MTBLS91: The metabolic response of marine copepods to environmental warming and ocean acidification in the absence of food

Abstract

Marine copepods are central to the productivity and biogeochemistry of marine ecosystems. Nevertheless, the direct and indirect effects of climate change on their metabolic functioning remain poorly understood. Here, we use metabolomics, the unbiased study of multiple low molecular weight organic metabolites, to examine how the physiology of Calanus spp. is affected by end-of-century global warming and ocean acidification scenarios. We report that the physiological stresses associated with incubation without food over a 5-day period greatly exceed those caused directly by seawater temperature or pH perturbations. This highlights the need to contextualise the results of climate change experiments by comparison to other, naturally occurring stressors such as food deprivation, which is being exacerbated by global warming. Protein and lipid metabolism were up-regulated in the food-deprived animals, with a novel class of taurine-containing lipids and the essential polyunsaturated fatty acids (PUFAs), eicosapentaenoic acid and docosahexaenoic acid, changing significantly over the duration of our experiment. Copepods derive these PUFAs by ingesting diatoms and flagellated microplankton respectively. Climate-driven changes in the productivity, phenology and composition of microplankton communities, and hence the availability of these fatty acids, therefore have the potential to influence the ability of copepods to survive starvation and other environmental stressors.

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 Authors: Ulf Sommer, Daniel Mayor, Kathryn Cook, Mark Viant

  Release date: 13-Oct-2015

 Status: Public

Organism(s)

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Calanus

  Study Design

EFO:metabolomic profiling

CSEO:Lipidomics

Direct Infusion Mass Spectrometry

MESH:Multivariate Analysis

untargeted metabolites

  Experimental Factors

treatment days

temperature

CO2 concentration

Protocol Description
Sample collection Our fully factorial experiment compared the metabolic profiles of 10 replicate groups of 5 wild-caught Calanus spp. stage 5 copepodites (so-called ‘CVs’) acclimated to 8 °C and 10 °C in 0.2 µm filtered seawater (FSW) to those of replicate groups of CVs incubated in FSW at 8 °C or 10 °C that had been equilibrated to ambient air, containing ~380 µatm pCO2 (ambient hereafter), or air enriched to 1000 µatm pCO2, for a period of 5 days in the absence of food (6 treatment regimes, n=10 each, total n=60). CO2-enriched air was commercially produced to order (BOC Special Gases, UK). Experimental animals were collected off Stonehaven, NE Scotland (56°57.80N, 02°06.20W) on 23 May 2011 using a 1 m ring net fitted with a 250 µm mesh net and non-filtering cod-end. The percentage abundance of C. helgolandicus:C. finmarchicus was 55:45 at the time of sampling. Zooplankton were gently concentrated onto a 45 µm mesh and 60 replicate groups of 5 Calanus spp. CVs were carefully picked into FSW; 30 of these replicates were acclimated to each of the two temperature regimes in ambient FSW for 72 hrs prior to experimentation. We chose to work with CVs to ensure that eggs were not available as a potential food source during our experiment. No attempts were made to distinguish between live C. helgolandicus and C. finmarchicus (Calanus spp. hereafter) because it is not possible to reliably achieve this without inflicting severe stress and/or killing the animals. At the outset of the experiment (t0), 10 replicate groups of 5 animals from the two temperatures were individually concentrated onto a 45 µm mesh, rapidly transferred into Precellys homogenisation tubes (Stretton Scientific, UK) and flash frozen in liquid nitrogen.

The experimental setup was conceptually similar to that described previously[1]. Experimental animals were transferred into 500 ml egg production chambers containing FSW at the prescribed temperature and CO2 level, topped up with the appropriate FSW (ambient or 1000 µatm pCO2) and sealed with an air-tight lid to avoid CO2 out-gassing. These were incubated for 24 hrs and subsequently transferred into fresh FSW at the same temperature and CO2 level after each 24 hr incubation period for a total of 5 days. The experiment was conducted in the absence of food to simultaneously examine the effects of food deprivation. This also avoided any confounding effects of feeding differences between the treatments. At the end of the experiment (t5) animals were collected and flash frozen in liquid nitrogen as described above. All samples were stored frozen at -80 °C until analysis. The pH of the incubation water was measured at the start and end of each 24-hr period using a Hanna bench top meter (H1859) following calibration using reference standards at pH 4, 7 and 10 (Sigma, UK). Average pH values of the ambient and CO2-acidified experimental seawater were 8.09 ± 0.03 (sd) and 7.76 ± 0.08, respectively; values did not differ between the temperature treatments (F=0.616, df=1, p=0.4337) or between the start and end of each 24 hr incubation period (F=0.100, df=1, p=0.7522).

Ref:
[1] Mayor DJ, Matthews C, Cook K, Zuur AF, Hay S (2007) CO2-induced acidification affects hatching success in Calanus finmarchicus. Mar Ecol Prog Ser 350:91-97. doi:10.3354/meps07142.
Extraction Metabolites were extracted from each sample, using a two-step methanol/water/chloroform protocol. In brief, 100 µl methanol (HPLC grade) and 40 µl water per copepod were added to each sample prior to homogenization using a Precellys-24 ceramic bead-based homogenizer (Stretton Scientific, UK). Thereafter, 50 µl water and 100 µl chloroform per copepod were added to each sample, which was vortexed and centrifuged (1800 rcf, 10 min, 4 ºC), yielding an upper (polar) and lower (non-polar) fraction for each sample. Each polar fraction was collected into a 1.5 ml Eppendorf tube, and the non-polar fraction into a 1.8 ml glass vial. Extraction blanks were also prepared using identical methods except that no biological material was added to the solvents. Two quality control samples were pooled from polar and nonpolar extracts, respectively. All polar samples were dried in a centrifugal concentrator (Thermo Savant, Holbrook, NY), the nonpolar samples under a stream of nitrogen gas. All samples were stored at -80 ºC prior to analysis.
Chromatography Not applicable.
Mass spectrometry Direct infusion mass spectrometry data acquisition in the positive ion mode was performed on a LTQ-FT Ultra mass spectrometer (Thermo Fisher Scientific, Bremen, Germany) with a chip-based Advion Triversa direct infusion nanoelectrospray source (Triversa, Advion Biosciences, Ithaca, NY). The polar extracts designated for this ion mode were each taken up in 100 µl of 0.25% formic acid in methanol/water 4:1. Samples were centrifuged (10 min, 22000 rcf, 4 ºC) to remove any particular matter. They were run in a controlled-randomized sequence different from the extraction sequence, in three technical replicates which followed each other immediately. QC samples were run in the beginning, the end, and equidistantly throughout the sequence. Data was acquired at nominal 1E5 resolution from m/z 70-590, in 7 wide SIM (selected ion monitoring) windows. Nonpolar (lipid) samples were taken up in the original volume of methanol/chloroform 3:1, containing 5 % ammonium acetate. Data were acquired in increasing SIM windows of 100 Da to 200 Da width, from m/z 120 to 1200.
Data transformation Raw mass spectral data were processed using the SIM-stitching algorithm (scripts available on request), using an in-house Matlab script.
Metabolite identification The data matrices were normalized using the PQN algorithm. Missing values were imputed into the resulting data matrix using the KNN algorithm via an in-house R script. This matrix would be used for univariate statistics. The matrix was transformed using the generalised logarithm to stabilise the variance across the measured peaks prior to analysis with multivariate statistics.

Principal components analysis (PCA) was used initially to assess the overall metabolic differences between the sample groups in an unbiased manner, using the PLS Toolbox (version 5.5.1, Eigenvector Research, Manson, WA, USA) within Matlab (version 7.8; The MathsWorks, Natick, MA, USA). The significance of any group separation along individual principal components was tested using ANOVA and Tukey posthoc tests. Partial least squares discriminant analysis (PLS-DA), a form of supervised multivariate analysis, was performed using the PLS Toolbox, with internal cross-validation (Venetian blinds). The optimal number of latent variables was determined by minimising the classification error and the significance of the predictive models using in-house MatLab scripts. Student t-tests, corrected for a 5% false discovery rate (FDR, Benjamini-Hochberg) using in-house R scripts, were used to confirm the significance of changes in individual mass spectral signals. Corrected p values are reported here as q values.

Signals were putatively annotated with empirical formulae calculated by the MIPack software[1], searching the KEGG[2][3] and LipidMaps[4][5] databases, and confirmed by performing calculations based on the original spectra in Xcalibur 2.0.7 (Thermo Fisher Scientific). Many signals that contributed significantly to distinguishing the metabolic profiles of individual treatment groups could not be identified by the combination of database and empirical formula searches. Consequently, further identification of selected metabolites was performed using mass spectrometry (same instrument as above). This utilised wide SIM windows and the m/z values of identified signals for additional high mass accuracy measurement of unknown signals, narrow SIM (nSIM) windows at up to 4E5 nominal resolution for the determination of isotope patterns, and MSn fragmentation using collision-induced dissociation (CID) and infrared multiphoton dissociation (IRMPD).

Ref:
[1] Weber, R. J. M. & Viant, M. R. MI-Pack: increased confidence of metabolite identification in mass spectra by integrating accurate masses and metabolic pathways. Chemometr. Intell. Lab. 104, 75–82 (2010).
[2] KEGG: Kyoto Encyclopedia of Genes and Genomics. Available at: www.genome.jp/kegg/download/.
[3] Kanehisa, M., Goto, S., Sato, Y., Furumichi, M. & Tanabe, M. KEGG for integration and interpretation of large-scale molecular data sets. Nucleic Acids Res. 40, D109–D114 (2012). doi: 10.1093/nar/gkr988. PMID:22080510
[4] LIPID MAPS Structural Database (LMSD). Available at: www.lipidmaps.org/resources/downloads/.
[5] Fahy, E., Sud, M., Cotter, D. & Subramaniam, S. LIPID MAPS online tools for lipid research. Nucleic Acids Res. 35, W606–W612 (2007) doi:10.1093/nar/gkm324. PMID:17584797.
Source Name Organism Variant Organism part Protocol REF Sample Name temperature Unit treatment days Unit CO2 concentration Unit
Calanus1 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_QC01 NA degree Celsius NA day NA parts per million
Calanus2 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_QC02 NA degree Celsius NA day NA parts per million
Calanus3 blank solvent Sample collection P_ExBlank1 NA degree Celsius NA day NA parts per million
Calanus4 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_Ctrl_06 10 degree Celsius 5 day 380 parts per million
Calanus5 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_Ctrl_06 8 degree Celsius 5 day 380 parts per million
Calanus6 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_10C_Ctrl_06 10 degree Celsius 0 day 380 parts per million
Calanus7 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_CO2_06 8 degree Celsius 5 day 1000 parts per million
Calanus8 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_CO2_06 10 degree Celsius 5 day 1000 parts per million
Calanus9 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_08C_Ctrl_06 8 degree Celsius 0 day 380 parts per million
Calanus10 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_Ctrl_03 10 degree Celsius 5 day 380 parts per million
Calanus11 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_Ctrl_03 8 degree Celsius 5 day 380 parts per million
Calanus12 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_10C_Ctrl_03 10 degree Celsius 0 day 380 parts per million
Calanus13 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_CO2_03 8 degree Celsius 5 day 1000 parts per million
Calanus14 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_CO2_03 10 degree Celsius 5 day 1000 parts per million
Calanus15 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_08C_Ctrl_03 8 degree Celsius 0 day 380 parts per million
Calanus16 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_QC03 NA degree Celsius NA day NA parts per million
Calanus17 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_Ctrl_04 10 degree Celsius 5 day 380 parts per million
Calanus18 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_Ctrl_04 8 degree Celsius 5 day 380 parts per million
Calanus19 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_10C_Ctrl_04 10 degree Celsius 0 day 380 parts per million
Calanus20 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_CO2_04 8 degree Celsius 5 day 1000 parts per million
Calanus21 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_CO2_04 10 degree Celsius 5 day 1000 parts per million
Calanus22 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_08C_Ctrl_04 8 degree Celsius 0 day 380 parts per million
Calanus23 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_Ctrl_08 10 degree Celsius 5 day 380 parts per million
Calanus24 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_Ctrl_08 8 degree Celsius 5 day 380 parts per million
Calanus25 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_10C_Ctrl_08 10 degree Celsius 0 day 380 parts per million
Calanus26 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_CO2_08 8 degree Celsius 5 day 1000 parts per million
Calanus27 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_CO2_08 10 degree Celsius 5 day 1000 parts per million
Calanus28 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_08C_Ctrl_08 8 degree Celsius 0 day 380 parts per million
Calanus29 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_QC04 NA degree Celsius NA day NA parts per million
Calanus30 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_Ctrl_01 10 degree Celsius 5 day 380 parts per million
Calanus31 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_Ctrl_01 8 degree Celsius 5 day 380 parts per million
Calanus32 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_10C_Ctrl_01 10 degree Celsius 0 day 380 parts per million
Calanus33 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_CO2_01 8 degree Celsius 5 day 1000 parts per million
Calanus34 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_CO2_01 10 degree Celsius 5 day 1000 parts per million
Calanus35 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_08C_Ctrl_01 8 degree Celsius 0 day 380 parts per million
Calanus36 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_Ctrl_07 10 degree Celsius 5 day 380 parts per million
Calanus37 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_Ctrl_07 8 degree Celsius 5 day 380 parts per million
Calanus38 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_10C_Ctrl_07 10 degree Celsius 0 day 380 parts per million
Calanus39 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_CO2_07 8 degree Celsius 5 day 1000 parts per million
Calanus40 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_CO2_07 10 degree Celsius 5 day 1000 parts per million
Calanus41 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_08C_Ctrl_07 8 degree Celsius 0 day 380 parts per million
Calanus42 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_QC05 NA degree Celsius NA day NA parts per million
Calanus43 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_Ctrl_02 10 degree Celsius 5 day 380 parts per million
Calanus44 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_Ctrl_02 8 degree Celsius 5 day 380 parts per million
Calanus45 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_10C_Ctrl_02 10 degree Celsius 0 day 380 parts per million
Calanus46 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_CO2_02 8 degree Celsius 5 day 1000 parts per million
Calanus47 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_CO2_02 10 degree Celsius 5 day 1000 parts per million
Calanus48 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_08C_Ctrl_02 8 degree Celsius 0 day 380 parts per million
Calanus49 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_Ctrl_10 10 degree Celsius 5 day 380 parts per million
Calanus50 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_10C_Ctrl_10 10 degree Celsius 0 day 380 parts per million
Calanus51 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_CO2_10 8 degree Celsius 5 day 1000 parts per million
Calanus52 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_08C_Ctrl_10 8 degree Celsius 0 day 380 parts per million
Calanus53 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_Ctrl_05 10 degree Celsius 5 day 380 parts per million
Calanus54 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_Ctrl_05 8 degree Celsius 5 day 380 parts per million
Calanus55 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_QC06 degree Celsius NA day NA parts per million
Calanus56 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_10C_Ctrl_05 10 degree Celsius 0 day 380 parts per million
Calanus57 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_CO2_05 8 degree Celsius 5 day 1000 parts per million
Calanus58 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_CO2_05 10 degree Celsius 5 day 1000 parts per million
Calanus59 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_08C_Ctrl_05 8 degree Celsius 0 day 380 parts per million
Calanus60 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_Ctrl_09 10 degree Celsius 5 day 380 parts per million
Calanus61 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_Ctrl_09 8 degree Celsius 5 day 380 parts per million
Calanus62 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_10C_Ctrl_09 10 degree Celsius 0 day 380 parts per million
Calanus63 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_08C_CO2_09 8 degree Celsius 5 day 1000 parts per million
Calanus64 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t5_10C_CO2_09 10 degree Celsius 5 day 1000 parts per million
Calanus65 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_t0_08C_Ctrl_09 8 degree Celsius 0 day 380 parts per million
Calanus66 blank solvent Sample collection P_ExBlank2 NA degree Celsius NA day NA parts per million
Calanus67 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_QC07 NA degree Celsius NA day NA parts per million
Calanus68 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection P_QC08 NA degree Celsius NA day NA parts per million
Calanus69 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_QC01 NA degree Celsius NA day NA parts per million
Calanus70 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_QC02 NA degree Celsius NA day NA parts per million
Calanus71 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_QC03 NA degree Celsius NA day NA parts per million
Calanus72 blank solvent Sample collection L_ExBlank1 NA degree Celsius NA day NA parts per million
Calanus73 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_Ctrl_06 10 degree Celsius 5 day 380 parts per million
Calanus74 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_Ctrl_06 8 degree Celsius 5 day 380 parts per million
Calanus75 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_10C_Ctrl_06 10 degree Celsius 0 day 380 parts per million
Calanus76 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_CO2_06 8 degree Celsius 5 day 1000 parts per million
Calanus77 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_CO2_06 10 degree Celsius 5 day 1000 parts per million
Calanus78 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_08C_Ctrl_06 8 degree Celsius 0 day 380 parts per million
Calanus79 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_Ctrl_03 10 degree Celsius 5 day 380 parts per million
Calanus80 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_Ctrl_03 8 degree Celsius 5 day 380 parts per million
Calanus81 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_10C_Ctrl_03 10 degree Celsius 0 day 380 parts per million
Calanus82 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_QC04 NA degree Celsius NA day NA parts per million
Calanus83 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_CO2_03 8 degree Celsius 5 day 1000 parts per million
Calanus84 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_CO2_03 10 degree Celsius 5 day 1000 parts per million
Calanus85 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_QC05 NA degree Celsius NA day NA parts per million
Calanus86 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_08C_Ctrl_03 8 degree Celsius 0 day 380 parts per million
Calanus87 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_Ctrl_04 8 degree Celsius 5 day 380 parts per million
Calanus88 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_10C_Ctrl_04 10 degree Celsius 0 day 380 parts per million
Calanus89 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_CO2_04 8 degree Celsius 5 day 1000 parts per million
Calanus90 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_CO2_04 10 degree Celsius 5 day 1000 parts per million
Calanus91 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_08C_Ctrl_04 8 degree Celsius 0 day 380 parts per million
Calanus92 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_Ctrl_04 10 degree Celsius 5 day 380 parts per million
Calanus93 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_Ctrl_08 10 degree Celsius 5 day 380 parts per million
Calanus94 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_Ctrl_08 8 degree Celsius 5 day 380 parts per million
Calanus95 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_10C_Ctrl_08 10 degree Celsius 0 day 380 parts per million
Calanus96 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_CO2_08 8 degree Celsius 5 day 1000 parts per million
Calanus97 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_CO2_08 10 degree Celsius 5 day 1000 parts per million
Calanus98 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_08C_Ctrl_08 8 degree Celsius 0 day 380 parts per million
Calanus99 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_Ctrl_01 10 degree Celsius 5 day 380 parts per million
Calanus100 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_Ctrl_01 8 degree Celsius 5 day 380 parts per million
Calanus101 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_10C_Ctrl_01 10 degree Celsius 0 day 380 parts per million
Calanus102 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_CO2_01 8 degree Celsius 5 day 1000 parts per million
Calanus103 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_CO2_01 10 degree Celsius 5 day 1000 parts per million
Calanus104 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_QC06 NA degree Celsius NA day NA parts per million
Calanus105 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_08C_Ctrl_01 8 degree Celsius 0 day 380 parts per million
Calanus106 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_Ctrl_07 10 degree Celsius 5 day 380 parts per million
Calanus107 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_Ctrl_07 8 degree Celsius 5 day 380 parts per million
Calanus108 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_10C_Ctrl_07 10 degree Celsius 0 day 380 parts per million
Calanus109 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_CO2_07 8 degree Celsius 5 day 1000 parts per million
Calanus110 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_CO2_07 10 degree Celsius 5 day 1000 parts per million
Calanus111 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_08C_Ctrl_07 8 degree Celsius 0 day 380 parts per million
Calanus112 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_Ctrl_02 10 degree Celsius 5 day 380 parts per million
Calanus113 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_Ctrl_02 8 degree Celsius 5 day 380 parts per million
Calanus114 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_10C_Ctrl_02 10 degree Celsius 0 day 380 parts per million
Calanus115 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_QC07 NA degree Celsius NA day NA parts per million
Calanus116 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_CO2_02 8 degree Celsius 5 day 1000 parts per million
Calanus117 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_CO2_02 10 degree Celsius 5 day 1000 parts per million
Calanus118 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_08C_Ctrl_02 8 degree Celsius 0 day 380 parts per million
Calanus119 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_Ctrl_10 10 degree Celsius 5 day 380 parts per million
Calanus120 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_10C_Ctrl_10 10 degree Celsius 0 day 380 parts per million
Calanus121 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_CO2_10 8 degree Celsius 5 day 1000 parts per million
Calanus122 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_08C_Ctrl_10 8 degree Celsius 0 day 380 parts per million
Calanus123 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_Ctrl_05 10 degree Celsius 5 day 380 parts per million
Calanus124 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_Ctrl_05 8 degree Celsius 5 day 380 parts per million
Calanus125 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_10C_Ctrl_05 10 degree Celsius 0 day 380 parts per million
Calanus126 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_QC08 NA degree Celsius NA day NA parts per million
Calanus127 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_CO2_05 8 degree Celsius 5 day 1000 parts per million
Calanus128 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_CO2_05 10 degree Celsius 5 day 1000 parts per million
Calanus129 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_08C_Ctrl_05 8 degree Celsius 0 day 380 parts per million
Calanus130 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_Ctrl_09 10 degree Celsius 5 day 380 parts per million
Calanus131 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_Ctrl_09 8 degree Celsius 5 day 380 parts per million
Calanus132 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_10C_Ctrl_09 10 degree Celsius 0 day 380 parts per million
Calanus133 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_08C_CO2_09 8 degree Celsius 5 day 1000 parts per million
Calanus134 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t5_10C_CO2_09 10 degree Celsius 5 day 1000 parts per million
Calanus135 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_t0_08C_Ctrl_09 8 degree Celsius 0 day 380 parts per million
Calanus136 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_QC09 NA degree Celsius NA day NA parts per million
Calanus137 Calanus NCBITAXON:Calanus helgolandicus/NCBITAXON:Calanus finmarchicus whole organism Sample collection L_QC10 NA degree Celsius NA day NA parts per million
Calanus138 blank solvent Sample collection L_ExBlank2 NA degree Celsius NA day NA parts per million

Assay  1

Assay file name: a_mtbls91_POLAR_mass_spectrometry.txt
Technology: mass spectrometry
Platform: LTQ FT ULTRA (Thermo Scientific)

Instrumentation

Sample Name Protocol REF Post Extraction Derivatization Extract Name Protocol REF Chromatography Instrument Column model Column type Labeled Extract Name Label Protocol REF Scan polarity Scan m/z range Instrument Ion source Mass analyzer MS Assay Name Raw Spectral Data File Protocol REF Normalization Name Derived Spectral Data File Protocol REF Data Transformation Name Metabolite Assignment File
P_QC01 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_QC01 P_QC01__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_QC02 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_QC02 P_QC02__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_ExBlank1 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_ExBlank1 P_ExBlank1__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_06 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_Ctrl_06 P_t5_10C_Ctrl_06__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_Ctrl_06 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_Ctrl_06 P_t5_08C_Ctrl_06__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_10C_Ctrl_06 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_10C_Ctrl_06 P_t0_10C_Ctrl_06__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_CO2_06 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_CO2_06 P_t5_08C_CO2_06__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_CO2_06 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_CO2_06 P_t5_10C_CO2_06__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_08C_Ctrl_06 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_08C_Ctrl_06 P_t0_08C_Ctrl_06__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_03 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_Ctrl_03 P_t5_10C_Ctrl_03__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_Ctrl_03 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_Ctrl_03 P_t5_08C_Ctrl_03__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_10C_Ctrl_03 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_10C_Ctrl_03 P_t0_10C_Ctrl_03__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_CO2_03 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_CO2_03 P_t5_08C_CO2_03__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_CO2_03 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_CO2_03 P_t5_10C_CO2_03__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_08C_Ctrl_03 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_08C_Ctrl_03 P_t0_08C_Ctrl_03__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_QC03 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_QC03 P_QC03__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_04 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_Ctrl_04 P_t5_10C_Ctrl_04__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_Ctrl_04 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_Ctrl_04 P_t5_08C_Ctrl_04__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_10C_Ctrl_04 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_10C_Ctrl_04 P_t0_10C_Ctrl_04__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_CO2_04 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_CO2_04 P_t5_08C_CO2_04__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_CO2_04 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_CO2_04 P_t5_10C_CO2_04__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_08C_Ctrl_04 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_08C_Ctrl_04 P_t0_08C_Ctrl_04__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_08 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_Ctrl_08 P_t5_10C_Ctrl_08__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_Ctrl_08 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_Ctrl_08 P_t5_08C_Ctrl_08__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_10C_Ctrl_08 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_10C_Ctrl_08 P_t0_10C_Ctrl_08__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_CO2_08 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_CO2_08 P_t5_08C_CO2_08__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_CO2_08 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_CO2_08 P_t5_10C_CO2_08__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_08C_Ctrl_08 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_08C_Ctrl_08 P_t0_08C_Ctrl_08__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_QC04 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_QC04 P_QC04__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_01 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_Ctrl_01 P_t5_10C_Ctrl_01__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_Ctrl_01 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_Ctrl_01 P_t5_08C_Ctrl_01__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_10C_Ctrl_01 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_10C_Ctrl_01 P_t0_10C_Ctrl_01__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_CO2_01 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_CO2_01 P_t5_08C_CO2_01__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_CO2_01 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_CO2_01 P_t5_10C_CO2_01__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_08C_Ctrl_01 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_08C_Ctrl_01 P_t0_08C_Ctrl_01__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_07 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_Ctrl_07 P_t5_10C_Ctrl_07__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_Ctrl_07 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_Ctrl_07 P_t5_08C_Ctrl_07__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_10C_Ctrl_07 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_10C_Ctrl_07 P_t0_10C_Ctrl_07__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_CO2_07 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_CO2_07 P_t5_08C_CO2_07__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_CO2_07 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_CO2_07 P_t5_10C_CO2_07__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_08C_Ctrl_07 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_08C_Ctrl_07 P_t0_08C_Ctrl_07__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_QC05 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_QC05 P_QC05__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_02 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_Ctrl_02 P_t5_10C_Ctrl_02__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_Ctrl_02 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_Ctrl_02 P_t5_08C_Ctrl_02__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_10C_Ctrl_02 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_10C_Ctrl_02 P_t0_10C_Ctrl_02__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_CO2_02 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_CO2_02 P_t5_08C_CO2_02__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_CO2_02 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_CO2_02 P_t5_10C_CO2_02__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_08C_Ctrl_02 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_08C_Ctrl_02 P_t0_08C_Ctrl_02__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_10 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_Ctrl_10 P_t5_10C_Ctrl_10__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_10C_Ctrl_10 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_10C_Ctrl_10 P_t0_10C_Ctrl_10__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_CO2_10 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_CO2_10 P_t5_08C_CO2_10__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_08C_Ctrl_10 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_08C_Ctrl_10 P_t0_08C_Ctrl_10__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_05 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_Ctrl_05 P_t5_10C_Ctrl_05__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_Ctrl_05 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_Ctrl_05 P_t5_08C_Ctrl_05__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_QC06 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_QC06 P_QC06__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_10C_Ctrl_05 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_10C_Ctrl_05 P_t0_10C_Ctrl_05__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_CO2_05 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_CO2_05 P_t5_08C_CO2_05__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_CO2_05 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_CO2_05 P_t5_10C_CO2_05__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_08C_Ctrl_05 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_08C_Ctrl_05 P_t0_08C_Ctrl_05__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_09 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_Ctrl_09 P_t5_10C_Ctrl_09__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_Ctrl_09 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_Ctrl_09 P_t5_08C_Ctrl_09__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_10C_Ctrl_09 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_10C_Ctrl_09 P_t0_10C_Ctrl_09__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_08C_CO2_09 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_08C_CO2_09 P_t5_08C_CO2_09__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_CO2_09 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t5_10C_CO2_09 P_t5_10C_CO2_09__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_t0_08C_Ctrl_09 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_t0_08C_Ctrl_09 P_t0_08C_Ctrl_09__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_ExBlank2 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_ExBlank2 P_ExBlank2__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_QC07 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_QC07 P_QC07__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
P_QC08 Extraction none polar Chromatography Advion TriVersa NanoMate Mass spectrometry positive 70-590 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell P_QC08 P_QC08__Dataset01_IRF.zip Data transformation DM_polar_SFPM_norm.xlsx DM_polar_SFPM.xlsx Metabolite identification DM_polar_SFPM_glog.xlsx m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv

Assay  2

Assay file name: a_mtbls91_NON-POLAR_mass_spectrometry.txt
Technology: mass spectrometry
Platform: LTQ FT ULTRA (Thermo Scientific)

Instrumentation

Sample Name Protocol REF Post Extraction Derivatization Extract Name Protocol REF Chromatography Instrument Column model Column type Labeled Extract Name Label Protocol REF Scan polarity Scan m/z range Instrument Ion source Mass analyzer MS Assay Name Raw Spectral Data File Protocol REF Normalization Name Derived Spectral Data File Protocol REF Data Transformation Name Metabolite Assignment File
L_QC01 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_QC01 L_QC01__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_QC02 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_QC02 L_QC02__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_QC03 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_QC03 L_QC03__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_ExBlank1 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_ExBlank1 L_ExBlank1__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_Ctrl_06 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_Ctrl_06 L_t5_10C_Ctrl_06__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_Ctrl_06 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_Ctrl_06 L_t5_08C_Ctrl_06__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_10C_Ctrl_06 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_10C_Ctrl_06 L_t0_10C_Ctrl_06__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_CO2_06 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_CO2_06 L_t5_08C_CO2_06__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_CO2_06 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_CO2_06 L_t5_10C_CO2_06__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_08C_Ctrl_06 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_08C_Ctrl_06 L_t0_08C_Ctrl_06__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_Ctrl_03 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_Ctrl_03 L_t5_10C_Ctrl_03__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_Ctrl_03 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_Ctrl_03 L_t5_08C_Ctrl_03__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_10C_Ctrl_03 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_10C_Ctrl_03 L_t0_10C_Ctrl_03__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_QC04 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_QC04 L_QC04__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_CO2_03 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_CO2_03 L_t5_08C_CO2_03__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_CO2_03 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_CO2_03 L_t5_10C_CO2_03__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_QC05 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_QC05 L_QC05__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_08C_Ctrl_03 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_08C_Ctrl_03 L_t0_08C_Ctrl_03__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_Ctrl_04 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_Ctrl_04 L_t5_08C_Ctrl_04__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_10C_Ctrl_04 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_10C_Ctrl_04 L_t0_10C_Ctrl_04__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_CO2_04 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_CO2_04 L_t5_08C_CO2_04__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_CO2_04 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_CO2_04 L_t5_10C_CO2_04__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_08C_Ctrl_04 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_08C_Ctrl_04 L_t0_08C_Ctrl_04__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_Ctrl_04 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_Ctrl_04 L_t5_10C_Ctrl_04__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_Ctrl_08 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_Ctrl_08 L_t5_10C_Ctrl_08__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_Ctrl_08 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_Ctrl_08 L_t5_08C_Ctrl_08__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_10C_Ctrl_08 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_10C_Ctrl_08 L_t0_10C_Ctrl_08__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_CO2_08 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_CO2_08 L_t5_08C_CO2_08__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_CO2_08 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_CO2_08 L_t5_10C_CO2_08__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_08C_Ctrl_08 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_08C_Ctrl_08 L_t0_08C_Ctrl_08__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_Ctrl_01 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_Ctrl_01 L_t5_10C_Ctrl_01__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_Ctrl_01 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_Ctrl_01 L_t5_08C_Ctrl_01__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_10C_Ctrl_01 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_10C_Ctrl_01 L_t0_10C_Ctrl_01__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_CO2_01 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_CO2_01 L_t5_08C_CO2_01__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_CO2_01 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_CO2_01 L_t5_10C_CO2_01__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_QC06 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_QC06 L_QC06__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_08C_Ctrl_01 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_08C_Ctrl_01 L_t0_08C_Ctrl_01__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_Ctrl_07 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_Ctrl_07 L_t5_10C_Ctrl_07__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_Ctrl_07 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_Ctrl_07 L_t5_08C_Ctrl_07__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_10C_Ctrl_07 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_10C_Ctrl_07 L_t0_10C_Ctrl_07__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_CO2_07 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_CO2_07 L_t5_08C_CO2_07__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_CO2_07 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_CO2_07 L_t5_10C_CO2_07__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_08C_Ctrl_07 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_08C_Ctrl_07 L_t0_08C_Ctrl_07__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_Ctrl_02 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_Ctrl_02 L_t5_10C_Ctrl_02__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_Ctrl_02 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_Ctrl_02 L_t5_08C_Ctrl_02__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_10C_Ctrl_02 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_10C_Ctrl_02 L_t0_10C_Ctrl_02__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_QC07 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_QC07 L_QC07__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_CO2_02 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_CO2_02 L_t5_08C_CO2_02__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_CO2_02 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_CO2_02 L_t5_10C_CO2_02__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_08C_Ctrl_02 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_08C_Ctrl_02 L_t0_08C_Ctrl_02__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_Ctrl_10 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_Ctrl_10 L_t5_10C_Ctrl_10__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_10C_Ctrl_10 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_10C_Ctrl_10 L_t0_10C_Ctrl_10__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_CO2_10 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_CO2_10 L_t5_08C_CO2_10__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_08C_Ctrl_10 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_08C_Ctrl_10 L_t0_08C_Ctrl_10__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_Ctrl_05 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_Ctrl_05 L_t5_10C_Ctrl_05__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_Ctrl_05 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_Ctrl_05 L_t5_08C_Ctrl_05__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_10C_Ctrl_05 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_10C_Ctrl_05 L_t0_10C_Ctrl_05__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_QC08 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_QC08 L_QC08__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_CO2_05 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_CO2_05 L_t5_08C_CO2_05__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_CO2_05 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_CO2_05 L_t5_10C_CO2_05__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_08C_Ctrl_05 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_08C_Ctrl_05 L_t0_08C_Ctrl_05__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_Ctrl_09 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_Ctrl_09 L_t5_10C_Ctrl_09__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_Ctrl_09 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_Ctrl_09 L_t5_08C_Ctrl_09__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_10C_Ctrl_09 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_10C_Ctrl_09 L_t0_10C_Ctrl_09__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_08C_CO2_09 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_08C_CO2_09 L_t5_08C_CO2_09__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t5_10C_CO2_09 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t5_10C_CO2_09 L_t5_10C_CO2_09__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_t0_08C_Ctrl_09 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_t0_08C_Ctrl_09 L_t0_08C_Ctrl_09__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_QC09 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_QC09 L_QC09__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_QC10 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_QC10 L_QC10__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
L_ExBlank2 Extraction none lipid Chromatography Advion TriVersa NanoMate Mass spectrometry negative 120-1200 Thermo Scientific LTQ FT Ultra MS:nanoelectrospray ion cyclotron resonance cell L_ExBlank2 L_ExBlank2__Dataset01_IRF.zip Data transformation DM_lipids_SFPM_norm.xlsx DM_lipids_SFPM.xlsx Metabolite identification DM_lipids_SFPM_glog.xlsx m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
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List of study files   Subset

File
DM_polar_SFPM_glog.xlsx
a_mtbls91_NON-POLAR_mass_spectrometry.txt
DM_lipids_SFPM.xlsx
DM_lipids_SFPM_glog.xlsx
DM_polar_SFPM.xlsx
L_ExBlank1__Dataset01_IRF.zip
DM_lipids_SFPM_norm.xlsx
DM_polar_SFPM_norm.xlsx
L_QC04__Dataset01_IRF.zip
L_QC09__Dataset01_IRF.zip
L_QC02__Dataset01_IRF.zip
L_QC06__Dataset01_IRF.zip
L_QC10__Dataset01_IRF.zip
L_QC05__Dataset01_IRF.zip
L_QC08__Dataset01_IRF.zip
L_QC07__Dataset01_IRF.zip
L_QC03__Dataset01_IRF.zip
L_QC01__Dataset01_IRF.zip
L_ExBlank2__Dataset01_IRF.zip
L_t0_08C_Ctrl_05__Dataset01_IRF.zip
L_t5_08C_CO2_01__Dataset01_IRF.zip
L_t5_08C_CO2_09__Dataset01_IRF.zip
L_t5_08C_Ctrl_05__Dataset01_IRF.zip
L_t5_08C_Ctrl_09__Dataset01_IRF.zip
L_t5_10C_Ctrl_05__Dataset01_IRF.zip
P_QC06__Dataset01_IRF.zip
P_QC07__Dataset01_IRF.zip
P_t0_10C_Ctrl_04__Dataset01_IRF.zip
L_t0_08C_Ctrl_10__Dataset01_IRF.zip
L_t0_08C_Ctrl_08__Dataset01_IRF.zip
L_t0_10C_Ctrl_05__Dataset01_IRF.zip
L_t0_10C_Ctrl_07__Dataset01_IRF.zip
L_t5_08C_CO2_08__Dataset01_IRF.zip
L_t5_08C_Ctrl_02__Dataset01_IRF.zip
L_t0_10C_Ctrl_04__Dataset01_IRF.zip
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L_t0_10C_Ctrl_01__Dataset01_IRF.zip
L_t5_08C_CO2_05__Dataset01_IRF.zip
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L_t5_08C_Ctrl_06__Dataset01_IRF.zip
L_t5_08C_CO2_04__Dataset01_IRF.zip
L_t0_08C_Ctrl_09__Dataset01_IRF.zip
L_t5_10C_CO2_02__Dataset01_IRF.zip
L_t5_10C_CO2_03__Dataset01_IRF.zip
L_t5_10C_CO2_04__Dataset01_IRF.zip
L_t5_10C_CO2_06__Dataset01_IRF.zip
L_t5_10C_CO2_07__Dataset01_IRF.zip
L_t5_10C_Ctrl_08__Dataset01_IRF.zip
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P_ExBlank2__Dataset01_IRF.zip
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L_t0_10C_Ctrl_09__Dataset01_IRF.zip
P_t0_08C_Ctrl_07__Dataset01_IRF.zip
P_t0_08C_Ctrl_10__Dataset01_IRF.zip
L_t5_10C_Ctrl_02__Dataset01_IRF.zip
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P_t0_10C_Ctrl_07__Dataset01_IRF.zip
L_t0_10C_Ctrl_02__Dataset01_IRF.zip
L_t5_08C_CO2_06__Dataset01_IRF.zip
P_t0_10C_Ctrl_08__Dataset01_IRF.zip
L_t5_10C_CO2_05__Dataset01_IRF.zip
P_t5_08C_CO2_01__Dataset01_IRF.zip
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P_t0_10C_Ctrl_09__Dataset01_IRF.zip
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L_t0_10C_Ctrl_06__Dataset01_IRF.zip
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P_t0_08C_Ctrl_06__Dataset01_IRF.zip
P_t0_10C_Ctrl_02__Dataset01_IRF.zip
L_t0_08C_Ctrl_01__Dataset01_IRF.zip
P_t0_10C_Ctrl_06__Dataset01_IRF.zip
P_t0_10C_Ctrl_01__Dataset01_IRF.zip
L_t5_10C_Ctrl_04__Dataset01_IRF.zip
L_t5_10C_Ctrl_06__Dataset01_IRF.zip
audit
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L_t5_08C_CO2_03__Dataset01_IRF.zip
P_QC05__Dataset01_IRF.zip
P_t0_08C_Ctrl_01__Dataset01_IRF.zip
L_t5_10C_CO2_01__Dataset01_IRF.zip
P_t0_10C_Ctrl_05__Dataset01_IRF.zip
P_t0_10C_Ctrl_03__Dataset01_IRF.zip
P_t0_08C_Ctrl_05__Dataset01_IRF.zip
P_t5_08C_CO2_02__Dataset01_IRF.zip
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P_t5_08C_CO2_05__Dataset01_IRF.zip
P_t5_08C_Ctrl_03__Dataset01_IRF.zip
P_t5_08C_CO2_04__Dataset01_IRF.zip
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P_t5_08C_Ctrl_04__Dataset01_IRF.zip
P_t5_08C_Ctrl_06__Dataset01_IRF.zip
P_t5_10C_CO2_02__Dataset01_IRF.zip
P_t5_10C_CO2_04__Dataset01_IRF.zip
P_t5_10C_CO2_08__Dataset01_IRF.zip
P_t5_08C_Ctrl_05__Dataset01_IRF.zip
P_t5_08C_Ctrl_01__Dataset01_IRF.zip
P_t5_08C_CO2_08__Dataset01_IRF.zip
P_t5_08C_CO2_09__Dataset01_IRF.zip
P_t5_10C_Ctrl_04__Dataset01_IRF.zip
P_t5_08C_Ctrl_09__Dataset01_IRF.zip
P_t5_10C_CO2_06__Dataset01_IRF.zip
P_t5_10C_Ctrl_07__Dataset01_IRF.zip
P_t5_10C_Ctrl_08__Dataset01_IRF.zip
P_t5_10C_Ctrl_10__Dataset01_IRF.zip
P_t5_10C_CO2_07__Dataset01_IRF.zip
P_t5_08C_CO2_10__Dataset01_IRF.zip
P_t5_08C_CO2_06__Dataset01_IRF.zip
a_mtbls000_metabolite_profiling_mass_spectrometry.txt
metexplore_mapping.json
P_t5_10C_CO2_09__Dataset01_IRF.zip
P_t5_10C_Ctrl_02__Dataset01_IRF.zip
P_t5_10C_Ctrl_01__Dataset01_IRF.zip
P_t5_08C_Ctrl_08__Dataset01_IRF.zip
P_t5_10C_Ctrl_03__Dataset01_IRF.zip
P_t5_08C_CO2_07__Dataset01_IRF.zip
P_t5_10C_Ctrl_05__Dataset01_IRF.zip
a_mtbls91_metabolite_profiling_mass_spectrometry-1.txt
s_MTBLS91.txt
i_Investigation.txt
a_mtbls000_metabolite profiling_mass spectrometry.txt
a_mtbls91_POLAR_mass_spectrometry.txt
a_mtbls91_metabolite_profiling_mass_spectrometry.txt
m_mtbls91_POLAR_mass_spectrometry_v2_maf.tsv
m_mtbls91_NON-POLAR_mass_spectrometry_v2_maf.tsv
P_t5_10C_Ctrl_06__Dataset01_IRF.zip
P_t5_10C_CO2_01__Dataset01_IRF.zip
P_t5_10C_CO2_03__Dataset01_IRF.zip
P_t5_10C_CO2_05__Dataset01_IRF.zip
P_t5_10C_Ctrl_09__Dataset01_IRF.zip

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Validations marked with (*) have been allowed 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 Extraction protocol description MANDATORY PROTOCOLS OK
PASSES Data transformation protocol description MANDATORY PROTOCOLS OK
PASSES Metabolite Identification protocol description MANDATORY PROTOCOLS OK
PASSES Mass spectrometry protocol description MANDATORY PROTOCOLS OK
PASSES Chromatography protocol description MANDATORY PROTOCOLS OK
PASSES Sample Collection protocol description 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

Pathways - Assay  1



MetExplore Pathways Mapping

Name DB Identifier Mapped Metabolite(s)

Pathways - Assay  2



MetExplore Pathways Mapping

Name DB Identifier Mapped Metabolite(s)