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MTBLS1:  A metabolomic study of urinary changes in type 2 diabetes in human compared to the control group

 Authors: Reza Salek , Jules Griffin

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  Submitted: 14-Feb-2012 , Release date: 14-Feb-2012 , Update date: 29-Jan-2016

 Submitted by:  Reza Salek  |   Study status: Public

Study Description

Type 2 diabetes mellitus is the result of a combination of impaired insulin secretion with reduced insulin sensitivity of target tissues. There are an estimated 150 million affected individuals worldwide, of whom a large proportion remains undiagnosed because of a lack of specific symptoms early in this disorder and inadequate diagnostics. In this study, NMR-based metabolomic analysis in conjunction with uni- and multivariate statistics was applied to examine the urinary metabolic changes in Human type 2 diabetes mellitus patients compared to the control group. The human population were un medicated diabetic patients who have good daily dietary control over their blood glucose concentrations by following the guidelines on diet issued by the American Diabetes Association. Note: This is part of a larger study, please refer to the original paper below.

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  Organism(s)

Homo sapiens

  Study Design Description

EFO:diabetes mellitus

EFO:metabolic syndrome

Urine global profiling

CHMO:nuclear magnetic resonance spectroscopy

NCIT:Human Study Subject

untargeted metabolites

  Experimental Factors

Gender

Metabolic syndrome

Protocol Description
Extraction For the human studies, midstream urine (∼15 ml) samples were collected and frozen from each volunteer. In total, 84 samples were collected from 12 healthy volunteers (7 time points, 8 males and 4 females) and 50 samples from 30 T2DM patients (1–3 time points, 17 males and 13 females) with well-controlled blood glucose maintained at normal concentrations by diet, following the guidelines issued by the American Diabetes Association, rather than medication. The healthy subjects were aged 18–55 yr, had a body mass index (BMI) ≥19 and ≤30 kg/m2 and a body mass ≥50 kg and ≤113 kg, and were free from any major disease or pregnancy. The T2DM patients were aged 30–65 yr (mean 56 ± 9 yr), had a BMI >25 and <40 kg/m2, weighed between 65 and 140 kg (mean 95 ± 19 kg), and were taking at most one oral anti-diabetic drug. T2DM patients agreed to stop treatment with oral anti-diabetic agents during the study. Subjects went through a washout period of 4 wk before sample collection and abstained from alcohol during the study; diet was controlled throughout the study.
NMR sample Aliquots of 400 µl urine samples were made up to 600 µl with phosphate buffer (0.2 M, pH 7.4) and any precipitate removed by centrifugation. In total, 500 µl of supernatant were transferred to 5-mm NMR tubes with 100 µl of sodium 3-trimethylsilyl-(2,2,3,3-2H4)-1-propionate (TSP)/D2O/sodium azide solution (0.05% wt/vol TSP in D2O and 1% wt/vol sodium azide).
NMR spectroscopy The spectra of human urine samples were acquired on a Bruker DRX700 NMR spectrometer using a 5 mm TXI ATMA probe at a proton frequency of 700.1 MHz and ambient temperature of 27 °C.
NMR assay A 1D NOESY presaturation pulse sequence was used to analyze the urine samples. For each sample 128 transients were collected into 64k data points using a spectral width of 14.005 kHz (20 ppm) and an acquisition time of 2.34 s per FID.
Data transformation Spectra were processed using ACD/1D NMR Manager 8.0 with Intelligent Bucketing Integration (Advanced Chemistry Development, Toronto, ON, Canada). Spectra were integrated 0.20-9.30 ppm excluding water (4.24-5.04 ppm), glucose (3.19-3.99 ppm, 5.21-5.27 ppm), and urea (5.04-6.00 ppm). Intelligent bucketing ensures that bucket edges do not coincide with peak maxima, preventing resonances from being split across separate integral regions; a 0.04 ppm bucket width and a 50% looseness factor were used. All spectra were normalized to total area excluding the water, urea, and glucose regions.
Metabolite identification Assignments were confirmed by two dimensional spectroscopy including homonuclear 1H-1H Correlation Spectroscopy (COSY), 1H-13C Heteronuclear Signal Quantum Coherence (HSQC) and 1H-13C Heteronuclear Multiple Bond Correlation (HMBC) Spectroscopy.
Sample collection For the human studies, midstream urine (~15 ml) samples were collected and frozen from each volunteer. In total, 84 samples were collected from 12 healthy volunteers (7 time points, 8 males and 4 females) and 50 samples from 30 T2DM patients (1-3 time points, 17 males and 13 females) with well-controlled blood glucose maintained at normal concentrations by diet, following the guidelines issued by the American Diabetes Association, rather than medication. T2DM patients agreed to stop treatment with oral anti-diabetic agents during the study. Subjects went through a washout period of 4 wk before sample collection and abstained from alcohol during the study; diet was controlled throughout the study.
Source Name Organism Organism part Protocol REF Sample Name Gender Metabolic syndrome
ADG10003u Homo sapiens urine Sample collection ADG10003u_007 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_008 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_009 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_010 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_015 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_016 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_017 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_021 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_022 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_023 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_051 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_052 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_053 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_066 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_067 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_071 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_072 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_073 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_087 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_088 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_089 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_097 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_098 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_112 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_113 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_114 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_115 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_116 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_117 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_118 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_120 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_151 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_152 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_153 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_155 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_156 Male diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_160 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_161 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_162 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_166 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_167 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_168 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_177 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_178 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_179 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_185 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_186 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG10003u_187 Female diabetes mellitus
ADG10003u Homo sapiens urine Sample collection ADG19007u_011 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_012 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_013 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_014 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_015 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_016 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_017 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_071 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_072 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_073 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_074 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_075 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_076 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_077 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_091 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_092 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_093 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_094 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_095 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_096 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_097 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_161 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_162 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_163 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_164 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_165 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_166 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_167 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_191 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_192 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_193 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_194 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_195 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_196 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_197 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_241 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_242 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_243 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_244 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_245 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_246 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_247 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_281 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_282 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_283 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_284 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_285 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_286 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_287 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_301 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_302 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_303 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_304 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_305 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_306 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_307 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_351 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_352 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_353 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_354 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_355 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_356 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_357 Female Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_401 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_402 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_403 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_404 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_405 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_406 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_407 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_431 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_432 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_433 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_434 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_435 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_436 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_437 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_471 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_472 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_473 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_474 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_475 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_476 Male Control Group
ADG10003u Homo sapiens urine Sample collection ADG19007u_477 Male Control Group
Validations marked with (*) are specially approved by the MetaboLights Curators.
Click here for the detailed description of Validations.
Condition Status Description Requirement Group Message
PASSES Study Title MANDATORY STUDY OK
PASSES Study Description MANDATORY STUDY OK
PASSES Study text successfully parsed OPTIONAL STUDY OK
PASSES Study Contact(s) have listed email MANDATORY CONTACT OK
PASSES Sample(s) MANDATORY SAMPLES OK
PASSES Sample Name consistency check MANDATORY ASSAYS OK
PASSES Publication(s) associated with this Study MANDATORY PUBLICATION OK
PASSES Minimal Experimental protocol MANDATORY PROTOCOLS OK
PASSES Comprehensive Experimental protocol OPTIONAL PROTOCOLS OK
PASSES Sample Collection protocol MANDATORY PROTOCOLS OK
PASSES Protocols text successfully parsed OPTIONAL PROTOCOLS OK
PASSES Organism name MANDATORY ORGANISM OK
PASSES Organism part MANDATORY ORGANISM OK
PASSES Study Factors MANDATORY FACTORS OK
PASSES Assay platform information OPTIONAL ASSAYS OK
PASSES Assay has raw files referenced MANDATORY FILES OK
PASSES Assay referenced raw files detection in filesystem MANDATORY FILES OK
PASSES Raw files in the Assay(s) have the correct format MANDATORY FILES OK
PASSES Assay(s) MANDATORY ASSAYS OK
PASSES All Assays have Metabolite Assignment File (MAF) referenced OPTIONAL FILES OK
PASSES Metabolite Assignment File (MAF) is present in Study folder MANDATORY FILES OK
PASSES Metabolite Assignment File (MAF) has correct format MANDATORY FILES OK
PASSES Metabolite Identification File (MAF) content MANDATORY FILES OK
PASSES ISA-Tab investigation file check MANDATORY ISATAB OK

Assay 

Assay file name: a_mtbls1_metabolite_profiling_NMR_spectroscopy.txt
Measurement: metabolite profiling
Technology: NMR spectroscopy
Platform: Bruker

Data

Sample Name Protocol REF Extraction Method Extract Name Protocol REF NMR tube type Solvent Sample pH Temperature Unit Labeled Extract Name Label Protocol REF Instrument NMR Probe Number of transients Pulse sequence name Magnetic field strength Unit Acquisition Parameter Data File Protocol REF NMR Assay Name Free Induction Decay Data File Protocol REF Normalization Name Derived Spectral Data File Protocol REF Data Transformation Name Metabolite Assignment File
ADG10003u_007 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_007 ADG10003u_007.zip Data transformation ADG_normalized_data.xlsx ADG10003u_007.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_008 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_008 ADG10003u_008.zip Data transformation ADG_normalized_data.xlsx ADG10003u_008.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_009 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_009 ADG10003u_009.zip Data transformation ADG_normalized_data.xlsx ADG10003u_009.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_010 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_010 ADG10003u_010.zip Data transformation ADG_normalized_data.xlsx ADG10003u_010.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_015 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_015 ADG10003u_015.zip Data transformation ADG_normalized_data.xlsx ADG10003u_015.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_016 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_016 ADG10003u_016.zip Data transformation ADG_normalized_data.xlsx ADG10003u_016.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_017 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_017 ADG10003u_017.zip Data transformation ADG_normalized_data.xlsx ADG10003u_017.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_021 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_021 ADG10003u_021.zip Data transformation ADG_normalized_data.xlsx ADG10003u_021.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_022 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_022 ADG10003u_022.zip Data transformation ADG_normalized_data.xlsx ADG10003u_022.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_023 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_023 ADG10003u_023.zip Data transformation ADG_normalized_data.xlsx ADG10003u_023.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_051 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_051 ADG10003u_051.zip Data transformation ADG_normalized_data.xlsx ADG10003u_051.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_052 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_052 ADG10003u_052.zip Data transformation ADG_normalized_data.xlsx ADG10003u_052.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_053 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_053 ADG10003u_053.zip Data transformation ADG_normalized_data.xlsx ADG10003u_053.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_066 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_066 ADG10003u_066.zip Data transformation ADG_normalized_data.xlsx ADG10003u_066.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_067 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_067 ADG10003u_067.zip Data transformation ADG_normalized_data.xlsx ADG10003u_067.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_071 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_071 ADG10003u_071.zip Data transformation ADG_normalized_data.xlsx ADG10003u_071.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_072 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_072 ADG10003u_072.zip Data transformation ADG_normalized_data.xlsx ADG10003u_072.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_073 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_073 ADG10003u_073.zip Data transformation ADG_normalized_data.xlsx ADG10003u_073.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_087 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_087 ADG10003u_087.zip Data transformation ADG_normalized_data.xlsx ADG10003u_087.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_088 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_088 ADG10003u_088.zip Data transformation ADG_normalized_data.xlsx ADG10003u_088.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_089 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_089 ADG10003u_089.zip Data transformation ADG_normalized_data.xlsx ADG10003u_089.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_097 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_097 ADG10003u_097.zip Data transformation ADG_normalized_data.xlsx ADG10003u_097.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_098 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_098 ADG10003u_098.zip Data transformation ADG_normalized_data.xlsx ADG10003u_098.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_112 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_112 ADG10003u_112.zip Data transformation ADG_normalized_data.xlsx ADG10003u_112.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_113 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_113 ADG10003u_113.zip Data transformation ADG_normalized_data.xlsx ADG10003u_113.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_114 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_114 ADG10003u_114.zip Data transformation ADG_normalized_data.xlsx ADG10003u_114.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_115 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_115 ADG10003u_115.zip Data transformation ADG_normalized_data.xlsx ADG10003u_115.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_116 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_116 ADG10003u_116.zip Data transformation ADG_normalized_data.xlsx ADG10003u_116.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_117 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_117 ADG10003u_117.zip Data transformation ADG_normalized_data.xlsx ADG10003u_117.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_118 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_118 ADG10003u_118.zip Data transformation ADG_normalized_data.xlsx ADG10003u_118.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_120 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_120 ADG10003u_120.zip Data transformation ADG_normalized_data.xlsx ADG10003u_120.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_151 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_151 ADG10003u_151.zip Data transformation ADG_normalized_data.xlsx ADG10003u_151.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_152 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_152 ADG10003u_152.zip Data transformation ADG_normalized_data.xlsx ADG10003u_152.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_153 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_153 ADG10003u_153.zip Data transformation ADG_normalized_data.xlsx ADG10003u_153.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_155 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_155 ADG10003u_155.zip Data transformation ADG_normalized_data.xlsx ADG10003u_155.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_156 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_156 ADG10003u_156.zip Data transformation ADG_normalized_data.xlsx ADG10003u_156.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_160 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_160 ADG10003u_160.zip Data transformation ADG_normalized_data.xlsx ADG10003u_160.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_161 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_161 ADG10003u_161.zip Data transformation ADG_normalized_data.xlsx ADG10003u_161.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_162 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_162 ADG10003u_162.zip Data transformation ADG_normalized_data.xlsx ADG10003u_162.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_166 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_166 ADG10003u_166.zip Data transformation ADG_normalized_data.xlsx ADG10003u_166.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_167 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_167 ADG10003u_167.zip Data transformation ADG_normalized_data.xlsx ADG10003u_167.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_168 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_168 ADG10003u_168.zip Data transformation ADG_normalized_data.xlsx ADG10003u_168.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_177 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_177 ADG10003u_177.zip Data transformation ADG_normalized_data.xlsx ADG10003u_177.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_178 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_178 ADG10003u_178.zip Data transformation ADG_normalized_data.xlsx ADG10003u_178.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_179 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_179 ADG10003u_179.zip Data transformation ADG_normalized_data.xlsx ADG10003u_179.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_185 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_185 ADG10003u_185.zip Data transformation ADG_normalized_data.xlsx ADG10003u_185.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_186 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_186 ADG10003u_186.zip Data transformation ADG_normalized_data.xlsx ADG10003u_186.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG10003u_187 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG10003u_187 ADG10003u_187.zip Data transformation ADG_normalized_data.xlsx ADG10003u_187.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_011 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_011 ADG19007u_011.zip Data transformation ADG_normalized_data.xlsx ADG19007u_011.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_012 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_012 ADG19007u_012.zip Data transformation ADG_normalized_data.xlsx ADG19007u_012.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_013 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_013 ADG19007u_013.zip Data transformation ADG_normalized_data.xlsx ADG19007u_013.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_014 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_014 ADG19007u_014.zip Data transformation ADG_normalized_data.xlsx ADG19007u_014.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_015 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_015 ADG19007u_015.zip Data transformation ADG_normalized_data.xlsx ADG19007u_015.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_016 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_016 ADG19007u_016.zip Data transformation ADG_normalized_data.xlsx ADG19007u_016.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_017 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_017 ADG19007u_017.zip Data transformation ADG_normalized_data.xlsx ADG19007u_017.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_071 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_071 ADG19007u_071.zip Data transformation ADG_normalized_data.xlsx ADG19007u_071.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_072 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_072 ADG19007u_072.zip Data transformation ADG_normalized_data.xlsx ADG19007u_072.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_073 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_073 ADG19007u_073.zip Data transformation ADG_normalized_data.xlsx ADG19007u_073.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_074 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_074 ADG19007u_074.zip Data transformation ADG_normalized_data.xlsx ADG19007u_074.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_075 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_075 ADG19007u_075.zip Data transformation ADG_normalized_data.xlsx ADG19007u_075.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_076 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_076 ADG19007u_076.zip Data transformation ADG_normalized_data.xlsx ADG19007u_076.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_077 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_077 ADG19007u_077.zip Data transformation ADG_normalized_data.xlsx ADG19007u_077.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_091 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_091 ADG19007u_091.zip Data transformation ADG_normalized_data.xlsx ADG19007u_091.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_092 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_092 ADG19007u_092.zip Data transformation ADG_normalized_data.xlsx ADG19007u_092.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_093 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_093 ADG19007u_093.zip Data transformation ADG_normalized_data.xlsx ADG19007u_093.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_094 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_094 ADG19007u_094.zip Data transformation ADG_normalized_data.xlsx ADG19007u_094.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_095 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_095 ADG19007u_095.zip Data transformation ADG_normalized_data.xlsx ADG19007u_095.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_096 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_096 ADG19007u_096.zip Data transformation ADG_normalized_data.xlsx ADG19007u_096.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_097 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_097 ADG19007u_097.zip Data transformation ADG_normalized_data.xlsx ADG19007u_097.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_161 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_161 ADG19007u_161.zip Data transformation ADG_normalized_data.xlsx ADG19007u_161.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_162 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_162 ADG19007u_162.zip Data transformation ADG_normalized_data.xlsx ADG19007u_162.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_163 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_163 ADG19007u_163.zip Data transformation ADG_normalized_data.xlsx ADG19007u_163.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_164 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_164 ADG19007u_164.zip Data transformation ADG_normalized_data.xlsx ADG19007u_164.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_165 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_165 ADG19007u_165.zip Data transformation ADG_normalized_data.xlsx ADG19007u_165.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_166 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_166 ADG19007u_166.zip Data transformation ADG_normalized_data.xlsx ADG19007u_166.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_167 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_167 ADG19007u_167.zip Data transformation ADG_normalized_data.xlsx ADG19007u_167.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_191 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_191 ADG19007u_191.zip Data transformation ADG_normalized_data.xlsx ADG19007u_191.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_192 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_192 ADG19007u_192.zip Data transformation ADG_normalized_data.xlsx ADG19007u_192.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_193 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_193 ADG19007u_193.zip Data transformation ADG_normalized_data.xlsx ADG19007u_193.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_194 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_194 ADG19007u_194.zip Data transformation ADG_normalized_data.xlsx ADG19007u_194.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_195 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_195 ADG19007u_195.zip Data transformation ADG_normalized_data.xlsx ADG19007u_195.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_196 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_196 ADG19007u_196.zip Data transformation ADG_normalized_data.xlsx ADG19007u_196.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_197 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_197 ADG19007u_197.zip Data transformation ADG_normalized_data.xlsx ADG19007u_197.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_241 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_241 ADG19007u_241.zip Data transformation ADG_normalized_data.xlsx ADG19007u_241.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_242 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_242 ADG19007u_242.zip Data transformation ADG_normalized_data.xlsx ADG19007u_242.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_243 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_243 ADG19007u_243.zip Data transformation ADG_normalized_data.xlsx ADG19007u_243.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_244 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_244 ADG19007u_244.zip Data transformation ADG_normalized_data.xlsx ADG19007u_244.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_245 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_245 ADG19007u_245.zip Data transformation ADG_normalized_data.xlsx ADG19007u_245.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_246 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_246 ADG19007u_246.zip Data transformation ADG_normalized_data.xlsx ADG19007u_246.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_247 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_247 ADG19007u_247.zip Data transformation ADG_normalized_data.xlsx ADG19007u_247.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_281 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_281 ADG19007u_281.zip Data transformation ADG_normalized_data.xlsx ADG19007u_281.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_282 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_282 ADG19007u_282.zip Data transformation ADG_normalized_data.xlsx ADG19007u_282.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_283 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_283 ADG19007u_283.zip Data transformation ADG_normalized_data.xlsx ADG19007u_283.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_284 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_284 ADG19007u_284.zip Data transformation ADG_normalized_data.xlsx ADG19007u_284.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_285 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_285 ADG19007u_285.zip Data transformation ADG_normalized_data.xlsx ADG19007u_285.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_286 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_286 ADG19007u_286.zip Data transformation ADG_normalized_data.xlsx ADG19007u_286.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_287 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_287 ADG19007u_287.zip Data transformation ADG_normalized_data.xlsx ADG19007u_287.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_301 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_301 ADG19007u_301.zip Data transformation ADG_normalized_data.xlsx ADG19007u_301.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_302 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_302 ADG19007u_302.zip Data transformation ADG_normalized_data.xlsx ADG19007u_302.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_303 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_303 ADG19007u_303.zip Data transformation ADG_normalized_data.xlsx ADG19007u_303.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_304 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_304 ADG19007u_304.zip Data transformation ADG_normalized_data.xlsx ADG19007u_304.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_305 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_305 ADG19007u_305.zip Data transformation ADG_normalized_data.xlsx ADG19007u_305.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_306 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_306 ADG19007u_306.zip Data transformation ADG_normalized_data.xlsx ADG19007u_306.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_307 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_307 ADG19007u_307.zip Data transformation ADG_normalized_data.xlsx ADG19007u_307.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_351 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_351 ADG19007u_351.zip Data transformation ADG_normalized_data.xlsx ADG19007u_351.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_352 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_352 ADG19007u_352.zip Data transformation ADG_normalized_data.xlsx ADG19007u_352.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_353 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_353 ADG19007u_353.zip Data transformation ADG_normalized_data.xlsx ADG19007u_353.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_354 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_354 ADG19007u_354.zip Data transformation ADG_normalized_data.xlsx ADG19007u_354.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_355 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_355 ADG19007u_355.zip Data transformation ADG_normalized_data.xlsx ADG19007u_355.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_356 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_356 ADG19007u_356.zip Data transformation ADG_normalized_data.xlsx ADG19007u_356.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_357 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_357 ADG19007u_357.zip Data transformation ADG_normalized_data.xlsx ADG19007u_357.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_401 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_401 ADG19007u_401.zip Data transformation ADG_normalized_data.xlsx ADG19007u_401.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_402 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_402 ADG19007u_402.zip Data transformation ADG_normalized_data.xlsx ADG19007u_402.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_403 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_403 ADG19007u_403.zip Data transformation ADG_normalized_data.xlsx ADG19007u_403.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_404 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_404 ADG19007u_404.zip Data transformation ADG_normalized_data.xlsx ADG19007u_404.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_405 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_405 ADG19007u_405.zip Data transformation ADG_normalized_data.xlsx ADG19007u_405.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_406 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_406 ADG19007u_406.zip Data transformation ADG_normalized_data.xlsx ADG19007u_406.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_407 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_407 ADG19007u_407.zip Data transformation ADG_normalized_data.xlsx ADG19007u_407.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_431 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_431 ADG19007u_431.zip Data transformation ADG_normalized_data.xlsx ADG19007u_431.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_432 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_432 ADG19007u_432.zip Data transformation ADG_normalized_data.xlsx ADG19007u_432.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_433 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_433 ADG19007u_433.zip Data transformation ADG_normalized_data.xlsx ADG19007u_433.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_434 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_434 ADG19007u_434.zip Data transformation ADG_normalized_data.xlsx ADG19007u_434.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_435 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_435 ADG19007u_435.zip Data transformation ADG_normalized_data.xlsx ADG19007u_435.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_436 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_436 ADG19007u_436.zip Data transformation ADG_normalized_data.xlsx ADG19007u_436.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_437 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_437 ADG19007u_437.zip Data transformation ADG_normalized_data.xlsx ADG19007u_437.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_471 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_471 ADG19007u_471.zip Data transformation ADG_normalized_data.xlsx ADG19007u_471.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_472 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_472 ADG19007u_472.zip Data transformation ADG_normalized_data.xlsx ADG19007u_472.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_473 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_473 ADG19007u_473.zip Data transformation ADG_normalized_data.xlsx ADG19007u_473.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_474 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_474 ADG19007u_474.zip Data transformation ADG_normalized_data.xlsx ADG19007u_474.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_475 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_475 ADG19007u_475.zip Data transformation ADG_normalized_data.xlsx ADG19007u_475.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_476 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_476 ADG19007u_476.zip Data transformation ADG_normalized_data.xlsx ADG19007u_476.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
ADG19007u_477 Extraction N/A N/A NMR sample 5 mm standard 0.2 M phosphate buffered D2O 7.4 300 kelvin N/A hydrogen molecular entity NMR spectroscopy Bruker AVANCE DRX 700 MHz spectrometer 5 mm TXI ATMA 128 1D NOESY with presaturation (noesypr1d) 16.4 tesla NMR assay ADG19007u_477 ADG19007u_477.zip Data transformation ADG_normalized_data.xlsx ADG19007u_477.nmrML Metabolite identification ADG_transformed_data.xlsx m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv

Pathways - Assay 



MetExplore Pathways Mapping

Name DB Identifier Mapped Metabolite(s)
  Download whole study (SLOW)  |  Download study (FTP)  |    Download metadata    

Aspera Download Details:

List of study files   Subset

File
audit
ADG_transformed_data.xlsx
ADG10003u_007.nmrML
ADG10003u_007.zip
ADG10003u_008.nmrML
ADG10003u_008.zip
ADG10003u_009.nmrML
ADG10003u_009.zip
ADG10003u_010.nmrML
ADG10003u_010.zip
ADG10003u_015.nmrML
ADG10003u_015.zip
ADG10003u_016.nmrML
ADG10003u_016.zip
ADG10003u_017.nmrML
ADG10003u_017.zip
ADG10003u_021.nmrML
ADG10003u_021.zip
ADG10003u_022.nmrML
ADG10003u_022.zip
ADG10003u_023.nmrML
ADG10003u_023.zip
ADG10003u_051.nmrML
ADG10003u_051.zip
ADG10003u_052.nmrML
ADG10003u_052.zip
ADG10003u_053.nmrML
ADG10003u_053.zip
ADG10003u_066.nmrML
ADG10003u_066.zip
ADG10003u_067.nmrML
ADG10003u_067.zip
ADG10003u_071.nmrML
ADG10003u_071.zip
ADG10003u_072.nmrML
ADG10003u_072.zip
ADG10003u_073.nmrML
ADG10003u_073.zip
ADG10003u_087.nmrML
ADG10003u_087.zip
ADG10003u_088.nmrML
ADG10003u_088.zip
ADG10003u_089.nmrML
ADG10003u_089.zip
ADG10003u_097.nmrML
ADG10003u_097.zip
ADG10003u_098.nmrML
ADG10003u_098.zip
ADG10003u_112.nmrML
ADG10003u_112.zip
ADG10003u_113.nmrML
ADG10003u_113.zip
ADG10003u_114.nmrML
ADG10003u_114.zip
ADG10003u_115.nmrML
ADG10003u_115.zip
ADG10003u_116.nmrML
ADG10003u_116.zip
ADG10003u_117.nmrML
ADG10003u_117.zip
ADG10003u_118.nmrML
ADG10003u_118.zip
ADG10003u_120.nmrML
ADG10003u_120.zip
ADG10003u_151.nmrML
ADG10003u_151.zip
ADG10003u_152.nmrML
ADG10003u_152.zip
ADG10003u_153.nmrML
ADG10003u_153.zip
ADG10003u_155.nmrML
ADG10003u_155.zip
ADG10003u_156.nmrML
ADG10003u_156.zip
ADG10003u_160.nmrML
ADG10003u_160.zip
ADG10003u_161.nmrML
ADG10003u_161.zip
ADG10003u_162.nmrML
ADG10003u_162.zip
ADG10003u_166.nmrML
ADG10003u_166.zip
ADG10003u_167.nmrML
ADG10003u_167.zip
ADG10003u_168.nmrML
ADG10003u_168.zip
ADG10003u_177.nmrML
ADG10003u_177.zip
ADG10003u_178.nmrML
ADG10003u_178.zip
ADG10003u_179.nmrML
ADG10003u_179.zip
ADG10003u_185.nmrML
ADG10003u_185.zip
ADG10003u_186.nmrML
ADG10003u_186.zip
ADG10003u_187.nmrML
ADG10003u_187.zip
ADG19007u_011.nmrML
ADG19007u_011.zip
ADG19007u_012.nmrML
ADG19007u_012.zip
ADG19007u_013.nmrML
ADG19007u_013.zip
ADG19007u_014.nmrML
ADG19007u_014.zip
ADG19007u_015.nmrML
ADG19007u_015.zip
ADG19007u_016.nmrML
ADG19007u_016.zip
ADG19007u_017.nmrML
ADG19007u_017.zip
ADG19007u_071.nmrML
ADG19007u_071.zip
ADG19007u_072.nmrML
ADG19007u_072.zip
ADG19007u_073.nmrML
ADG19007u_073.zip
ADG19007u_074.nmrML
ADG19007u_074.zip
ADG19007u_075.nmrML
ADG19007u_075.zip
ADG19007u_076.nmrML
ADG19007u_076.zip
ADG19007u_077.nmrML
ADG19007u_077.zip
ADG19007u_091.nmrML
ADG19007u_091.zip
ADG19007u_092.nmrML
ADG19007u_092.zip
ADG19007u_093.nmrML
ADG19007u_093.zip
ADG19007u_094.nmrML
ADG19007u_094.zip
ADG19007u_095.nmrML
ADG19007u_095.zip
ADG19007u_096.nmrML
ADG19007u_096.zip
ADG19007u_097.nmrML
ADG19007u_097.zip
ADG19007u_161.nmrML
ADG19007u_161.zip
ADG19007u_162.nmrML
ADG19007u_162.zip
ADG19007u_163.nmrML
ADG19007u_163.zip
ADG19007u_164.nmrML
ADG19007u_164.zip
ADG19007u_165.nmrML
ADG19007u_165.zip
ADG19007u_166.nmrML
ADG19007u_166.zip
ADG19007u_167.nmrML
ADG19007u_167.zip
ADG19007u_191.nmrML
ADG19007u_191.zip
ADG19007u_192.nmrML
ADG19007u_192.zip
ADG19007u_193.nmrML
ADG19007u_193.zip
ADG19007u_194.nmrML
ADG19007u_194.zip
ADG19007u_195.nmrML
ADG19007u_195.zip
ADG19007u_196.nmrML
ADG19007u_196.zip
ADG19007u_197.nmrML
ADG19007u_197.zip
ADG19007u_241.nmrML
ADG19007u_241.zip
ADG19007u_242.nmrML
ADG19007u_242.zip
ADG19007u_243.nmrML
ADG19007u_243.zip
ADG19007u_244.nmrML
ADG19007u_244.zip
ADG19007u_245.nmrML
ADG19007u_245.zip
ADG19007u_246.nmrML
ADG19007u_246.zip
ADG19007u_247.nmrML
ADG19007u_247.zip
ADG19007u_281.nmrML
ADG19007u_281.zip
ADG19007u_282.nmrML
ADG19007u_282.zip
ADG19007u_283.nmrML
ADG19007u_283.zip
ADG19007u_284.nmrML
ADG19007u_284.zip
ADG19007u_285.nmrML
ADG19007u_285.zip
ADG19007u_286.nmrML
ADG19007u_286.zip
ADG19007u_287.nmrML
ADG19007u_287.zip
ADG19007u_301.nmrML
ADG19007u_301.zip
ADG19007u_302.nmrML
ADG19007u_302.zip
ADG19007u_303.nmrML
ADG19007u_303.zip
ADG19007u_304.nmrML
ADG19007u_304.zip
ADG19007u_305.nmrML
ADG19007u_305.zip
ADG19007u_306.nmrML
ADG19007u_306.zip
ADG19007u_307.nmrML
ADG19007u_307.zip
ADG19007u_351.nmrML
ADG19007u_351.zip
ADG19007u_352.nmrML
ADG19007u_352.zip
ADG19007u_353.nmrML
ADG19007u_353.zip
ADG19007u_354.nmrML
ADG19007u_354.zip
ADG19007u_355.nmrML
ADG19007u_355.zip
ADG19007u_356.nmrML
ADG19007u_356.zip
ADG19007u_357.nmrML
ADG19007u_357.zip
ADG19007u_401.nmrML
ADG19007u_401.zip
ADG19007u_402.nmrML
ADG19007u_402.zip
ADG19007u_403.nmrML
ADG19007u_403.zip
ADG19007u_404.nmrML
ADG19007u_404.zip
ADG19007u_405.nmrML
ADG19007u_405.zip
ADG19007u_406.nmrML
ADG19007u_406.zip
ADG19007u_407.nmrML
ADG19007u_407.zip
ADG19007u_431.nmrML
ADG19007u_431.zip
ADG19007u_432.nmrML
ADG19007u_432.zip
ADG19007u_433.nmrML
ADG19007u_433.zip
ADG19007u_434.nmrML
ADG19007u_434.zip
ADG19007u_435.nmrML
ADG19007u_435.zip
ADG19007u_436.nmrML
ADG19007u_436.zip
ADG19007u_437.nmrML
ADG19007u_437.zip
ADG19007u_471.nmrML
ADG19007u_471.zip
ADG19007u_472.nmrML
ADG19007u_472.zip
ADG19007u_473.nmrML
ADG19007u_473.zip
ADG19007u_474.nmrML
ADG19007u_474.zip
ADG19007u_475.nmrML
ADG19007u_475.zip
ADG19007u_476.nmrML
ADG19007u_476.zip
ADG19007u_477.nmrML
ADG19007u_477.zip
metexplore_mapping.json
i_Investigation.txt
a_mtbls1_metabolite_profiling_NMR_spectroscopy.txt
m_mtbls1_metabolite_profiling_NMR_spectroscopy_v2_maf.tsv
s_MTBLS1.txt

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