Summary of Study ST002281

This data is available at the NIH Common Fund's National Metabolomics Data Repository (NMDR) website, the Metabolomics Workbench, https://www.metabolomicsworkbench.org, where it has been assigned Project ID PR001461. The data can be accessed directly via it's Project DOI: 10.21228/M8W122 This work is supported by NIH grant, U2C- DK119886.

See: https://www.metabolomicsworkbench.org/about/howtocite.php

This study contains a large results data set and is not available in the mwTab file. It is only available for download via FTP as data file(s) here.

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Study IDST002281
Study TitleMetabolite patterns between isogenic normal hiPSCs and Trisomy hiPSC
Study SummaryWe wanted to compare metabolites patterns between isogenic normal hiPSCs and Trisomy hiPSCs. All hiPSCs cell lines were generated from same mosaic Down symdrome patient.
Institute
Guangdong Provincial People's Hospital
DepartmentMedical Research Center
LaboratoryLiu lab
Last NameLiu
First NameJuli
AddressZhongshan 2nd road
Emailliujuli@gdph.org.cn
Phone+8602083827812
Submit Date2022-09-09
Raw Data AvailableYes
Raw Data File Type(s)raw(Thermo)
Analysis Type DetailAPCI-MS
Release Date2024-09-13
Release Version1
Juli Liu Juli Liu
https://dx.doi.org/10.21228/M8W122
ftp://www.metabolomicsworkbench.org/Studies/ application/zip

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Project:

Project ID:PR001461
Project DOI:doi: 10.21228/M8W122
Project Title:Metabolite patterns between isogenic normal hiPSCs and Trisomy hiPSCs
Project Summary:We wanted to compare metabolites patterns between isogenic normal hiPSCs and Trisomy hiPSCs. All hiPSCs cell lines were generated from same mosaic Down symdrome patient.
Institute:Guangdong provincial people's hospital
Department:Medical Research Center
Laboratory:Liu Lab
Last Name:Liu
First Name:Juli
Address:Zhongshan 2nd road
Email:liujuli@gdph.org.cn
Phone:+8602083827812

Subject:

Subject ID:SU002367
Subject Type:Cultured cells
Subject Species:Homo sapiens
Taxonomy ID:9606
Cell Strain Details:Human pluripotent stem cells

Factors:

Subject type: Cultured cells; Subject species: Homo sapiens (Factor headings shown in green)

mb_sample_id local_sample_id Genotype Treatment
SA218473HFX3_1074585_CN_blankblank negative mode-blank
SA218474HFX3_1074585_CP_blankblank positive mode-blank
SA218475HFX3_CN1_FZTM220002975-1A_N1 groupisogenic normal hiPSCs (N1) negative mode-normal
SA218476HFX3_CP1_FZTM220002975-1A_N1 groupisogenic normal hiPSCs (N1) positive mode-normal
SA218477HFX3_CN2_FZTM220002976-1A_N2 groupisogenic normal hiPSCs (N2) negative mode-normal
SA218478HFX3_CP2_FZTM220002976-1A_N2 groupisogenic normal hiPSCs (N2) positive mode-normal
SA218479HFX3_CN3_FZTM220002977-1A_N3 groupisogenic normal hiPSCs (N3) negative mode-normal
SA218480HFX3_CP3_FZTM220002977-1A_N3 groupisogenic normal hiPSCs (N3) positive mode-normal
SA218481HFX3_1074585_CN_QC1quality control 1 (QC1) negative mode-quality control 1 (QC1)
SA218482HFX3_1074585_CP_QC1quality control 1 (QC1) positive mode-quality control 1 (QC1)
SA218483HFX3_1074585_CN_QC2quality control 2 (QC2) negative mode-quality control 2 (QC2)
SA218484HFX3_1074585_CP_QC2quality control 2 (QC2) positive mode-quality control 2 (QC2)
SA218485HFX3_1074585_CN_QC3quality control 3 (QC3) negative mode-quality control 3 (QC3)
SA218486HFX3_1074585_CP_QC3quality control 3 (QC3) positive mode-quality control 3 (QC3)
SA218467HFX3_CN4_FZTM220002978-1A_P1 groupTrisomy 21 hiPSCs (P1) negative mode-Trisomy 21
SA218468HFX3_CP4_FZTM220002978-1A_P1 groupTrisomy 21 hiPSCs (P1) positive mode-Trisomy 21
SA218469HFX3_CN5_FZTM220002979-1A_P2 groupTrisomy 21 hiPSCs (P2) negative mode-Trisomy 21
SA218470HFX3_CP5_FZTM220002979-1A_P2 groupTrisomy 21 hiPSCs (P2) positive mode-Trisomy 21
SA218471HFX3_CN6_FZTM220002980-1A_P3 groupTrisomy 21 hiPSCs (P3) negative mode-Trisomy 21
SA218472HFX3_CP6_FZTM220002980-1A_P3 groupTrisomy 21 hiPSCs (P3) positive mode-Trisomy 21
Showing results 1 to 20 of 20

Collection:

Collection ID:CO002360
Collection Summary:Metabolites patterns between isogenic hiPSCs and Trisomy 21 hiPSCs.
Sample Type:iPSC cells
Storage Conditions:Room temperature

Treatment:

Treatment ID:TR002379
Treatment Summary:All hiPSCs were cultured in mTesR1 medium in 6-well plate pre-coated with Matrigel in 37 degree.

Sample Preparation:

Sampleprep ID:SP002373
Sampleprep Summary:The samples were placed in the EP tubes and resuspended with prechilled 80% methanol by well vortex. Then the samples were melted on ice and whirled for 30 s. After the sonification for 6 min, they were centrifuged at 5,000 rpm, 4°C for 1 min. The supernatant was freeze-dried and dissolvedwith 10% methanol. Finally, the solution was injected into the LC-MS/MS system analysis.

Combined analysis:

Analysis ID AN003725 AN003726
Analysis type MS MS
Chromatography type Reversed phase Reversed phase
Chromatography system Thermo Vanquish Thermo Vanquish
Column Hypesil Gold Hypesil Gold
MS Type APCI APCI
MS instrument type Orbitrap Orbitrap
MS instrument name Thermo Q Exactive HF-X Orbitrap Thermo Q Exactive HF-X Orbitrap
Ion Mode POSITIVE NEGATIVE
Units pmoles/l pmoles/l

Chromatography:

Chromatography ID:CH002759
Chromatography Summary:UHPLC-MS/MS analyses were performed using a Vanquish UHPLC system (ThermoFisher, Germany) coupled with an Orbitrap Q ExactiveTMHF-X mass spectrometer (Thermo Fisher,Germany) in Novogene Co., Ltd. (Beijing, China). Samples were injected onto a Hypesil Gold column (100×2.1 mm, 1.9µm) using a 17-min linear gradient at a flow rate of 0.2mL/min. The eluents for the positive polarity mode were eluent A (0.1% FA in Water) and eluent B (Methanol).The eluents for the negative polarity mode were eluent A (5 mMammonium acetate, pH 9.0) and eluent B (Methanol).The solvent gradient was set as follows: 2% B, 1.5 min; 2-100% B, 3 min; 100% B, 10 min;100-2% B, 10.1 min;2% B, 12 min. Q ExactiveTM HF-X mass spectrometer was operated in positive/negative polarity mode with spray voltage of 3.5 kV, capillary temperature of 320°C, sheath gas flow rate of 35 psi and aux gas flow rate of 10 L/min, S-lens RF level of 60, Aux gas heater temperature of 350°C.
Instrument Name:Thermo Vanquish
Column Name:Hypesil Gold
Flow Gradient:2% B, 1.5 min; 2-100% B, 3 min; 100% B, 10 min;100-2% B, 10.1 min;2% B, 12 min
Flow Rate:0.2mL/min
Solvent A:100% water; 5 mM ammonium acetate, pH 9.0
Solvent B:100% methanol
Chromatography Type:Reversed phase

MS:

MS ID:MS003473
Analysis ID:AN003725
Instrument Name:Thermo Q Exactive HF-X Orbitrap
Instrument Type:Orbitrap
MS Type:APCI
MS Comments:The raw data files generated by UHPLC-MS/MS were processed using the Compound Discoverer 3.1 (CD3.1, ThermoFisher) to perform peak alignment, peak picking, and quantitation for each metabolite. The main parameters were set as follows: retention time tolerance, 0.2 minutes; actual mass tolerance, 5ppm; signal intensity tolerance, 30%; signal/noise ratio, 3; and minimum intensity, et al. After that, peak intensities were normalized to the total spectral intensity.The normalized data was used to predict the molecular formula based on additive ions, molecular ion peaks and fragment ions. And then peaks were matched with the mzCloud (https://www.mzcloud.org/),mzVault and MassList database to obtain the accurate. qualitative and relative quantitative results.
Ion Mode:POSITIVE
  
MS ID:MS003474
Analysis ID:AN003726
Instrument Name:Thermo Q Exactive HF-X Orbitrap
Instrument Type:Orbitrap
MS Type:APCI
MS Comments:The raw data files generated by UHPLC-MS/MS were processed using the Compound Discoverer 3.1 (CD3.1, ThermoFisher) to perform peak alignment, peak picking, and quantitation for each metabolite. The main parameters were set as follows: retention time tolerance, 0.2 minutes; actual mass tolerance, 5ppm; signal intensity tolerance, 30%; signal/noise ratio, 3; and minimum intensity, et al. After that, peak intensities were normalized to the total spectral intensity.The normalized data was used to predict the molecular formula based on additive ions, molecular ion peaks and fragment ions. And then peaks were matched with the mzCloud (https://www.mzcloud.org/),mzVault and MassList database to obtain the accurate. qualitative and relative quantitative results.
Ion Mode:NEGATIVE
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