#METABOLOMICS WORKBENCH wkumler_20230720_172312 DATATRACK_ID:4177 STUDY_ID:ST002790 ANALYSIS_ID:AN004540 PROJECT_ID:PR001021 VERSION 1 CREATED_ON July 21, 2023, 9:50 am #PROJECT PR:PROJECT_TITLE Community metabolomes reflect taxon-specific fingerprints of phytoplankton in PR:PROJECT_TITLE the ocean PR:PROJECT_TYPE Marine Metabolomics PR:PROJECT_SUMMARY Phytoplankton transform inorganic carbon into thousands of biomolecules, PR:PROJECT_SUMMARY including polar metabolites that represent an important pool of labile fixed PR:PROJECT_SUMMARY carbon, nitrogen, and sulfur. Metabolite production is not identical among PR:PROJECT_SUMMARY phytoplankton, and the flux of these molecules through the microbial loop PR:PROJECT_SUMMARY depends on compound-specific bioavailability to a wider microbial community. Yet PR:PROJECT_SUMMARY relatively little is known about the diversity or concentration of polar PR:PROJECT_SUMMARY metabolites within marine plankton. Here we evaluate 313 metabolites in 21 PR:PROJECT_SUMMARY phytoplankton species and in natural marine particles across environmental PR:PROJECT_SUMMARY gradients to show that bulk community metabolomes reflect the phytoplankton PR:PROJECT_SUMMARY community on a chemical level. PR:INSTITUTE University of Washington PR:DEPARTMENT Oceanography PR:LABORATORY Ingalls Lab PR:LAST_NAME Kumler PR:FIRST_NAME William PR:ADDRESS 1501 NE Boat St, Seattle, WA, 98105, USA PR:EMAIL wkumler@uw.edu PR:PHONE 2062216732 #STUDY ST:STUDY_TITLE Community metabolomes reflect taxon-specific fingerprints of phytoplankton and ST:STUDY_TITLE heterotrophic bacteria in the ocean (expanded) ST:STUDY_TYPE Metabolomic survey of 46 phytoplankton and heterotrophic bacteria species ST:STUDY_SUMMARY This study is an updated version of the prior study in this project, ST001514. ST:STUDY_SUMMARY With this update we introduce additional marine species, in particular the ST:STUDY_SUMMARY heterotrophic bacteria, and include our expanded library of authentic standards ST:STUDY_SUMMARY (available at ST:STUDY_SUMMARY https://github.com/IngallsLabUW/Ingalls_Standards/blob/430992e10c0464a817c69d22e3905d73f2ea196f/Ingalls_Lab_Standards.csv) ST:STUDY_SUMMARY for improved targeted coverage. ST:INSTITUTE University of Washington ST:LAST_NAME Kumler ST:FIRST_NAME William ST:ADDRESS 1501 NE Boat St, Seattle, WA, 98105, USA ST:EMAIL wkumler@uw.edu ST:PHONE 9095551234 #SUBJECT SU:SUBJECT_TYPE Other organism SU:SUBJECT_SPECIES Marine plankton #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooCyanos_Full1.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Cyanos RAW_FILE_NAME=211102_Poo_TruePooCyanos_Full1.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooCyanos_Full2.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Cyanos RAW_FILE_NAME=211102_Poo_TruePooCyanos_Full2.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooCyanos_Full3.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Cyanos RAW_FILE_NAME=211102_Poo_TruePooCyanos_Full3.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooCyanos_Half1.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Cyanos RAW_FILE_NAME=211102_Poo_TruePooCyanos_Half1.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooCyanos_Half2.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Cyanos RAW_FILE_NAME=211102_Poo_TruePooCyanos_Half2.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooCyanos_Half3.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Cyanos RAW_FILE_NAME=211102_Poo_TruePooCyanos_Half3.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDiatoms_Full1.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Diatom RAW_FILE_NAME=211102_Poo_TruePooDiatoms_Full1.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDiatoms_Full2.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Diatom RAW_FILE_NAME=211102_Poo_TruePooDiatoms_Full2.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDiatoms_Full3.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Diatom RAW_FILE_NAME=211102_Poo_TruePooDiatoms_Full3.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDiatoms_Half1.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Diatom RAW_FILE_NAME=211102_Poo_TruePooDiatoms_Half1.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDiatoms_Half2.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Diatom RAW_FILE_NAME=211102_Poo_TruePooDiatoms_Half2.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDiatoms_Half3.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Diatom RAW_FILE_NAME=211102_Poo_TruePooDiatoms_Half3.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDinosGreens_Full1.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:DinosGreens RAW_FILE_NAME=211102_Poo_TruePooDinosGreens_Full1.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDinosGreens_Full2.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:DinosGreens RAW_FILE_NAME=211102_Poo_TruePooDinosGreens_Full2.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDinosGreens_Full3.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:DinosGreens RAW_FILE_NAME=211102_Poo_TruePooDinosGreens_Full3.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDinosGreens_Half1.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:DinosGreens RAW_FILE_NAME=211102_Poo_TruePooDinosGreens_Half1.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDinosGreens_Half2.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:DinosGreens RAW_FILE_NAME=211102_Poo_TruePooDinosGreens_Half2.mzML SUBJECT_SAMPLE_FACTORS - 211102_Poo_TruePooDinosGreens_Half3.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:DinosGreens RAW_FILE_NAME=211102_Poo_TruePooDinosGreens_Half3.mzML SUBJECT_SAMPLE_FACTORS - 211215_Blk_MediaBlk_A_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Blk_MediaBlk_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Blk_MediaBlk_B_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Blk_MediaBlk_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Blk_MediaBlk_Fc_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Blk_MediaBlk_Fc_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Blk_MediaBlk_Pc55x_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Blk_MediaBlk_Pc55x_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Blk_MediaBlk_Z_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Blk_MediaBlk_Z_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Cy_A_pos.mzML Sample_type:Sample | Species_strain:Cyclotella meneghiniana CCMP 338 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Cy_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Cy_B_pos.mzML Sample_type:Sample | Species_strain:Cyclotella meneghiniana CCMP 338 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Cy_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Cy_C_pos.mzML Sample_type:Sample | Species_strain:Cyclotella meneghiniana CCMP 338 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Cy_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Fc_A_pos.mzML Sample_type:Sample | Species_strain:Fragilariopsis cylindrus CCMP3383 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Fc_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Fc_B_pos.mzML Sample_type:Sample | Species_strain:Fragilariopsis cylindrus CCMP3383 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Fc_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Fc_C_pos.mzML Sample_type:Sample | Species_strain:Fragilariopsis cylindrus CCMP3383 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Fc_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Np_A_pos.mzML Sample_type:Sample | Species_strain:Navicula pelliculosa CCMP543 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Np_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Np_C_pos.mzML Sample_type:Sample | Species_strain:Navicula pelliculosa CCMP543 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Np_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Np_F_pos.mzML Sample_type:Sample | Species_strain:Navicula pelliculosa CCMP543 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Np_F_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Pc55x_A_pos.mzML Sample_type:Sample | Species_strain:Pseudo-nitzschia pungens Pc55x | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Pc55x_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Pc55x_B_pos.mzML Sample_type:Sample | Species_strain:Pseudo-nitzschia pungens Pc55x | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Pc55x_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Pc55x_C_pos.mzML Sample_type:Sample | Species_strain:Pseudo-nitzschia pungens Pc55x | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Pc55x_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Pt_C_pos.mzML Sample_type:Sample | Species_strain:Phaeodactylum tricornutum CCMP2561 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Pt_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Pt_F_pos.mzML Sample_type:Sample | Species_strain:Phaeodactylum tricornutum CCMP2561 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Pt_F_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_To_A_pos.mzML Sample_type:Sample | Species_strain:Thalassiosira oceanica CCMP 1005 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_To_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_To_B_pos.mzML Sample_type:Sample | Species_strain:Thalassiosira oceanica CCMP 1005 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_To_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_To_C_pos.mzML Sample_type:Sample | Species_strain:Thalassiosira oceanica CCMP 1005 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_To_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Tp_A_pos.mzML Sample_type:Sample | Species_strain:Thalassiosira pseudonana CCMP1335 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Tp_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Tp_E_pos.mzML Sample_type:Sample | Species_strain:Thalassiosira pseudonana CCMP1335 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Tp_E_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Smp_Tp_F_pos.mzML Sample_type:Sample | Species_strain:Thalassiosira pseudonana CCMP1335 | Broad_taxon:Diatoms | MS_run:Diatom RAW_FILE_NAME=211215_Smp_Tp_F_pos.mzML SUBJECT_SAMPLE_FACTORS - 211215_Std_4uMStdsMix1InH2O_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Std_4uMStdsMix1InH2O_1.mzML SUBJECT_SAMPLE_FACTORS - 211215_Std_4uMStdsMix1InH2O_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Std_4uMStdsMix1InH2O_2.mzML SUBJECT_SAMPLE_FACTORS - 211215_Std_4uMStdsMix1InMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Std_4uMStdsMix1InMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 211215_Std_4uMStdsMix1InMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Std_4uMStdsMix1InMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 211215_Std_4uMStdsMix2InH2O_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Std_4uMStdsMix2InH2O_1.mzML SUBJECT_SAMPLE_FACTORS - 211215_Std_4uMStdsMix2InH2O_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Std_4uMStdsMix2InH2O_2.mzML SUBJECT_SAMPLE_FACTORS - 211215_Std_4uMStdsMix2InMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Std_4uMStdsMix2InMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 211215_Std_4uMStdsMix2InMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Std_4uMStdsMix2InMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 211215_Std_H2OinMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Std_H2OinMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 211215_Std_H2OinMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211215_Std_H2OinMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 211218_Blk_MediaBlk_21_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Blk_MediaBlk_21_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Blk_MediaBlk_3430_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Blk_MediaBlk_3430_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Blk_MediaBlk_49_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Blk_MediaBlk_49_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Blk_MediaBlk_71_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Blk_MediaBlk_71_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Blk_MediaBlk_N_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Blk_MediaBlk_N_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Blk_MediaBlk_O_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Blk_MediaBlk_O_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_1314_A_pos.mzML Sample_type:Sample | Species_strain:Amphidinium carterae CCMP1314 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_1314_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_1314_B_pos.mzML Sample_type:Sample | Species_strain:Amphidinium carterae CCMP1314 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_1314_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_1314_C_pos.mzML Sample_type:Sample | Species_strain:Amphidinium carterae CCMP1314 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_1314_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_1545_A_pos.mzML Sample_type:Sample | Species_strain:Micromonas pusilla CCMP1545 | Broad_taxon:Pico-euks (Greens) | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_1545_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_1545_B_pos.mzML Sample_type:Sample | Species_strain:Micromonas pusilla CCMP1545 | Broad_taxon:Pico-euks (Greens) | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_1545_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_1545_C_pos.mzML Sample_type:Sample | Species_strain:Micromonas pusilla CCMP1545 | Broad_taxon:Pico-euks (Greens) | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_1545_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_1771_A_pos.mzML Sample_type:Sample | Species_strain:Alexandrium tamarense CCMP1771 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_1771_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_1771_B_pos.mzML Sample_type:Sample | Species_strain:Alexandrium tamarense CCMP1771 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_1771_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_1771_C_pos.mzML Sample_type:Sample | Species_strain:Alexandrium tamarense CCMP1771 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_1771_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_2021_A_pos.mzML Sample_type:Sample | Species_strain:Lingulodinium polyedra CCMP2021 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_2021_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_2021_B_pos.mzML Sample_type:Sample | Species_strain:Lingulodinium polyedra CCMP2021 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_2021_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_2021_C_pos.mzML Sample_type:Sample | Species_strain:Lingulodinium polyedra CCMP2021 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_2021_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_3430_A_pos.mzML Sample_type:Sample | Species_strain:Ostreococcus lucimarinus CCMP3430 | Broad_taxon:Pico-euks (Greens) | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_3430_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_3430_B_pos.mzML Sample_type:Sample | Species_strain:Ostreococcus lucimarinus CCMP3430 | Broad_taxon:Pico-euks (Greens) | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_3430_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_3430_C_pos.mzML Sample_type:Sample | Species_strain:Ostreococcus lucimarinus CCMP3430 | Broad_taxon:Pico-euks (Greens) | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_3430_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_449_A_pos.mzML Sample_type:Sample | Species_strain:Heterocapsa triquetra CCMP449 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_449_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_449_B_pos.mzML Sample_type:Sample | Species_strain:Heterocapsa triquetra CCMP449 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_449_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Smp_449_C_pos.mzML Sample_type:Sample | Species_strain:Heterocapsa triquetra CCMP449 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211218_Smp_449_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211218_Std_4uMStdsMix1InH2O_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Std_4uMStdsMix1InH2O_1.mzML SUBJECT_SAMPLE_FACTORS - 211218_Std_4uMStdsMix1InMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Std_4uMStdsMix1InMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 211218_Std_4uMStdsMix1InMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Std_4uMStdsMix1InMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 211218_Std_4uMStdsMix2InH2O_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Std_4uMStdsMix2InH2O_1.mzML SUBJECT_SAMPLE_FACTORS - 211218_Std_4uMStdsMix2InMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Std_4uMStdsMix2InMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 211218_Std_4uMStdsMix2InMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Std_4uMStdsMix2InMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 211218_Std_H2OinMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Std_H2OinMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 211218_Std_H2OinMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211218_Std_H2OinMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 211221_Blk_MediaBlk_1314P_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Blk_MediaBlk_1314P_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Blk_MediaBlk_A_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Blk_MediaBlk_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Blk_MediaBlk_As9601_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Blk_MediaBlk_As9601_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Blk_MediaBlk_C_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Blk_MediaBlk_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Blk_MediaBlk_Nat_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Blk_MediaBlk_Nat_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_1314P_A_pos.mzML Sample_type:Sample | Species_strain:Amphidinium carterae CCMP1314 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211221_Smp_1314P_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_1314P_B_pos.mzML Sample_type:Sample | Species_strain:Amphidinium carterae CCMP1314 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211221_Smp_1314P_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_1314P_C_pos.mzML Sample_type:Sample | Species_strain:Amphidinium carterae CCMP1314 | Broad_taxon:Dinoflagellates | MS_run:DinosGreens RAW_FILE_NAME=211221_Smp_1314P_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_7803_B_pos.mzML Sample_type:Sample | Species_strain:Synechococcus sp. 7803 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_7803_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_7803_F_pos.mzML Sample_type:Sample | Species_strain:Synechococcus sp. 7803 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_7803_F_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_8102_A_pos.mzML Sample_type:Sample | Species_strain:Synechococcus sp. 8102 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_8102_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_8102_F_pos.mzML Sample_type:Sample | Species_strain:Synechococcus sp. 8102 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_8102_F_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_8501_B_pos.mzML Sample_type:Sample | Species_strain:Crocosphaera watsonii WH8501 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_8501_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_8501_C_pos.mzML Sample_type:Sample | Species_strain:Crocosphaera watsonii WH8501 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_8501_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_8501_D_pos.mzML Sample_type:Sample | Species_strain:Crocosphaera watsonii WH8501 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_8501_D_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_As9601_A_pos.mzML Sample_type:Sample | Species_strain:Prochlorococcus AS9601 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_As9601_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_As9601_B_pos.mzML Sample_type:Sample | Species_strain:Prochlorococcus AS9601 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_As9601_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_As9601_C_pos.mzML Sample_type:Sample | Species_strain:Prochlorococcus AS9601 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_As9601_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_MED4_D_pos.mzML Sample_type:Sample | Species_strain:Prochlorococcus marinus MED4 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_MED4_D_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_MED4_E_pos.mzML Sample_type:Sample | Species_strain:Prochlorococcus marinus MED4 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_MED4_E_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_MED4_F_pos.mzML Sample_type:Sample | Species_strain:Prochlorococcus marinus MED4 | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_MED4_F_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_Nat_A_pos.mzML Sample_type:Sample | Species_strain:Prochlorococcus NATL2A | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_Nat_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_Nat_B_pos.mzML Sample_type:Sample | Species_strain:Prochlorococcus NATL2A | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_Nat_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Smp_Nat_C_pos.mzML Sample_type:Sample | Species_strain:Prochlorococcus NATL2A | Broad_taxon:Cyanos | MS_run:Cyanos RAW_FILE_NAME=211221_Smp_Nat_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 211221_Std_4uMStdsMix1InH2O_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Std_4uMStdsMix1InH2O_1.mzML SUBJECT_SAMPLE_FACTORS - 211221_Std_4uMStdsMix1InH2O_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Std_4uMStdsMix1InH2O_2.mzML SUBJECT_SAMPLE_FACTORS - 211221_Std_4uMStdsMix1InMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Std_4uMStdsMix1InMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 211221_Std_4uMStdsMix1InMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Std_4uMStdsMix1InMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 211221_Std_4uMStdsMix2InH2O_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Std_4uMStdsMix2InH2O_1.mzML SUBJECT_SAMPLE_FACTORS - 211221_Std_4uMStdsMix2InH2O_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Std_4uMStdsMix2InH2O_2.mzML SUBJECT_SAMPLE_FACTORS - 211221_Std_4uMStdsMix2InMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Std_4uMStdsMix2InMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 211221_Std_4uMStdsMix2InMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Std_4uMStdsMix2InMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 211221_Std_H2OinMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Std_H2OinMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 211221_Std_H2OinMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=211221_Std_H2OinMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 220104_Blk_MediaBlk_C_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Blk_MediaBlk_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Blk_MediaBlk_H_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Blk_MediaBlk_H_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Blk_MediaBlk_LInoSi_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Blk_MediaBlk_LInoSi_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Blk_MediaBlk_RAC5_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Blk_MediaBlk_RAC5_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Poo_TruePooHaptophytes_Full1.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Haptophytes RAW_FILE_NAME=220104_Poo_TruePooHaptophytes_Full1.mzML SUBJECT_SAMPLE_FACTORS - 220104_Poo_TruePooHaptophytes_Full2.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Haptophytes RAW_FILE_NAME=220104_Poo_TruePooHaptophytes_Full2.mzML SUBJECT_SAMPLE_FACTORS - 220104_Poo_TruePooHaptophytes_Full3.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Haptophytes RAW_FILE_NAME=220104_Poo_TruePooHaptophytes_Full3.mzML SUBJECT_SAMPLE_FACTORS - 220104_Poo_TruePooHaptophytes_Half1.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Haptophytes RAW_FILE_NAME=220104_Poo_TruePooHaptophytes_Half1.mzML SUBJECT_SAMPLE_FACTORS - 220104_Poo_TruePooHaptophytes_Half2.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Haptophytes RAW_FILE_NAME=220104_Poo_TruePooHaptophytes_Half2.mzML SUBJECT_SAMPLE_FACTORS - 220104_Poo_TruePooHaptophytes_Half3.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Haptophytes RAW_FILE_NAME=220104_Poo_TruePooHaptophytes_Half3.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_116-1_A_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_116-1_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_116-1_B_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_116-1_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_116-1_C_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_116-1_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_2090_A_pos.mzML Sample_type:Sample | Species_strain:Emiliana huxleyi CCMP2090 (baller) | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_2090_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_2090_B_pos.mzML Sample_type:Sample | Species_strain:Emiliana huxleyi CCMP2090 (baller) | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_2090_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_2090_C_pos.mzML Sample_type:Sample | Species_strain:Emiliana huxleyi CCMP2090 (baller) | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_2090_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_371_A_pos.mzML Sample_type:Sample | Species_strain:Emiliana huxleyi CCMP371 (c) | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_371_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_371_B_pos.mzML Sample_type:Sample | Species_strain:Emiliana huxleyi CCMP371 (c) | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_371_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_371_C_pos.mzML Sample_type:Sample | Species_strain:Emiliana huxleyi CCMP371 (c) | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_371_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_Ca_A_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina acantha | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_Ca_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_Ca_B_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina acantha | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_Ca_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_Ca_C_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina acantha | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_Ca_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_Cr_A_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina rotalis | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_Cr_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_Cr_B_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina rotalis | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_Cr_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_Cr_C_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina rotalis | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_Cr_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_Cs_A_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina simplex | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_Cs_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_Cs_B_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina simplex | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_Cs_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_Cs_C_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina simplex | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_Cs_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_P3_A_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_P3_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_P3_B_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_P3_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_P3_C_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_P3_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_P5-5_A_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_P5-5_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_P5-5_B_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_P5-5_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Smp_P5-5_C_pos.mzML Sample_type:Sample | Species_strain:Chrysochromulina | Broad_taxon:Haptophytes | MS_run:Haptos RAW_FILE_NAME=220104_Smp_P5-5_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220104_Std_4uMStdsMix1InH2O_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Std_4uMStdsMix1InH2O_1.mzML SUBJECT_SAMPLE_FACTORS - 220104_Std_4uMStdsMix1InH2O_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Std_4uMStdsMix1InH2O_2.mzML SUBJECT_SAMPLE_FACTORS - 220104_Std_4uMStdsMix1InMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Std_4uMStdsMix1InMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 220104_Std_4uMStdsMix1InMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Std_4uMStdsMix1InMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 220104_Std_4uMStdsMix2InH2O_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Std_4uMStdsMix2InH2O_1.mzML SUBJECT_SAMPLE_FACTORS - 220104_Std_4uMStdsMix2InH2O_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Std_4uMStdsMix2InH2O_2.mzML SUBJECT_SAMPLE_FACTORS - 220104_Std_4uMStdsMix2InMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Std_4uMStdsMix2InMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 220104_Std_4uMStdsMix2InMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Std_4uMStdsMix2InMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 220104_Std_H2OinMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Std_H2OinMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 220104_Std_H2OinMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220104_Std_H2OinMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 220111_Blk_MediaBlk_A_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Blk_MediaBlk_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Blk_MediaBlk_AMS_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Blk_MediaBlk_AMS_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Blk_MediaBlk_AOA_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Blk_MediaBlk_AOA_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Blk_MediaBlk_B_pos.mzML Sample_type:Blank | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Blk_MediaBlk_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Poo_TruePooBacteria_Full1.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Bacteria RAW_FILE_NAME=220111_Poo_TruePooBacteria_Full1.mzML SUBJECT_SAMPLE_FACTORS - 220111_Poo_TruePooBacteria_Full2.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Bacteria RAW_FILE_NAME=220111_Poo_TruePooBacteria_Full2.mzML SUBJECT_SAMPLE_FACTORS - 220111_Poo_TruePooBacteria_Full3.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Bacteria RAW_FILE_NAME=220111_Poo_TruePooBacteria_Full3.mzML SUBJECT_SAMPLE_FACTORS - 220111_Poo_TruePooBacteria_Half1.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Bacteria RAW_FILE_NAME=220111_Poo_TruePooBacteria_Half1.mzML SUBJECT_SAMPLE_FACTORS - 220111_Poo_TruePooBacteria_Half2.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Bacteria RAW_FILE_NAME=220111_Poo_TruePooBacteria_Half2.mzML SUBJECT_SAMPLE_FACTORS - 220111_Poo_TruePooBacteria_Half3.mzML Sample_type:QC Pooled | Species_strain:NA | Broad_taxon:NA | MS_run:Bacteria RAW_FILE_NAME=220111_Poo_TruePooBacteria_Half3.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_DSS3_A_pos.mzML Sample_type:Sample | Species_strain:Ruegeria pomeroyi DSS-3 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_DSS3_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_DSS3_B_pos.mzML Sample_type:Sample | Species_strain:Ruegeria pomeroyi DSS-3 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_DSS3_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_DSS3_C_pos.mzML Sample_type:Sample | Species_strain:Ruegeria pomeroyi DSS-3 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_DSS3_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_Och_A_pos.mzML Sample_type:Sample | Species_strain:Roseobacter denitrificans Och 114 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_Och_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_Och_B_pos.mzML Sample_type:Sample | Species_strain:Roseobacter denitrificans Och 114 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_Och_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_Och_C_pos.mzML Sample_type:Sample | Species_strain:Roseobacter denitrificans Och 114 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_Och_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA11_A_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA11 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA11_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA11_B_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA11 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA11_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA11_C_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA11 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA11_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA16_A_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA16 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA16_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA16_B_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA16 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA16_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA16_C_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA16 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA16_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA36_A_pos.mzML Sample_type:Sample | Species_strain:Hyphomonas (α) SA36 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA36_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA36_B_pos.mzML Sample_type:Sample | Species_strain:Hyphomonas (α) SA36 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA36_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA36_C_pos.mzML Sample_type:Sample | Species_strain:Hyphomonas (α) SA36 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA36_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA42_A_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA44 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA42_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA44_B_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA44 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA44_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA44_C_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA44 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA44_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA48_A_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA48 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA48_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA48_B_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA48 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA48_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA48_C_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA48 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA48_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA53_A_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA53 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA53_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA53_B_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA53 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA53_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA53_C_pos.mzML Sample_type:Sample | Species_strain:Sulfitobacter (α) SA53 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA53_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA55_A_pos.mzML Sample_type:Sample | Species_strain:Marinobacter (γ) SA55 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA55_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA55_B_pos.mzML Sample_type:Sample | Species_strain:Marinobacter (γ) SA55 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA55_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA55_C_pos.mzML Sample_type:Sample | Species_strain:Marinobacter (γ) SA55 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA55_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA59_A_pos.mzML Sample_type:Sample | Species_strain:Limnobacter (β) SA59 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA59_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA59_B_pos.mzML Sample_type:Sample | Species_strain:Limnobacter (β) SA59 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA59_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA59_C_pos.mzML Sample_type:Sample | Species_strain:Limnobacter (β) SA59 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA59_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA60_A_pos.mzML Sample_type:Sample | Species_strain:Croceibacter (CFB) SA60 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA60_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA60_B_pos.mzML Sample_type:Sample | Species_strain:Croceibacter (CFB) SA60 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA60_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA60_C_pos.mzML Sample_type:Sample | Species_strain:Croceibacter (CFB) SA60 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA60_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA7_A_pos.mzML Sample_type:Sample | Species_strain:Pseudoalteromonas (γ) SA7 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA7_A_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA7_B_pos.mzML Sample_type:Sample | Species_strain:Pseudoalteromonas (γ) SA7 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA7_B_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SA7_C_pos.mzML Sample_type:Sample | Species_strain:Pseudoalteromonas (γ) SA7 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SA7_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SAR11_AB_pos.mzML Sample_type:Sample | Species_strain:SAR11 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SAR11_AB_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SAR11_C_pos.mzML Sample_type:Sample | Species_strain:SAR11 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SAR11_C_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SAR11_DE_pos.mzML Sample_type:Sample | Species_strain:SAR11 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SAR11_DE_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SAR11_F_pos.mzML Sample_type:Sample | Species_strain:SAR11 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SAR11_F_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SAR11_GH_pos.mzML Sample_type:Sample | Species_strain:SAR11 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SAR11_GH_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SAR11_I_pos.mzML Sample_type:Sample | Species_strain:SAR11 | Broad_taxon:Heterotrophic Bacteria | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SAR11_I_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SCM1_Exp1_pos.mzML Sample_type:Sample | Species_strain:Nitrosopumilus maritimus | Broad_taxon:Chemoautotrophs | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SCM1_Exp1_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SCM1_Exp2_pos.mzML Sample_type:Sample | Species_strain:Nitrosopumilus maritimus | Broad_taxon:Chemoautotrophs | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SCM1_Exp2_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SCM1_Exp3_pos.mzML Sample_type:Sample | Species_strain:Nitrosopumilus maritimus | Broad_taxon:Chemoautotrophs | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SCM1_Exp3_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SCM1_St1_pos.mzML Sample_type:Sample | Species_strain:Nitrosopumilus maritimus | Broad_taxon:Chemoautotrophs | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SCM1_St1_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SCM1_St2_pos.mzML Sample_type:Sample | Species_strain:Nitrosopumilus maritimus | Broad_taxon:Chemoautotrophs | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SCM1_St2_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SCM1_St3_pos.mzML Sample_type:Sample | Species_strain:Nitrosopumilus maritimus | Broad_taxon:Chemoautotrophs | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SCM1_St3_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Smp_SCM1_St4_pos.mzML Sample_type:Sample | Species_strain:Nitrosopumilus maritimus | Broad_taxon:Chemoautotrophs | MS_run:Bacteria RAW_FILE_NAME=220111_Smp_SCM1_St4_pos.mzML SUBJECT_SAMPLE_FACTORS - 220111_Std_4uMStdsMix1InH2O_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Std_4uMStdsMix1InH2O_1.mzML SUBJECT_SAMPLE_FACTORS - 220111_Std_4uMStdsMix1InH2O_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Std_4uMStdsMix1InH2O_2.mzML SUBJECT_SAMPLE_FACTORS - 220111_Std_4uMStdsMix1InMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Std_4uMStdsMix1InMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 220111_Std_4uMStdsMix1InMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Std_4uMStdsMix1InMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 220111_Std_4uMStdsMix2InH2O_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Std_4uMStdsMix2InH2O_1.mzML SUBJECT_SAMPLE_FACTORS - 220111_Std_4uMStdsMix2InH2O_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Std_4uMStdsMix2InH2O_2.mzML SUBJECT_SAMPLE_FACTORS - 220111_Std_4uMStdsMix2InMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Std_4uMStdsMix2InMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 220111_Std_4uMStdsMix2InMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Std_4uMStdsMix2InMatrix_2.mzML SUBJECT_SAMPLE_FACTORS - 220111_Std_H2OinMatrix_1.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Std_H2OinMatrix_1.mzML SUBJECT_SAMPLE_FACTORS - 220111_Std_H2OinMatrix_2.mzML Sample_type:Standard mix | Species_strain:NA | Broad_taxon:NA | MS_run:NA RAW_FILE_NAME=220111_Std_H2OinMatrix_2.mzML #COLLECTION CO:COLLECTION_SUMMARY Cultures were harvested under exponential growth using a gentle vacuum CO:COLLECTION_SUMMARY filtration onto 47 mm Durapore filters (pore size 0.2 µm). Samples were flash CO:COLLECTION_SUMMARY frozen in liquid N2 and stored at -80°C until extraction for metabolites. CO:SAMPLE_TYPE Cultured cells #TREATMENT TR:TREATMENT_SUMMARY Media, light, and temperature were chosen for optimal growth of each TR:TREATMENT_SUMMARY phytoplankton species. In short, cultures were grown in controlled laboratory TR:TREATMENT_SUMMARY settings and harvested under exponential growth using a gentle vacuum filtration TR:TREATMENT_SUMMARY onto 47 mm Durapore filters (pore size 0.2 µm). Samples were flash frozen in TR:TREATMENT_SUMMARY liquid N2 and stored at -80°C until extraction. In addition to samples, media TR:TREATMENT_SUMMARY blanks corresponding to each media type were harvested and served as a matrix TR:TREATMENT_SUMMARY blank to each corresponding phytoplankton sample. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Each sample was extracted using a modified Bligh-Dyer extraction. Briefly, SP:SAMPLEPREP_SUMMARY filters were cut up and put into 15 mL teflon centrifuge tubes containing a SP:SAMPLEPREP_SUMMARY mixture of 100 µm and 400 µm silica beads. Heavy isotope-labeled internal SP:SAMPLEPREP_SUMMARY standards were added along with ~2 mL of cold aqueous solvent (50:50 SP:SAMPLEPREP_SUMMARY methanol:water) and ~3 mL of cold organic solvent (dichloromethane). The samples SP:SAMPLEPREP_SUMMARY were shaken on a FastPrep-24 Homogenizer for 30 seconds and chilled in a -20°C SP:SAMPLEPREP_SUMMARY freezer repeatedly for three cycles of bead-beating and a total of 30 minutes of SP:SAMPLEPREP_SUMMARY chilling. The organic and aqueous layers were separated by spinning samples in a SP:SAMPLEPREP_SUMMARY centrifuge at 4,300 rpm for 2 minutes at 4°C. The aqueous layer was removed to SP:SAMPLEPREP_SUMMARY a new glass centrifuge tube. The remaining organic fraction was rinsed three SP:SAMPLEPREP_SUMMARY more times with additions of 1 to 2 mL of cold 50:50 methanol:water. All aqueous SP:SAMPLEPREP_SUMMARY rinses were combined for each sample and ~2mL of cold dichloromethane was added SP:SAMPLEPREP_SUMMARY to the combined aqueous layer. Tubes were shaken and centrifuged at 4,300 rpm SP:SAMPLEPREP_SUMMARY for 2 minutes at 4°C. The aqueous layer was removed to a new glass vial and SP:SAMPLEPREP_SUMMARY dried under N2 gas. The remaining organic layer in the bead beating tubes was SP:SAMPLEPREP_SUMMARY transferred into the glass centrifuge tube and the bead beating tube was rinsed SP:SAMPLEPREP_SUMMARY two more times with cold organic solvent. The combined organic rinses were SP:SAMPLEPREP_SUMMARY centrifuged, transferred to a new glass vial, and dried under N2 gas. Dried SP:SAMPLEPREP_SUMMARY aqueous fractions were re-dissolved in 380 µL of water. Dried organic fractions SP:SAMPLEPREP_SUMMARY were re-dissolved in 380 µL of 1:1 water:acetonitrile. 20 µL of SP:SAMPLEPREP_SUMMARY isotope-labeled injection standards in water were added to both fractions. Media SP:SAMPLEPREP_SUMMARY blanks were extracted alongside samples as methodological blanks. SP:PROCESSING_STORAGE_CONDITIONS On ice SP:EXTRACTION_METHOD Bligh-Dyer SP:EXTRACT_STORAGE -80℃ #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY A SeQuant ZIC-pHILIC column (5 um particle size, 2.1 mm x 150 mm, from CH:CHROMATOGRAPHY_SUMMARY Millipore) was used with 10 mM ammonium carbonate in 85:15 acetonitrile to water CH:CHROMATOGRAPHY_SUMMARY (Solvent A) and 10 mM ammonium carbonate in 85:15 water to acetonitrile (Solvent CH:CHROMATOGRAPHY_SUMMARY B) at a flow rate of 0.15 mL/min. This column was compared with a Waters UPLC CH:CHROMATOGRAPHY_SUMMARY BEH amide and a Millipore cHILIC column; the pHILIC showed superior CH:CHROMATOGRAPHY_SUMMARY reproducibility and peak shapes. The column was held at 100% A for 2 minutes, CH:CHROMATOGRAPHY_SUMMARY ramped to 64% B over 18 minutes, ramped to 100% B over 1 minute, held at 100% B CH:CHROMATOGRAPHY_SUMMARY for 5 minutes, and equilibrated at 100% A for 25 minutes (50 minutes total). The CH:CHROMATOGRAPHY_SUMMARY column was maintained at 30 C. The injection volume was 2 µL for samples and CH:CHROMATOGRAPHY_SUMMARY standard mixes. When starting a batch, the column was equilibrated at the CH:CHROMATOGRAPHY_SUMMARY starting conditions for at least 30 minutes. To improve the performance of the CH:CHROMATOGRAPHY_SUMMARY HILIC column, we maintained the same injection volume, kept the instrument CH:CHROMATOGRAPHY_SUMMARY running water blanks between samples as necessary, and injected standards in a CH:CHROMATOGRAPHY_SUMMARY representative matrix in addition to standards in water. After each batch, the CH:CHROMATOGRAPHY_SUMMARY column was flushed with 10 mM ammonium carbonate in 85:15 water to acetonitrile CH:CHROMATOGRAPHY_SUMMARY for 20 to 30 minutes. CH:CHROMATOGRAPHY_TYPE HILIC CH:INSTRUMENT_NAME Waters Acquity I-Class CH:COLUMN_NAME SeQuant ZIC- pHILIC (150 x 2.1mm,5um) CH:SOLVENT_A 85% acetonitrile/15% water; 10 mM ammonium carbonate CH:SOLVENT_B 15% acetonitrile/85% water; 10 mM ammonium carbonate CH:FLOW_GRADIENT 100% A for 2 minutes, ramped to 64% B over 18 minutes, ramped to 100% B over 1 CH:FLOW_GRADIENT minute, held at 100% B for 5 minutes, and equilibrated at 100% A for 25 minutes CH:FLOW_GRADIENT (50 minutes total) CH:FLOW_RATE 0.15mL/min CH:COLUMN_TEMPERATURE 30 #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive HF hybrid Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS Metabolomic data was collected on a Thermo Q Exactive HF hybrid Orbitrap mass MS:MS_COMMENTS spectrometer. The capillary and auxiliary gas heater temperatures were MS:MS_COMMENTS maintained at 320°C and 100°C, respectively. The S-lens RF level was kept at MS:MS_COMMENTS 65, the H-ESI voltage was set to 3.3 kV and sheath gas, auxiliary gas, and sweep MS:MS_COMMENTS gas flow rates were set at 16, 3, and 1, respectively. Polarity switching was MS:MS_COMMENTS used with a scan range of 60 to 900 m/z and a resolution of 60,000. Calibration MS:MS_COMMENTS was performed every 3-4 days at a target mass of 200 m/z. All files were then MS:MS_COMMENTS converted to an open-source mzML format and centroided via Proteowizard’s MS:MS_COMMENTS msConvert tool. Skyline was used to for manual integration and QC of quantified MS:MS_COMMENTS data, while XCMS was used with a custom QC method for peak area data and each MS:MS_COMMENTS feature manually reviewed. MS:MS_RESULTS_FILE ST002790_AN004540_Results.txt UNITS:normalized peak area per liter seawater filtered Has m/z:Yes Has RT:Yes RT units:Minutes #END