thr-Asp","Gatifloxacin","Validamycin A","Glycerophosphocholine","L-Beta-Aspartyl-L-Leucine","7Alpha,25-Dihydroxy-4-Cholesten-3-One","N-Acetyl-L-Phenylalanine","1-Keto-24-Methylcalcifediol","Trilostane","Paramethasone","Lucyoside M","Ginsenoyne B","12-Hydroxyoctadecanoic Acid","Lucyoside R","2Alpha-(3-Hydroxypropyl)-1Alpha,25-Dihydroxy-19-Norvitamin D3","Protoporphyrin Ix","Glaucarubin","S-Hydroxymethylglutathione","Aclacinomycin S","Glycogen","Purpurogallin","Xanthine","Tyr-Tyr","2-Methylbutyryl-Coa","4-Hprog","Maslinic Acid","N-Nervonoyl Serine","Nobiletin","Gemfibrozil 1-O-Beta-Glucuronide","Mppa (Methyl Pyropheophorbide-A)","Pc(5-Iso Pgf2Vi/P-16:0)","Methyl 7-Epi-12-Hydroxyjasmonate Glucoside","Blasticidin S","Bromocriptine","Pentetic Acid","Arg-Phe","Betavulgaroside Iv","Apigenin 7-Sulfate","Sulfinpyrazone","Quinic Acid","N-Ribosylhistidine","Lpe(17:0)","3-Hydroxysebacic Acid","Val-Glu","N-Acetylglycine","Sebacic Acid","Cinnamoside","6-Hydroxy-4-Methoxy-3-(3-Methyl-2-Butenyl)-2-(2-Phenylethenyl)Benzoic Acid","Blennin D","Alpha-D-Glucose","Dihydrozeatin O-Beta-D-Glucoside","S-Adenosylhomocysteine","Pyridine-3,4-Diol","6-Hydroxymethylpterin","Pencycuron","(-)-Arctigenin","Fluticasone 17Beta-Carboxylic Acid","3-Dehydroteasterone","2-Mercaptobenzothiazole","[(S)-1-Carboxy-2-Phenyl-Ethyl]-Carbamoyl-Arg-Val-Arg-Aldehyde","Visnagin","N-(3-(Dimethylamino)Propyl)Acrylamide","Diosgenin","(2E,4Z)-Tetradeca-2,4-Dienedioylcarnitine","Cytidine-3'-Monophosphate","Pc(Dime(13,5)/Pgd2)","Daphnoretin","Blumenol C O-[Rhamnosyl-(1->6)-Glucoside]","Cyclic-3,4-O-Oxalyl-L-Threonate","(3Z)-2-Propylpent-3-Enoic Acid","Dolichyl B-D-Glucosyl Phosphate","Arg-Trp","Quercetagetin 3'-Methylether 7-Glucoside","Fuzlocillin","Soyasaponin Iii","Gamma-Glutamyl-2-Aminobutyric Acid","Fa(9:0)","Gamma-Glutamyl-Beta-Aminopropiononitrile","Loganic Acid","7A,12A-Dihydroxy-5A-Cholestan-3-One","Leu-Ser","Casokefamide","Mifepristone","(2S)-5-Amino-2-[(2-Carboxy-2-Oxoethyl)Amino]-5-Oxopentanoic Acid","Baicalin","6-Hydroxy-3,4-Dihydro-2(1H)-Quinolinone","Hydroxytetradecadienyl-L-Carnitine","Azelaic Acid","(3R)-3,4-Dihydroxy-3-(Hydroxymethyl)Butanenitrile 4-Glucoside","Digitoxigenin Bisdigitoxide","5-Amino-6-Ribitylamino Uracil","Alanyl-Gamma-Glutamate","(9E,12E)-N-(2-Hydroxyethyl)Octadeca-9,12-Dienamide","Alpha-Trisaccharide","Nortrachelogenin","Trp-Asp","Paclobutrazol","Mammea B/Bc Cyclo E","Cichorioside B","A-L-Threo-4-Hex-4-Enopyranuronosyl-D-Galacturonic Acid","Vanillin","Tri-Glyceride","Skimmin","A-L-Arabinofuranosyl-(1->2)-[A-D-Mannopyranosyl-(1->6)]-D-Mannose","Uridine Monophosphate","(6E)-Dodeca-2,6-Dienedioylcarnitine","5-Hydroxy-2-Oxo-4-Ureido-2,5-Dihydro-1H Imidazole-5-Carboxylate","Pa(Pgd1/A-21:0)","Stercobilinogen","Deoxyribose","Riboflavin","Chenodeoxycholylaspartic Acid","(24S)-24-Ethylbrassinone","Diosbulbinoside F","Glucose Pyruvate Lactate","2-[3-(Sulfooxy)Phenyl]Acetic Acid","Prostaglandin E2 Ethanolamide","Tyrosylhydroxyproline","Evogliptin","Arecoline","Pg(Pge2/A-15:0)","Pe(Pgj2/Dime(9,5))","Leu-Asn","Oleuropein-Aglycone","Leu-Asp","Trans-4-Hydroxycyclohexylacetic Acid","Calanolide A","Daphniphylline","Fumaryl Diketopiperazine","Apiosylglucosyl 4-Hydroxybenzoate","Hexaminolevulinate","Flumioxazin","Gly-Pro-Arg-Pro","9,10,13-Trihome","Gingerglycolipid C","Pantothenic Acid","Kainic Acid","N-Palmitoyl Lysine","Udp-N-Acetylmuraminate","3'',4''-Diacetylcosmosiin","Deoxypyridinoline","2-Furoic Acid","Verbascoside A","3-Oxoadipic Acid","Solutol Hs 15","Elacridar","Austdiol","Ent-6R,16Boh,17-Trihydroxy-7-Oxo-6,7-Seco-19,6-Kauranolide 6-O-Glucoside","Cathasterone","Glycitein","Pseudouridine","3-Hydroxydodecanedioic Acid","4-(4-Fluorophenyl)-2-(4-Methylsulfinylphenyl)-5-(4-Pyridyl)-1H-Imidazole","Phospholipase","Ochromycinone","Linatine","Dihydrocapsaicin","Glycerol Lactate Pyruvate","27-Deoxy-5B-Cyprinol","3-Oxoglutaric Acid","Tyr-Ser","Lucidenic Acid E2","Isocitric Acid","Ps(Dime(13,5)/Monome(13,5))","Guanosine","3-Methyl-1-Hydroxybutyl-Thpp","Db-Camp","Small Bacteriocin","Beta-D-Xylopyranosyl-(1->4)-Alpha-L-Rhamnopyranosyl-(1->2)-D-Fucose","Acetyl Coenzyme A","Zinostatin","Clausarinol","Chenodeoxycholic Acid","3Alpha,7Alpha,12Alpha-Trihydroxy-5Beta-Cholestanate","Glu-Ala","Morph","Triacanthine","Asp-Ser","Urolithin A 3-Sulfate","4-Hydroxyphenyllactic Acid","Midodrine","Mono-Trans-P-Coumaroylmesotartaric Acid","Isorhynchophylline","Pregnanetriol 3A-O-B-D-Glucuronide","N-Acetylaspartylglutamic Acid","Sorbitan Stearate","3-Hydroxybenzoic Acid","Camonagrel","2-Hydroxypentanoic Acid","Ht-2 Toxin","Uridine","Trans-2,3-Dehydropristanoyl-Coa","Imazamox","L-2-Amino-3-(1-Pyrazolyl)Propanoic Acid","Lymecycline","2-Hydroxymyristoylcarnitine","Bedoradrine","Enterodiol Sulfate","Hydroxypropionic Acid","Ala-Met","Lexacalcitol","Phe-Ser","S-(2-Hydroxy-3-Buten-1-Yl)Glutathione","Borapetoside","Birabresib","Pe(Dime(11,3)/5-Iso Pgf2Vi)","N-Oxide Abiraterone Sulfate","Gly-His","Trimazosin","Ile-Ser","Corchorusoside A","Suberylglycine","2,3-Bis(Palmitoyloxy)Propyl Dihydrogen Phosphate","Cdp-Ethanolamine","Norethindrone Oxime","Isopeonidin 3-Rutinoside","Neplanocin A","L-Tyrosine","Daucic Acid","Melitin","Myotoxin A","Olaquindox","12,13-Dihome","7A,12A-Dihydroxy-Cholestene-3-One","Serylhydroxyproline","Schleicherastatin 5","Hemiasterlin","2-Keto-6-Acetamidocaproate","Isoguanosine","4-[(4'-O-Acetyl-Alpha-L-Rhamnosyloxy)Benzyl]Isothiocyanate","Glyzarin","H-Asp(Obzl)-Oh","Ziziphin","5-Hydroxyoct-3-Enoylglycine","4Alpha-Carboxy-5Alpha-Cholesta-8-En-3Beta-Ol","Dibekacin","Integerrimine","Asparagoside A","Aflatoxin M1","5-Nitroxystearic Acid","Phenylbutyrylglutamine","Arctiin","Hovetrichoside C","Metabolite A","21-Hydroxy-Heneicosanoic Acid","Ligusticide","12-Oxo-2,3-Dinor-10,15-Phytodienoic Acid","Ile-His","Physapubenolide","Isosyringinoside","L-Malic Acid","Fa(16:0)","Val-Tyr","Carbocysteine-Lysine","N-Acetyl-L-2-Aminoadipate(2-)","Gamma-Glutamylvaline","Zearalenone","Isopenicillin N","Pectolinarin","Astemizole","(S)-2,3-Dihydrodipicolinate","4-Methylumbelliferone","Seocalcitol","Benzoic Acid","3-Carboxy-4-Methyl-5-Propyl-2-Furanpropionic Acid","Beta-D-Glucosamine","Dathf","6-[2,3-Dihydroxy-1-(Hydroxymethyl)Propyl]-1,2-Dihydro-7-Hydroxy-9-Methoxy-Cyclopenta[C][1]Benzopyran-3,4-Dione","Erucic Acid","Valeryl 4-Hydroxy Valsartan","3'-Deoxy-3'-Fluorothymidine","Stachyflin","Glycyrrhetinic Acid","19(R)-Hydroxy-Prostaglandin E2","2-Hydroxy-4-Methylvaleric Acid","N-Acetyl-L-Alanine","Dimethylsphingosine","11-Oxahexadecanolide","Acetyl-N-Formyl-5-Methoxykynurenamine","Hydroxycitric Acid","Guanosine 5'-Monophosphate","1-Hydroxytrimazosin","N-Acetylneuraminic Acid","Difructose Anhydride Iii","Isodityrosine","L-Threonic Acid","Gln-Val","2-Aminoheptanedioic Acid","Val-Asn","Gulonic Acid","Val-Asp","Dihydrozeatin-9-N-Glucoside-O-Glucoside","Heliotridine","Simeprevir","Sacubitrilat","Galantamine","Scarlet Red","Levonantradol","2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-Ethyl-5-(3-Hydroxy-1-Methylbutyl)-","Naphthoquine","Sterebin B","Zizybeoside I","Leu-Leu","5-Hydroxy-1-Methylpyrrolidin-2-One","Propylene Glycol Stearate","(2S,3R,4S,5R,6R)-6-Ethyloxane-2,3,4,5-Tetrol","4'-Methylliquiritigenin 7-Rhamnoside","7A-Hydroxy-Cholestene-3-One","N-Undecylbenzenesulfonic Acid","6-Methoxy-Alpha-Pyrufuran","N-Epsilon-Acetyl-L-Lysine","Biotinyl-P-Aminobenzoate","Pterin","Pisumionoside","Mesaconitine","L-Leucyl-L-Alanine","Cholest-5-En-3B-Yl (9Z-Tetradecenoate)","Cytidine","N-Desmethylvenlafaxine","17-Aminogeldanamycin","Lyciumin C","2-(Malonylamino)Benzoic Acid","Glu-Asn","Dhesn","Terbogrel","Mesobilirubinogen","Quercetin 3-O-Glucuronide","Flavan-3-Ol","Sialyl Lewis X Antigen","Hemsleyanoside","2-Methylcitric Acid","Maleamic Acid","Nitrilotriacetic Acid","Deoxyspergualin","11-Oxo-Androsterone Glucuronide","N(2)-Phenylacetyl-L-Glutaminate","Phenolphthalin","Docosanedioic Acid","Thymidine 5'-Monophosphate","Aloe Emodin W-Acetate","4-Methylumbelliferyl Acetate","N-Palmitoyl Threonine","Traumatic Acid","(S)-2,3-Dihydro-3,5-Dihydroxy-2-Oxo-3-Indoleacetic Acid 5-Glucoside","Actodigin","Glutarimide","Stearic Acid","Gamma-Glutamylfelinylglycine","22-Hydroxydocosanoic Acid","6''-Malonylgenistin","Retaspimycin","Quercetin 3-O-Sophoroside","Histidine Glutamate","Amphotericin B","Butyl (S)-3-Hydroxybutyrate Glucoside","Gln-Ile","3'-Hydroxyamobarbital","Glu-Pro","Ethisterone","Nandrolone Decanoate","(S)-9-Hydroxy-10-Undecenoic Acid","Prunetin","Lpg(14:0)","Notoginsenoside T1","Acexamic Acid","Sucralose","Citramalic Acid","Zabicipril","Enalapril","Dibutyl Phthalate","Hypromellosum","Allobarbital","Jubanine B","Cis-Zeatin-7-N-Glucoside","Podofilox","N-Alpha-Acetyl-L-Citrulline","2-(Acetylamino)-2-Deoxy-Alpha-D-Mannopyranose","Pgp(6 Keto-Pgf1Alpha/A-17:0)","Castanospermine","6-Oxocampestanol","Beta-Acetyldigoxin","Nalbuphine","Myricanene A 5-[Arabinosyl-(1->6)-Glucoside]","Cortisone Acetate","Arg-Gly-Asp-Ser","Gibberellin A1 Glucosyl Ester","Oleuropein","Neopine","Hebevinoside Iii","Austalide D","7-Hexyl-2-Oxepanone","Biotripyrrin-A","Glutamine Pyruvate","D-3-Phenyllactic Acid","Thr-Val","Tridecanedioic Acid","Dg(6 Keto-Pgf1Alpha/0:0/2:0)","Ergocornine","Resiniferatoxin","Lincomycin","1-Stearoylglycerol","2-Hydroxysebacic Acid","3-Methylcrotonylglycine","Ptaquiloside","Niacinamide","L-Quinate","Thienamycin","Pc(Pgf2Alpha/22:2(13Z,16Z))","Zeranol","Pretyrosine","Flutamide","Levulinic Acid","Limocitrin 3-Rutinoside","Lampranthin Ii","Macrophorin B","Aureomycin","Glu-Glu","Neuac(Alpha->6)Galnac(Alpha1->O)Ser","5-Hexyl-3,4-Dimethyl-2-Furanundecanoic Acid","8-Hydroxyquinoline","Pralsetinib","1-(9Z-Eicosenoyl)-Sn-Glycero-3-Phosphocholine","N-Palmitoyl Arginine","Beta-Nicotinamide Adenine Dinucleotide","Lagerstroemine","Ala-Ile","Maltotetraose","5-L-Glutamyl-L-Alanine","Met-Enkephalinamide","4-Dodecylbenzenesulfonic Acid","3-Methyluridine","Luteolin 7-Glucuronylglucoside","2-Succinylbenzoate","Citric Acid","12-Hydroxyicosanoic Acid","Resmethrin","Himbacine","Lpc(16:0)","(3B,9R)-5-Megastigmene-3,9-Diol 9-[Apiosyl-(1->6)-Glucoside]","Ser-Val","Adipic Acid","Pa(6 Keto-Pgf1Alpha/22:5(4Z,7Z,10Z,13Z,16Z))","Hypoxanthine","17-Aag","Idarubicin","Lewis B","(4E,14Z)-2-Aminooctadeca-4,14-Diene-1,3-Diol","Indole-3-Acetic-Acid-O-Glucuronide","Gly-Trp","Lpe(14:0)","Lupex","Amarogentin","Phenacemide","Dinoterb","4-Hydroxy-5-[3-(Sulfooxy)Phenyl]Pentanoylcarnitine","8-Methylthiooctyl Glucosinolate","Thr-Ile","Plantaricin Bn","3-(6'-Methylthio)Hexylmalate","3-Hydroxyphenylacetic Acid","Neocarlinoside","Citreoviridin","Phe-Asn","Nemifitide","(-)-Jasmonoyl-L-Isoleucine","Deoxycytidine Diphosphate","N-(1,3-Dihydroxyoctadec-4-En-2-Yl)Acetamide","4-Nitrobenzoic Acid","L-Cysteine, N-Acetyl-, Ethyl Ester","Dacinostat","Arg-His-Phe-Trp-Gln-Gln","(-)-Wikstromol","3-Icosa-8,11,14-Trienoylcarnitine","5-Hydroxy-L-Tryptophan","Gly-Phe","2-Methylhippuric Acid","2-Pyrrolidinone","P-Cresol Sulfate","3-O-Methylfluorescein","Leu-Ile","Nervonic Acid","Megestrol","Tricosanoic Acid","N-Stearoyl Serine","Sitostanol-Beta","S-(Pga1)-Glutathione","N-Desisopropylpropranolol","Salicylic Acid","5-Aminovaleric Acid","Melibiose","Cadabicine","Pc-M6","Pantethine","Acetylleucine","Caffeine","Cucurbitacin A","6''-O-(3-Hydroxy-3-Methylglutaroyl)Astragalin","Oxopurpureine","1-(2-Hydroxyphenylamino)-1-Deoxy-Beta-D-Gentiobioside 1,2-Carbamate","(22R,23R)-22,23-Dihydroxycampesterol","N-Acetylproline","N-Palmitoyl Serine","4-O-Alpha-D-Galactopyranuronosyl-D-Galacturonic Acid","Soyasaponin I","Pa(6 Keto-Pgf1Alpha/2:0)","N-Acetyl-L-Glutamine","Cucurbitacin C","N-Myristoyl Serine","N-Docosahexaenoyl Cysteine","Fucose","11-Beta-Hydroxyandrosterone-3-Glucuronide","Licorice Glycoside B","Epsilon-Maleimido-Lysine","D-(-)-Fructose","Alaptide","Plazomicin","Capecitabine","4-Hydroxycinnamic Acid","4-Hydroxytamoxifen-O-Glucuronide","4-(4-Methylpiperazin-1-Yl)-7-(Trifluoromethyl)Pyrrolo[1,2-A]Quinoxaline","N2-Fructopyranosylarginine","Penitrem E","L-Gamma-Glutamyl-Beta-Phenyl-Beta-L-Alanine","Vanillylacetone","L-Prolinamide,D-Tyrosyl-L-Arginylglycyl-4-Nitro-L-Phenylalanyl-","Propionic Acid","N-Oleoyl Phenylalanine","Rosuvastatin 5 S-Lactone","Phyllanthusol B","Lanabecestat","Pinolidoxin","Shikimic Acid","N-Myristoyl Threonine","Lucidenic Acid D2","3,4-Methylenedioxybenzaldehyde","N-[(3S)-2-Oxotetrahydrofuran-3-Yl]Butanamide","Propafenone Glucuronide","5-Hydroxyferulate","Fa(21:0)","Linalool Oxide D 3-[Apiosyl-(1->6)-Glucoside]","Avapritinib","Pa(20:2/22:6)","Lavoltidine","Xi-8-Hydroxyhexadecanedioic Acid","Leu-Glu","Lacto-N-Tetraose","Rubschisandrin","Tranexamic Acid","Glu-Thr","Vitexin","Polyoxyethylene 40 Monostearate","Undecanoic Acid","1-[(2R,4R,5R)-5-(Aminomethyl)-4-Hydroxyoxolan-2-Yl]-5-Methylpyrimidine-2,4-Dione","Galactaric Acid","Docosanedioate","Lpa(18:2)","Apigetrin","Chrysosplenetin","Dimethylstrobochrysin","O-Acetyl-L-Serine","18-Hydroxycorticosterone","D-Glucaro-1,4-Lactone","L-Aspartic Acid","3-Methyl-2-(3-Pyridyl)-1-Indoleoctanoic Acid","11'-Carboxy-Alpha-Chromanol","Mukurozidiol","Lpc(18:2)","Pralmorelin","Leucomycin A5","(1R,6R)-6-Hydroxy-2-Succinylcyclohexa-2,4-Diene-1-Carboxylate","(R)-2-Hydroxystearic Acid","Prolyl-Alanine","2-Tiglylcarnitine","Cyclosquamosin C","Reduced Ketanserin","N-[(3A,5B,7A)-3-Hydroxy-24-Oxo-7-(Sulfooxy)Cholan-24-Yl]-Glycine","Nicotinic Acid","Homodihydrocapsaicin","Undecanedioic Acid","Ll-2,6-Diaminopimelic Acid","Mangalkanyl Glucoside","Normetanephrine","6,8-Dihydroxypurine","Pgp(Pgf1Alpha/18:0)","(4E,15Z)-Bilirubin","Galacturonic Acid","24-Hydroxytetracosanoic Acid","Lpg(16:0)","Lpc(18:1)","9,10-Epoxyoctadecanoic Acid","Cynaropicrin","Gamma-Glutamylproline","3A,7A-Dihydroxy-5B-Cholestane","Acetyl-Ser-Asp-Lys-Pro","N-Formyl-Met-Leu-Phe-Lys","Decane-1-Sulfonic Acid","Tripdiolide","Leuphasyl","Regadenoson","Tetracosanedioic Acid","Bergapten","Arctiopicrin","4-Hydroxy-3-Methoxy-Cinnamoylglycine","2-Hydroxynicotinic Acid","2-Hydroxymyristic Acid","Chrysin","Deoxycytidine","Cerebronic Acid","Tetranor-Pgem","Hexadecanedioate","Leu-Gly"],"additional_accession":[]},"is_claimable":false,"name":"liquid chromatography-mass spectrometry","description":"Bacterial cells harvested at peak enzyme activity were subjected to untargeted metabolomic profiling to evaluate metabolic changes during straw degradation compared to control (CK) groups. Samples were extracted using pre-chilled methanol–water (4:1, v/v) and analyzed on a UHPLC-Q Exactive HF-X system operating in both positive and negative ionisation modes. Metabolites were identified by database matching against HMDB, KEGG, and Metlin. Downstream analyses integrated metabolomic findings with transcriptomic data to identify co-regulated pathways and construct correlation networks linking metabolite abundances with CMCase enzymatic activity.","dates":{"publication":"2026-08-24","submission":"2026-08-21"},"accession":"MTBLS15412","cross_references":{"HMDB":["HMDB0000214","HMDB0258202","HMDB0001432","HMDB0034249","HMDB0000097;PW_C000065","HMDB0000177;PW_C000116","HMDB0011174","HMDB0000271;PW_C000185","HMDB0028705","HMDB0000112;PW_C000071","HMDB0259811","HMDB0032055","HMDB0257128","HMDB0001888","HMDB0028851","HMDB0000883;PW_C000704","HMDB0003459","HMDB0302754","HMDB0029150","HMDB0004110","HMDB0039948","HMDB0038228","HMDB0243702","HMDB0241038","HMDB0041908","HMDB0253663","HMDB0001545;PW_C001188","HMDB0252832","HMDB0041931;HMDB0254382;HMDB0254382","HMDB0006790","HMDB0000070;HMDB0000716;HMDB0000070","HMDB0244974","HMDB0028844","HMDB0062445","HMDB0032332","HMDB0259923","HMDB0246894","HMDB0258621","HMDB0028923","HMDB0000300;PW_C000204","HMDB0030274","HMDB0258261","HMDB0002243","HMDB0250782","HMDB0031321","HMDB0001422","HMDB0249137","HMDB0002271","HMDB0005765","HMDB0001972","HMDB0001367","HMDB0000590","HMDB0028893","HMDB0041989","HMDB0004825","HMDB0006050","HMDB0029136","HMDB0011718","HMDB0002641","HMDB0011676","HMDB0060470","HMDB0031179","HMDB0029026","HMDB0028955","HMDB0028832","HMDB0028766","HMDB0251319","HMDB0015217","HMDB0034301","HMDB0244817","HMDB0000802","HMDB0034889","HMDB0004985","HMDB0253190","HMDB0029393","HMDB0028959","HMDB0304409","HMDB0060484","HMDB0034887","HMDB0000050;HMDB0247583;PW_C000034","HMDB0037085","HMDB0060503","HMDB0030697","HMDB0039750","HMDB0060400","HMDB0036255","HMDB0000195;HMDB0247301;PW_C000127","HMDB0000851","HMDB0246739","HMDB0000132","HMDB0028907","HMDB0029773","HMDB0035177","HMDB0011178","HMDB0039348","HMDB0028743","HMDB0060080","HMDB0028699","HMDB0000238;PW_C000160","HMDB0303782","HMDB0013319","HMDB0029339","HMDB0028888","HMDB0030693","HMDB0029011","HMDB0304894","HMDB0028869","HMDB0249997","HMDB0029333","HMDB0038691","HMDB0036856","HMDB0039110","HMDB0013188","HMDB0245397","HMDB0033161","HMDB0039631","HMDB0028974","HMDB0033005","HMDB0038682","HMDB0000567;HMDB0000930;HMDB0000567;HMDB0000930","HMDB0250582","HMDB0060493","HMDB0258242","HMDB0028962","HMDB0250970","HMDB0015676","HMDB0014700","HMDB0012948","HMDB0029771","HMDB0243807","HMDB0240650","HMDB0006765","HMDB0029806","HMDB0302163","HMDB0247946","HMDB0249107","HMDB0000162;PW_C000106","HMDB0257791","HMDB0259742","HMDB0028831","HMDB0301777","HMDB0029042","HMDB0258775","HMDB0246810","HMDB0259500","HMDB0031791","HMDB0028952","HMDB0253405","HMDB0255071","HMDB0245680","HMDB0037589","HMDB0002113","HMDB0259044","HMDB0251330","HMDB0003325","HMDB0028892","HMDB0014423","HMDB0028712","HMDB0006587","HMDB0004827","HMDB0062702","HMDB0000446","HMDB0255342","HMDB0035863","HMDB0028954","HMDB0304310","HMDB0259813","HMDB0254342","HMDB0301945","HMDB0011175","HMDB0015267","HMDB0015303","HMDB0251628","HMDB0038883","HMDB0000667","HMDB0000600","HMDB0038482","HMDB0003581","HMDB0000734","HMDB0259749","HMDB0028913","HMDB0028694","HMDB0256647","HMDB0029068","HMDB0029000","HMDB0037892","HMDB0028700","HMDB0256201","HMDB0041372","HMDB0028903","HMDB0028902","HMDB0246316","HMDB0254366","HMDB0005773","HMDB0036708","HMDB0003831","HMDB0004073","HMDB0293304","HMDB0029076","HMDB0255168","HMDB0034695","HMDB0013318","HMDB0013060","HMDB0029120","HMDB0031954","HMDB0243894","HMDB0060684","HMDB0001901","HMDB0000842","HMDB0013209","HMDB0257197","HMDB0060794","HMDB0302013","HMDB0002098","HMDB0250824","HMDB0040943","HMDB0000715;PW_C000566","HMDB0029109","HMDB0015414","HMDB0029135","HMDB0029181","HMDB0029028","HMDB0256589","HMDB0000594","HMDB0244978","HMDB0029134","HMDB0240728","HMDB0262674","HMDB0002094","HMDB0259836","HMDB0060423","HMDB0038689","HMDB0028866","HMDB0059792","HMDB0001520;PW_C001170","HMDB0031101","HMDB0032952","HMDB0031985","HMDB0245261","HMDB0014426;PW_C008817","HMDB0030311","HMDB0028911","HMDB0253397","HMDB0259740","HMDB0253043","HMDB0006348","HMDB0252101","HMDB0251874","HMDB0000030","HMDB0304006","HMDB0029091","HMDB0000493","HMDB0030483","HMDB0030407","HMDB0062407","HMDB0303369","HMDB0004096","HMDB0250793","HMDB0013240","HMDB0242046","HMDB0035386","HMDB0257216","HMDB0013021","HMDB0035103","HMDB0244524","HMDB0255461","HMDB0258653","HMDB0257008","HMDB0254597","HMDB0033573","HMDB0251085","HMDB0303182","HMDB0059810","HMDB0032024","HMDB0258434","HMDB0013302","HMDB0242632","HMDB0252688","HMDB0255850","HMDB0015197;PW_C009493","HMDB0061043","HMDB0029006","HMDB0247230","HMDB0242096","HMDB0040210","HMDB0255544","HMDB0029086","HMDB0011177","HMDB0255056","HMDB0000306;PW_C000210","HMDB0015652","HMDB0303759","HMDB0252941","HMDB0094738","HMDB0000671","HMDB0029090","HMDB0252830","HMDB0000201","HMDB0011179","HMDB0037541","HMDB0304808","HMDB0000764","HMDB0062175","HMDB0035829","HMDB0040810","HMDB0004231;HMDB0304820","HMDB0037490;LMPK12140022","HMDB0246599","HMDB0010355","HMDB0013010","HMDB0242623","HMDB0250981","HMDB0036822","HMDB0259191","HMDB0035352","HMDB0029008","HMDB0252470","HMDB0256490","HMDB0304708","HMDB0036103","HMDB0250276;LMPK12111163","HMDB0003553","HMDB0034084","HMDB0013156","HMDB0245789","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