Summary of Study ST002790

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 PR001021. The data can be accessed directly via it's Project DOI: 10.21228/M8QM5H 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 ID	ST002790
Study Title	Community metabolomes reflect taxon-specific fingerprints of phytoplankton and heterotrophic bacteria in the ocean (expanded)
Study Type	Metabolomic survey of 46 phytoplankton and heterotrophic bacteria species
Study Summary	This study is an updated version of the prior study in this project, ST001514. With this update we introduce additional marine species, in particular the heterotrophic bacteria, and include our expanded library of authentic standards (available at https://github.com/IngallsLabUW/Ingalls_Standards/blob/430992e10c0464a817c69d22e3905d73f2ea196f/Ingalls_Lab_Standards.csv) for improved targeted coverage.
Institute	University of Washington
Last Name	Kumler
First Name	William
Address	1501 NE Boat St, Seattle, WA, 98105, USA
Email	wkumler@uw.edu
Phone	9095551234
Submit Date	2023-07-20
Raw Data Available	Yes
Raw Data File Type(s)	mzML
Analysis Type Detail	LC-MS
Release Date	2023-08-07
Release Version	1

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Factors:

Subject type: Other organism; Subject species: Marine plankton (Factor headings shown in green)

mb_sample_id	local_sample_id	Sample_type
SA299298	211218_Blk_MediaBlk_21_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299299	211218_Blk_MediaBlk_3430_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299300	211218_Blk_MediaBlk_49_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299301	211218_Blk_MediaBlk_71_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299302	220111_Blk_MediaBlk_A_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299303	220111_Blk_MediaBlk_AMS_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299304	211215_Blk_MediaBlk_Z_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299305	220111_Blk_MediaBlk_B_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299306	220111_Blk_MediaBlk_AOA_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299307	211218_Blk_MediaBlk_N_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299308	211218_Blk_MediaBlk_O_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299309	211221_Blk_MediaBlk_C_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299310	211221_Blk_MediaBlk_1314P_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299311	211221_Blk_MediaBlk_A_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299312	211221_Blk_MediaBlk_Nat_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299313	220104_Blk_MediaBlk_C_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299314	220104_Blk_MediaBlk_RAC5_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299315	220104_Blk_MediaBlk_LInoSi_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299316	220104_Blk_MediaBlk_H_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299317	211215_Blk_MediaBlk_Pc55x_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299318	211221_Blk_MediaBlk_As9601_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299319	211215_Blk_MediaBlk_B_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299320	211215_Blk_MediaBlk_A_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299321	211215_Blk_MediaBlk_Fc_pos.mzML	Blank \| Species_strain:NA \| Broad_taxon:NA \| MS_run:NA
SA299322	220111_Poo_TruePooBacteria_Full1.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Bacteria
SA299323	220111_Poo_TruePooBacteria_Full2.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Bacteria
SA299324	220111_Poo_TruePooBacteria_Half3.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Bacteria
SA299325	220111_Poo_TruePooBacteria_Half1.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Bacteria
SA299326	220111_Poo_TruePooBacteria_Half2.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Bacteria
SA299327	220111_Poo_TruePooBacteria_Full3.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Bacteria
SA299328	211102_Poo_TruePooCyanos_Full1.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Cyanos
SA299329	211102_Poo_TruePooCyanos_Full2.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Cyanos
SA299330	211102_Poo_TruePooCyanos_Half3.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Cyanos
SA299331	211102_Poo_TruePooCyanos_Half2.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Cyanos
SA299332	211102_Poo_TruePooCyanos_Half1.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Cyanos
SA299333	211102_Poo_TruePooCyanos_Full3.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Cyanos
SA299334	211102_Poo_TruePooDiatoms_Half3.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Diatom
SA299335	211102_Poo_TruePooDiatoms_Half1.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Diatom
SA299336	211102_Poo_TruePooDiatoms_Half2.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Diatom
SA299337	211102_Poo_TruePooDiatoms_Full2.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Diatom
SA299338	211102_Poo_TruePooDiatoms_Full1.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Diatom
SA299339	211102_Poo_TruePooDiatoms_Full3.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Diatom
SA299340	211102_Poo_TruePooDinosGreens_Full2.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:DinosGreens
SA299341	211102_Poo_TruePooDinosGreens_Full1.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:DinosGreens
SA299342	211102_Poo_TruePooDinosGreens_Half1.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:DinosGreens
SA299343	211102_Poo_TruePooDinosGreens_Full3.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:DinosGreens
SA299344	211102_Poo_TruePooDinosGreens_Half3.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:DinosGreens
SA299345	211102_Poo_TruePooDinosGreens_Half2.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:DinosGreens
SA299346	220104_Poo_TruePooHaptophytes_Half1.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Haptophytes
SA299347	220104_Poo_TruePooHaptophytes_Half2.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Haptophytes
SA299348	220104_Poo_TruePooHaptophytes_Full3.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Haptophytes
SA299349	220104_Poo_TruePooHaptophytes_Full2.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Haptophytes
SA299350	220104_Poo_TruePooHaptophytes_Half3.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Haptophytes
SA299351	220104_Poo_TruePooHaptophytes_Full1.mzML	QC Pooled \| Species_strain:NA \| Broad_taxon:NA \| MS_run:Haptophytes
SA299352	211218_Smp_1771_A_pos.mzML	Sample \| Species_strain:Alexandrium tamarense CCMP1771 \| Broad_taxon:Dinoflagellates \| MS_run:DinosGreens
SA299353	211218_Smp_1771_C_pos.mzML	Sample \| Species_strain:Alexandrium tamarense CCMP1771 \| Broad_taxon:Dinoflagellates \| MS_run:DinosGreens
SA299354	211218_Smp_1771_B_pos.mzML	Sample \| Species_strain:Alexandrium tamarense CCMP1771 \| Broad_taxon:Dinoflagellates \| MS_run:DinosGreens
SA299355	211221_Smp_1314P_B_pos.mzML	Sample \| Species_strain:Amphidinium carterae CCMP1314 \| Broad_taxon:Dinoflagellates \| MS_run:DinosGreens
SA299356	211221_Smp_1314P_C_pos.mzML	Sample \| Species_strain:Amphidinium carterae CCMP1314 \| Broad_taxon:Dinoflagellates \| MS_run:DinosGreens
SA299357	211221_Smp_1314P_A_pos.mzML	Sample \| Species_strain:Amphidinium carterae CCMP1314 \| Broad_taxon:Dinoflagellates \| MS_run:DinosGreens
SA299358	211218_Smp_1314_C_pos.mzML	Sample \| Species_strain:Amphidinium carterae CCMP1314 \| Broad_taxon:Dinoflagellates \| MS_run:DinosGreens
SA299359	211218_Smp_1314_A_pos.mzML	Sample \| Species_strain:Amphidinium carterae CCMP1314 \| Broad_taxon:Dinoflagellates \| MS_run:DinosGreens
SA299360	211218_Smp_1314_B_pos.mzML	Sample \| Species_strain:Amphidinium carterae CCMP1314 \| Broad_taxon:Dinoflagellates \| MS_run:DinosGreens
SA299361	220104_Smp_Ca_A_pos.mzML	Sample \| Species_strain:Chrysochromulina acantha \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299362	220104_Smp_Ca_C_pos.mzML	Sample \| Species_strain:Chrysochromulina acantha \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299363	220104_Smp_Ca_B_pos.mzML	Sample \| Species_strain:Chrysochromulina acantha \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299370	220104_Smp_P3_A_pos.mzML	Sample \| Species_strain:Chrysochromulina \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299371	220104_Smp_116-1_B_pos.mzML	Sample \| Species_strain:Chrysochromulina \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299372	220104_Smp_116-1_A_pos.mzML	Sample \| Species_strain:Chrysochromulina \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299373	220104_Smp_P5-5_C_pos.mzML	Sample \| Species_strain:Chrysochromulina \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299374	220104_Smp_P3_B_pos.mzML	Sample \| Species_strain:Chrysochromulina \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299375	220104_Smp_116-1_C_pos.mzML	Sample \| Species_strain:Chrysochromulina \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299376	220104_Smp_P3_C_pos.mzML	Sample \| Species_strain:Chrysochromulina \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299377	220104_Smp_P5-5_A_pos.mzML	Sample \| Species_strain:Chrysochromulina \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299378	220104_Smp_P5-5_B_pos.mzML	Sample \| Species_strain:Chrysochromulina \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299364	220104_Smp_Cr_A_pos.mzML	Sample \| Species_strain:Chrysochromulina rotalis \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299365	220104_Smp_Cr_C_pos.mzML	Sample \| Species_strain:Chrysochromulina rotalis \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299366	220104_Smp_Cr_B_pos.mzML	Sample \| Species_strain:Chrysochromulina rotalis \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299367	220104_Smp_Cs_C_pos.mzML	Sample \| Species_strain:Chrysochromulina simplex \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299368	220104_Smp_Cs_A_pos.mzML	Sample \| Species_strain:Chrysochromulina simplex \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299369	220104_Smp_Cs_B_pos.mzML	Sample \| Species_strain:Chrysochromulina simplex \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299379	220111_Smp_SA60_A_pos.mzML	Sample \| Species_strain:Croceibacter (CFB) SA60 \| Broad_taxon:Heterotrophic Bacteria \| MS_run:Bacteria
SA299380	220111_Smp_SA60_B_pos.mzML	Sample \| Species_strain:Croceibacter (CFB) SA60 \| Broad_taxon:Heterotrophic Bacteria \| MS_run:Bacteria
SA299381	220111_Smp_SA60_C_pos.mzML	Sample \| Species_strain:Croceibacter (CFB) SA60 \| Broad_taxon:Heterotrophic Bacteria \| MS_run:Bacteria
SA299382	211221_Smp_8501_D_pos.mzML	Sample \| Species_strain:Crocosphaera watsonii WH8501 \| Broad_taxon:Cyanos \| MS_run:Cyanos
SA299383	211221_Smp_8501_C_pos.mzML	Sample \| Species_strain:Crocosphaera watsonii WH8501 \| Broad_taxon:Cyanos \| MS_run:Cyanos
SA299384	211221_Smp_8501_B_pos.mzML	Sample \| Species_strain:Crocosphaera watsonii WH8501 \| Broad_taxon:Cyanos \| MS_run:Cyanos
SA299385	211215_Smp_Cy_B_pos.mzML	Sample \| Species_strain:Cyclotella meneghiniana CCMP 338 \| Broad_taxon:Diatoms \| MS_run:Diatom
SA299386	211215_Smp_Cy_C_pos.mzML	Sample \| Species_strain:Cyclotella meneghiniana CCMP 338 \| Broad_taxon:Diatoms \| MS_run:Diatom
SA299387	211215_Smp_Cy_A_pos.mzML	Sample \| Species_strain:Cyclotella meneghiniana CCMP 338 \| Broad_taxon:Diatoms \| MS_run:Diatom
SA299388	220104_Smp_2090_B_pos.mzML	Sample \| Species_strain:Emiliana huxleyi CCMP2090 (baller) \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299389	220104_Smp_2090_A_pos.mzML	Sample \| Species_strain:Emiliana huxleyi CCMP2090 (baller) \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299390	220104_Smp_2090_C_pos.mzML	Sample \| Species_strain:Emiliana huxleyi CCMP2090 (baller) \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299391	220104_Smp_371_C_pos.mzML	Sample \| Species_strain:Emiliana huxleyi CCMP371 (c) \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299392	220104_Smp_371_A_pos.mzML	Sample \| Species_strain:Emiliana huxleyi CCMP371 (c) \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299393	220104_Smp_371_B_pos.mzML	Sample \| Species_strain:Emiliana huxleyi CCMP371 (c) \| Broad_taxon:Haptophytes \| MS_run:Haptos
SA299394	211215_Smp_Fc_B_pos.mzML	Sample \| Species_strain:Fragilariopsis cylindrus CCMP3383 \| Broad_taxon:Diatoms \| MS_run:Diatom
SA299395	211215_Smp_Fc_A_pos.mzML	Sample \| Species_strain:Fragilariopsis cylindrus CCMP3383 \| Broad_taxon:Diatoms \| MS_run:Diatom
SA299396	211215_Smp_Fc_C_pos.mzML	Sample \| Species_strain:Fragilariopsis cylindrus CCMP3383 \| Broad_taxon:Diatoms \| MS_run:Diatom
SA299397	211218_Smp_449_C_pos.mzML	Sample \| Species_strain:Heterocapsa triquetra CCMP449 \| Broad_taxon:Dinoflagellates \| MS_run:DinosGreens