Summary of Study ST002321

This data is available at the NIH Common Fund's National Metabolomics Data Repository (NMDR) website, the Metabolomics Workbench,, where it has been assigned Project ID PR001487. The data can be accessed directly via it's Project DOI: 10.21228/M8HM7D This work is supported by NIH grant, U2C- DK119886.


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 IDST002321
Study Title13C NMR metabolomics: integrating J-resolved STOCSY and INADEQUATE
Study SummaryRobust annotation of metabolites remains a challenging task in metabolomics. This study introduces an approach that uses 13C homonuclear J-resolved experiment (JRES), statistical total correlation spectroscopy (STOCSY), and 2D incredible natural abundance double-quantum experiment (INADEQUATE) complementarily, to obtain robust molecular structure information based on 13C NMR with less experiment time. This approach was tested using the endometabolome from a model marine phytoplankton strain, varying the settings of incubation temperature, nutrient condition, and the presence of co-culturing bacteria.
University of Georgia
Last NameUchimiya
First NameMario
Address315 Riverbend Rd, Athens, GA, 30602, USA
Phone‭(706) 542-8387‬
Submit Date2022-10-17
Raw Data AvailableYes
Raw Data File Type(s)ser
Analysis Type DetailNMR
Release Date2022-11-25
Release Version1
Mario Uchimiya Mario Uchimiya application/zip

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NMR ID:NM000254
Analysis ID:AN003788
Instrument Name:Bruker NEO
Instrument Type:CW-NMR
NMR Experiment Type:Other
Spectrometer Frequency:600 MHz