#METABOLOMICS WORKBENCH huntermoseley_20200822_092453 DATATRACK_ID:2148 STUDY_ID:ST001465 ANALYSIS_ID:AN002440 PROJECT_ID:000000 VERSION 1 CREATED_ON August 26, 2020, 5:41 pm #PROJECT PR:PROJECT_TITLE Metabolomics of lung injury after allogeneic hematopoietic cell transplantation PR:PROJECT_SUMMARY Allogeneic hematopoietic cell transplantation (allo-HCT) is a potentially PR:PROJECT_SUMMARY curative treatment option for a variety of hematological malignancies. PR:PROJECT_SUMMARY Interactions between the donor immune system and the patient tissue result in a PR:PROJECT_SUMMARY disease, called GVHD. The pathophysiology of acute GVHD can be hypothesized in PR:PROJECT_SUMMARY three sequential phases: cytokine storm and activation of the antigen-presenting PR:PROJECT_SUMMARY cells (APC), donor T cell activation and effector cell phase. Idiopathic PR:PROJECT_SUMMARY pneumonia syndrome (IPS) is one of the most deleterious complications after PR:PROJECT_SUMMARY allogeneic HCT and is considered not only to be related to conditioning regimen PR:PROJECT_SUMMARY toxicity but also represents an end organ damage caused by allo-reactive T PR:PROJECT_SUMMARY cells, therefore making the lung susceptible to a two-pronged attack, one of PR:PROJECT_SUMMARY which overlaps with GVHD causing other target organ injury. IPS results in PR:PROJECT_SUMMARY mortality of up to 90% of patients. We will use a murine model of IPS and GVHD PR:PROJECT_SUMMARY which is well established in our group, and in which disease evolves either PR:PROJECT_SUMMARY across disparities in major histocompatibility complex (MCH) class I and II, PR:PROJECT_SUMMARY minor histocompatibility antigens (miHags) or both. Metabolomics changes PR:PROJECT_SUMMARY following syngeneic and allogeneic HCT at post-transplantation Days +7 (cytokine PR:PROJECT_SUMMARY storm phase) and Days +42 (cellular effector phase) are compared to baseline PR:PROJECT_SUMMARY wild-type (naive) controls. Prior to analysis, naïve - and experimental mice PR:PROJECT_SUMMARY (N=3 from each group) were fed with semi-liquid diet supplemented with tracers PR:PROJECT_SUMMARY (13C6-glucose ) over 24 hours. At the end of 7 days or 42 days, respectively, PR:PROJECT_SUMMARY feces and aGVHD target organs (colon, liver and lung) were collected from all PR:PROJECT_SUMMARY groups and further processed and / or analyzed. We expect to reveal metabolic PR:PROJECT_SUMMARY pathways affected after allo-HCT which contribute to immune cell mediated lung PR:PROJECT_SUMMARY injury (IPS) and will potentially identify different metabolic pathways in other PR:PROJECT_SUMMARY GVHD target organs. PR:INSTITUTE University of Kentucky PR:DEPARTMENT Markey Cancer Center, Hematology and Blood and Marrow Transplant PR:LAST_NAME Hildebrandt PR:FIRST_NAME Gerhard PR:ADDRESS Gerhard C. Hildebrandt, MD, Room no. CC401A, Ben Roach Building, Markey Cancer PR:ADDRESS Center University of Kentucky, Lexington, 40536 PR:EMAIL gerhard.hildebrandt@uky.edu PR:PHONE 800-333-8874 #STUDY ST:STUDY_TITLE Metabolomics of lung injury after allogeneic hematopoietic cell transplantation ST:STUDY_TITLE - Spleen NMR 1D ST:STUDY_TYPE preliminary data ST:STUDY_SUMMARY Allogeneic hematopoietic cell transplantation (allo-HCT) is a potentially ST:STUDY_SUMMARY curative treatment option for a variety of hematological malignancies. ST:STUDY_SUMMARY Interactions between the donor immune system and the patient tissue result in a ST:STUDY_SUMMARY disease, called GVHD. The pathophysiology of acute GVHD can be hypothesized in ST:STUDY_SUMMARY three sequential phases: cytokine storm and activation of the antigen-presenting ST:STUDY_SUMMARY cells (APC), donor T cell activation and effector cell phase. Idiopathic ST:STUDY_SUMMARY pneumonia syndrome (IPS) is one of the most deleterious complications after ST:STUDY_SUMMARY allogeneic HCT and is considered not only to be related to conditioning regimen ST:STUDY_SUMMARY toxicity but also represents an end organ damage caused by allo-reactive T ST:STUDY_SUMMARY cells, therefore making the lung susceptible to a two-pronged attack, one of ST:STUDY_SUMMARY which overlaps with GVHD causing other target organ injury. IPS results in ST:STUDY_SUMMARY mortality of up to 90% of patients. We will use a murine model of IPS and GVHD ST:STUDY_SUMMARY which is well established in our group, and in which disease evolves either ST:STUDY_SUMMARY across disparities in major histocompatibility complex (MCH) class I and II, ST:STUDY_SUMMARY minor histocompatibility antigens (miHags) or both. Metabolomics changes ST:STUDY_SUMMARY following syngeneic and allogeneic HCT at post-transplantation Days +7 (cytokine ST:STUDY_SUMMARY storm phase) and Days +42 (cellular effector phase) are compared to baseline ST:STUDY_SUMMARY wild-type (naive) controls. Prior to analysis, naïve - and experimental mice ST:STUDY_SUMMARY (N=3 from each group) were fed with semi-liquid diet supplemented with tracers ST:STUDY_SUMMARY (13C6-glucose ) over 24 hours. At the end of 7 days or 42 days, respectively, ST:STUDY_SUMMARY feces and aGVHD target organs (colon, liver and lung) were collected from all ST:STUDY_SUMMARY groups and further processed and / or analyzed. We expect to reveal metabolic ST:STUDY_SUMMARY pathways affected after allo-HCT which contribute to immune cell mediated lung ST:STUDY_SUMMARY injury (IPS) and will potentially identify different metabolic pathways in other ST:STUDY_SUMMARY GVHD target organs. ST:INSTITUTE University of Kentucky ST:DEPARTMENT MCC ST:LAST_NAME Hildebrandt ST:FIRST_NAME Gerhard ST:ADDRESS CTW-453, 900 South Limestone street. UKY. Lexington, Kentucky-40536 ST:EMAIL gerhard.hildebrandt@uky.edu ST:PHONE 800-333-8874 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 #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 - 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Treatment Protocol:allogenic lineage_1=07_C1-1_allogenic_42days_UKy_GCH_rep1; protocol.id=['allogenic']; replicate=1; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=42; lineage_2=07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage7']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.7766999999999997; weight%units=g; lineage_4=07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=07_C1-1_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Treatment Protocol:naive lineage_1=01_A0_naive_0days_UKy_GCH_rep1; protocol.id=['naive']; replicate=1; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=-; lineage_2=01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage1']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.8091999999999997; weight%units=g; lineage_4=01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=01_A0_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Treatment Protocol:syngenic lineage_1=04_B0_syngenic_42days_UKy_GCH_rep1; protocol.id=['syngenic']; replicate=1; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=42; lineage_2=04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage4']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.7723999999999998; weight%units=g; lineage_4=04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=04_B0_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Treatment Protocol:syngenic lineage_1=11_B1-1_syngenic_7days_UKy_GCH_rep2; protocol.id=['syngenic']; replicate=2; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=7; lineage_2=11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage11']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.7434; weight%units=g; lineage_4=11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=11_B1-1_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Treatment Protocol:naive lineage_1=02_A1_naive_0days_UKy_GCH_rep2; protocol.id=['naive']; replicate=2; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=-; lineage_2=02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage2']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.8049000000000002; weight%units=g; lineage_4=02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=02_A1_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Treatment Protocol:syngenic lineage_1=05_B1_syngenic_42days_UKy_GCH_rep2; protocol.id=['syngenic']; replicate=2; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=42; lineage_2=05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage5']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.8440000000000001; weight%units=g; lineage_4=05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=05_B1_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Treatment Protocol:syngenic lineage_1=10_B1-0_syngenic_7days_UKy_GCH_rep1; protocol.id=['syngenic']; replicate=1; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=7; lineage_2=10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage10']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.7457; weight%units=g; lineage_4=10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=10_B1-0_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Treatment Protocol:syngenic lineage_1=12_B1-2_syngenic_7days_UKy_GCH_rep3; protocol.id=['syngenic']; replicate=3; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=7; lineage_2=12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage12']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.7406; weight%units=g; lineage_4=12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=12_B1-2_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Treatment Protocol:allogenic lineage_1=15_C1-20_allogenic_7days_UKy_GCH_rep3; protocol.id=['allogenic']; replicate=3; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=7; lineage_2=15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage15']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.6794; weight%units=g; lineage_4=15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=15_C1-20_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Treatment Protocol:naive lineage_1=03_A2_naive_0days_UKy_GCH_rep3; protocol.id=['naive']; replicate=3; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=-; lineage_2=03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage3']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.8131000000000002; weight%units=g; lineage_4=03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=03_A2_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Treatment Protocol:allogenic lineage_1=13_C1-1_allogenic_7days_UKy_GCH_rep1; protocol.id=['allogenic']; replicate=1; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=7; lineage_2=13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage13']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.3022; weight%units=g; lineage_4=13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=13_C1-1_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Treatment Protocol:syngenic lineage_1=06_B2_syngenic_42days_UKy_GCH_rep3; protocol.id=['syngenic']; replicate=3; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=42; lineage_2=06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage6']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.8069000000000002; weight%units=g; lineage_4=06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=06_B2_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Treatment Protocol:allogenic lineage_1=14_C1-2_allogenic_7days_UKy_GCH_rep2; protocol.id=['allogenic']; replicate=2; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=7; lineage_2=14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage14']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.3402; weight%units=g; lineage_4=14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=14_C1-2_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Treatment Protocol:allogenic lineage_1=08_C1-2_allogenic_42days_UKy_GCH_rep2; protocol.id=['allogenic']; replicate=2; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=42; lineage_2=08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage8']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.8232999999999999; weight%units=g; lineage_4=08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=08_C1-2_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid SUBJECT_SAMPLE_FACTORS - 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Treatment Protocol:allogenic lineage_1=09_C2-0_allogenic_42days_UKy_GCH_rep1; protocol.id=['allogenic']; replicate=1; species=Mus musculus; species_type=Mouse; taxonomy_id=10090; time_point=42; lineage_2=09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1; protocol.id=['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']; lineage_3=09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A; protocol.id=['polar_extraction', 'NMR_file_storage9']; replicate=1; replicate%type=analytical; type=cell_extract; weight=0.7538; weight%units=g; lineage_4=09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-protein; protein_weight=-; protein_weight%units=mg; protocol.id=['protein_extraction']; RAW_FILE_NAME=09_C2-0_13C6-Glc_UKy_GCH_Ms_spleen_PRESAT_01.fid/fid #COLLECTION CO:COLLECTION_SUMMARY Mouse is sacrificed and tissues are harvested. CO:COLLECTION_PROTOCOL_ID mouse_tissue_collection CO:SAMPLE_TYPE Multiple tissues #TREATMENT TR:TREATMENT_SUMMARY Mouse with allogenic bone marrow transplant. Fed with semi-liquid diet TR:TREATMENT_SUMMARY supplemented with fully labeled glucose for 24 hours before harvest. Mouse with TR:TREATMENT_SUMMARY no treatment. Fed with semi-liquid diet supplemented with fully labeled glucose TR:TREATMENT_SUMMARY for 24 hours before harvest. Mouse with syngenic bone marrow transplant. Fed TR:TREATMENT_SUMMARY with semi-liquid diet supplemented with fully labeled glucose for 24 hours TR:TREATMENT_SUMMARY before harvest. TR:TREATMENT_PROTOCOL_ID allogenic naive syngenic #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Tissue is frozen in liquid nitrogen to stop metabolic processes. Frozen tissue SP:SAMPLEPREP_SUMMARY is ground in a SPEX grinder under liquid nitrogen to homogenize the sample. SP:SAMPLEPREP_SUMMARY Polar extraction from homogenate, lypholized, and frozen. Protein extraction and SP:SAMPLEPREP_SUMMARY quantification. SP:SAMPLEPREP_PROTOCOL_ID tissue_quench; polar_extraction; protein_extraction; frozen_tissue_grind SP:SAMPLEPREP_PROTOCOL_FILENAME 4D_17Jun4_Fan_Prot_Quant.pdf; 4B_Extract_Polar_Lipid_Prot_Fan_070417.pdf #ANALYSIS AN:ANALYSIS_TYPE NMR #NMR NM:INSTRUMENT_NAME Agilent 600 NM:INSTRUMENT_TYPE Agilent 600 NM:NMR_EXPERIMENT_TYPE PRESAT (1H1D) NM:STANDARD_CONCENTRATION 0.5 mM NM:SPECTROMETER_FREQUENCY 600 MHz NM:NMR_PROBE cryogenic triple resonance HCN NM:NMR_SOLVENT D20 NM:NMR_TUBE_SIZE 1.7 mm NM:SHIMMING_METHOD gradient shimming NM:PULSE_SEQUENCE PRESAT NM:WATER_SUPPRESSION presaturation NM:CHEMICAL_SHIFT_REF_CPD DSS NM:TEMPERATURE 15 celsius NM:ACQUISITION_TIME 2 s NM:RELAXATION_DELAY 4 s NM:BASELINE_CORRECTION_METHOD Bernstein Polynomial #NMR_METABOLITE_DATA NMR_METABOLITE_DATA:UNITS normalized peak area NMR_METABOLITE_DATA_START Samples 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Factors Treatment Protocol:allogenic Treatment Protocol:naive Treatment Protocol:syngenic Treatment Protocol:syngenic Treatment Protocol:naive Treatment Protocol:syngenic Treatment Protocol:syngenic Treatment Protocol:syngenic Treatment Protocol:allogenic Treatment Protocol:naive Treatment Protocol:allogenic Treatment Protocol:syngenic Treatment Protocol:allogenic Treatment Protocol:allogenic Treatment Protocol:allogenic AXP-1' 13C-A_1 49.25289606907639 502.5021104976589 899.7518089272015 2742.940239538765 1184.138444440746 2685.786078479132 1047.789424270844 1566.496956987393 910.2709867530034 2216.801239963082 489.6390069711061 AXP-1' 13C-B_1 584.3454338934952 701.5191731490444 1084.439168699374 536.5511251217197 527.1654179002744 1838.779420128827 907.070058064234 2258.681288231271 793.0637410005556 1061.472289216198 1555.333833037309 1928.891617972621 290.6864212331473 AXP-1'_1 139.6350015153743 234.1976092977262 569.6366341668509 356.2817215227211 330.3409838560075 116.6511232216669 512.0209110779352 141.1481307627827 499.5560216930488 456.7830607329011 347.8091084793215 762.2800920384152 431.3398981959185 32.44205272848955 94.11457156419183 AXP-1'_2 456.9342294834757 414.0007830318076 1331.740585473058 801.0851189870527 926.4800747808108 481.8457980090816 1196.447816123885 32.13842452210093 702.7208558884516 1039.59578223064 462.2408162470398 1809.498212988737 485.3979808292668 94.24647805502791 331.712301198239 AXP-1'_3 253.4169112399 287.6194707935863 415.4191195795779 336.533703755039 382.9980093072868 218.0322996938986 455.2526206406953 345.6428130695593 273.8116000055138 462.1008438625494 167.7132037502238 611.8670227645359 222.3676233377371 43.63755896812253 143.0722255568269 AXP-1'_4 363.6872346618577 187.8151927987216 AXP-2_1 216.5607326571361 288.4472248063486 701.8925222082868 506.5330269343524 434.61892599966 205.3782013318314 1252.687813455748 45.70641786250669 99.97470558774388 58.86629658262683 123.8119923014441 1515.402584245933 64.54739576834555 59.12757876513452 154.9809715185004 AXP-2_2 201.6213016069092 272.7873370101801 438.234558373049 341.8849836191366 344.0602482390857 160.1181411303569 549.6301125089715 318.0624187411495 757.6475256712362 561.4219529753698 465.0422106333385 769.3318325676563 625.1777991540893 49.88040607497565 102.95735237562 AXP-2_3 269.5116026475259 281.6714340157214 415.1078855648339 291.6952469756449 401.941995448543 208.1135190294845 176.1135915686373 849.2578373867352 433.1952291835622 131.249057675019 148.2959061848379 799.6993488028402 122.4102576958222 AXP-2_4 209.8953032747798 506.2603833038735 73.16448397431098 AXP-2_5 200.6040123500972 AXP-8_1 415.1200363419749 502.1615829017501 618.08342736333 507.2246001555946 608.3339777456981 354.3931243052748 861.9604807718258 369.8021043022696 493.8345273125439 682.282893697305 195.7313174699226 1078.751900711741 460.6823452167142 55.02190457065699 197.8285592552303 AXP-8_2 344.1537427666321 472.8058445374975 695.7744979853431 539.695301498739 558.6934009824298 312.8992823190527 879.3396016731781 362.9564203855303 658.8157093336924 667.4825944694828 327.4509726930173 1069.527669086212 547.9233263236778 49.83394684599344 199.5775241986397 Ace-2_1 664.4472104234666 421.644727659888 1204.378149388472 1151.516461627599 881.2022136187888 926.0670226741591 1007.843679059105 1081.521246338881 319.9655398838502 732.25507842225 881.5370466400491 973.6184744089395 747.9872814606506 366.722935747565 528.0931873516746 Ala-3_1 308.4307257815523 210.8505782655758 638.2499556567346 608.6745084640696 210.974181843528 173.5861730815759 816.4587655116193 323.0815083363397 739.0511724009303 250.3989085245969 657.4441606209481 468.651831708957 674.8947511278251 31.79176561205624 77.4921436523921 Ala-3_2 298.6779076005774 221.7162264410802 640.9071315700508 604.9726806883984 207.5780178352559 189.8734536495456 881.3094937357099 324.5738553133921 702.0079430837735 269.180985170408 624.987293261218 505.8249185378224 649.8567341932452 38.23623989783527 84.15455300360215 Ala13C-A_1 127.0090748725537 9.226335230803732 25.3992573176897 18.49172035941089 22.54463240586219 12.90588671560202 32.71232712019699 59.62708848614574 187.7214370971845 21.3179917641368 63.95901978520519 102.5431262479999 170.4577954064808 19.29352763303596 Ala13C-A_2 58.53792962904935 36.35023141307715 100.1461304940428 88.45099531747768 94.5372327104056 39.45978229167764 132.0366514214809 154.7191333341291 510.51729001478 92.5539093004765 206.4379685817049 280.5102397087086 482.7215451781536 19.84252308458195 Ala13C-A_3 12.28967349608136 24.36169810595321 30.87210396290842 18.13888054013348 30.90832283079301 36.12894045416726 53.04438694742343 72.34229871296739 256.8212185645027 33.48351745216101 105.9790839804833 173.6388769834704 228.8851582081578 11.14966357168626 Ala13C-A_4 52.46231940173913 39.92562332423347 53.61200614826516 32.98176091124291 51.49486573118732 48.89546746643857 51.39013248507285 62.03202534551713 250.1704749240783 39.61166087656304 88.41986164661246 126.2574785962498 215.0707634376633 Ala13C-A_5 67.785710679714 10.31056612786434 118.3030027038047 93.76361720910303 88.30705769022507 13.18821129508014 170.1456453385848 156.749528762316 599.8842614019171 83.07533240270703 245.804280578279 297.5101843316792 495.1056049585225 Ala13C-A_6 12.61743411313399 23.57968831142151 19.28576709094797 27.33436785916861 11.74432579363714 59.09632624142787 234.5905219364041 27.39193074143588 81.70446760216717 107.2445307699073 204.6718808922155 Ala13C-A_7 36.72742575019903 86.09279234741787 Ala13C-B_1 31.95692394393755 45.84026584212685 49.87552039510431 43.3687225548006 36.02288142880382 27.67430797398274 74.47488333645559 185.2732379909199 254.1454107451914 40.37404889780097 89.6477261993734 136.3290897032822 219.3587870361719 8.99186563517436 Ala13C-B_2 99.48611408966057 27.85783392397242 115.6100801966959 118.0019012918621 96.95802038236997 57.68858080455769 226.3068869509669 94.64854698875887 624.8843565830887 103.2124812002965 274.9931567995347 282.1625286588273 524.7457454998579 8.99186563517436 Ala13C-B_3 79.34908442255772 43.79821614175196 108.916588262893 91.23059860008838 68.92279066129599 57.29042461273309 78.95107012075233 99.62835588490218 280.0780685359179 73.33832957100462 128.88274387953 145.3502411477139 257.3031420158147 29.98317266298406 Ala13C-B_4 99.62348994874397 14.68304099876845 120.6726879502148 118.1568660597454 100.959413968885 72.72511189014045 94.71285654032657 201.2745721503916 278.839480543381 97.54049441353256 107.5209068190474 151.1842566093742 228.1968498847258 18.05773537510152 Ala13C-B_5 27.53046975968388 14.68304099876845 38.80032185503902 33.67531174628764 44.15966360533545 24.71321402149749 253.7215141285214 88.95955224431889 621.1867163062374 41.18518241847667 318.1052733094585 308.5037901809063 586.4761447850324 28.48338135386397 Ala13C-B_6 57.88578531469584 219.2973995327131 89.11318798355728 133.9564087698532 184.2496535207333 Asp-3a_1 563.3887780055409 291.0144044103557 785.660552566185 594.414409411136 312.9290210690345 208.447690368475 838.953581303064 284.2931976734166 843.1371069783305 518.8955772702785 809.5722892637748 820.0014246229392 919.0129643286717 25.27788824322529 150.1642946293324 Asp-3a_2 180.4736549524406 291.1696046630801 613.8008278826313 534.5841454004798 233.7229360949733 172.8002443512761 823.7629658294156 176.0683670340013 469.4581189155176 338.9860184918973 593.5550438111669 553.1455895462525 752.4977526065264 26.23045545248386 93.39606665938948 Asp-3a_3 262.3075211712102 447.8411852240143 1137.994916906667 822.1516050502767 442.5976052737668 334.3553411548431 1328.628670510494 421.2187151331979 922.0838845989805 564.4966851058964 905.609163099944 899.8295467620475 766.1157818754854 74.54845406162919 193.5852919009602 Asp-3a_4 452.0238969724543 437.6653981227045 1079.285615711878 969.0039317175294 496.8890003302094 363.7803414468116 1265.645428116531 413.8677379358241 1342.256062233548 693.1298146816116 1167.292690402397 1201.802571131788 1441.182465731842 38.86179030700028 188.8283719894774 Asp-3b_1 436.2736219596749 543.7058350894958 1156.713820151313 1002.350587459682 571.5878018846812 554.949199792062 1568.60606020453 351.6012705778119 1662.170733090028 800.0909962575564 986.7456318263986 1262.616732221198 1220.216926822946 73.72896749281666 364.2503553461218 Asp-3b_2 408.8978256976201 490.1825030838338 1304.182418656191 951.196948550172 555.0998167008999 355.4318298579245 1245.791787375132 373.7880036705486 1296.546932123385 743.8366087859399 1142.907762637163 1226.869022867956 1394.623050270313 35.33016629756993 175.4014618663992 Asp-3b_3 260.5350769111485 312.739591422256 755.5522311432783 685.4200511169213 337.2566721838664 203.1477766485495 879.4342166488408 224.8740872717681 1121.890479830684 452.4518710678916 720.914840557301 697.1781821261822 993.6656703416888 41.44088560496976 135.3206631924593 Asp-3b_4 337.091649724817 358.1577129804745 910.994995491739 665.6449084446326 363.4875478414081 390.9910874655487 839.3444769046074 288.6559067905886 802.1101676432653 550.9301724251934 682.8548319744149 878.9737520419073 816.7727216077899 25.98560071780079 166.9144008954846 CXP-6_1 88.80378257814651 69.9678464716748 63.60838866890042 70.06983206649656 116.0652210258286 49.66262780877499 231.1549958564741 47.26291565652964 184.6705734761547 78.26336471583339 295.4124820499816 371.2892507355968 314.8405909703023 43.13141365237813 29.60270634292188 CXP-6_2 66.69984187384462 147.7926475328777 91.06336557967964 40.06627969249417 80.32401421532572 137.5627337094402 23.38730729083238 Creat_1 519.8656140403122 311.0402008854576 507.3449795267107 355.2019390350108 400.5576264897618 252.6150354392385 753.4135899134704 365.6896922756101 812.6073335348441 395.5574679552815 518.9083230604463 756.2988408591899 630.2228050405938 63.32519908009035 133.0406887411275 Cys-3-GSH_1 90.35944996113281 92.38155341947609 303.2215699564657 303.4319090422253 106.8302357855809 162.7627505595667 482.9466829533674 209.5176509125644 488.3826830819365 188.733124379877 261.5241623189527 397.1331805391252 514.0251786399616 20.05197988873063 75.43145318392443 Cys-3-GSH_2 82.06382491440294 65.1601868635423 299.9248208663163 308.0746165256002 88.11552517163751 136.3790217368898 422.7618245396141 175.6844399820774 444.6947203117852 170.1947034176725 251.9469508867319 352.1554667245167 346.0631453639962 16.41819889018469 62.84596426334147 Cys-3-GSH_3 90.53066141205507 97.02608793070182 343.1918668557909 356.688680377853 114.0002668541885 152.9978831461582 487.1703198200048 186.586340405703 418.8580580031076 206.4245976705656 272.2700901953094 408.445777594074 367.7630821590302 17.1881798890976 70.2173997226925 Cys-3-GSH_4 90.59921279838511 95.33698462955833 368.2642931565837 368.4801728374156 112.7553407486642 156.6584749840601 484.3915614455426 195.1976707190346 445.0583078783815 307.5187741944008 273.7493915883023 529.6085151486274 414.3216564241316 16.67119264064216 91.89225239258893 DSS_1 3316.469611353331 3305.580462907087 3224.864929545864 3324.754701972488 3354.623184780433 3230.948835035125 3393.237648359589 3282.230814139263 3309.798009306649 3297.719409257068 3448.688942739744 3397.969940868938 3323.401773391865 3090.472225333333 3306.351897515762 For_1 123.4312791532489 115.400593862374 204.0930379311149 181.646137852348 167.6242991144888 124.5640511180301 219.702851530805 166.6585836302148 230.8489759739389 153.2145258107752 200.6266541077179 170.6790613053978 207.462379752822 84.38930286445876 119.0589874192459 Fum_1 15.57566088488634 20.84730805711936 28.5707793709785 9.011633859116863 13.10587074054525 16.91436568799753 GSH+GSSG-3_1 88.77773986400744 299.952598848043 567.7817829968615 561.3436343102185 196.6907419415768 280.2153393380813 1079.55356658266 391.3250325598764 849.6572637564195 344.9178154804471 368.78458878515 762.497244880268 328.3421753668806 15.83890302522852 148.5363859111154 GSH+GSSG-3_2 134.2351303318348 308.9512443055237 732.3434939495601 555.5016406810412 379.979378533488 361.2471224656697 590.0689901432482 228.5854108602709 734.6697782108371 554.2629822371113 305.6820921804542 793.31001861141 858.664568434219 13.31160595542874 186.9036925989635 GSH+GSSG-3_3 11.47700218555007 121.4425846922561 188.644857233302 163.0831132216211 109.5376129635418 156.2804984412659 272.0906927472229 179.9001096609391 192.4242196124192 131.8301081371395 170.8941483743382 243.1093565202031 215.9100724180423 11.1117762912308 61.54496340529913 GSH+GSSG-3_4 11.47700218555007 121.4425846922561 188.644857233302 163.0831132216211 109.5376129635418 156.2804984412659 272.0906927472229 179.9001096609391 192.4242196124192 131.8301081371395 170.8941483743382 243.1093565202031 215.9100724180423 11.1117762912308 61.54496340529913 GSH+GSSG-4_1 8.77420799555643 9.203877497421853 30.89334907267078 26.95461581941298 11.5486250069218 10.11830580858681 47.19405327270587 12.41206826117544 26.2177627218468 17.40591698489522 18.24340496574567 30.29756167994115 23.83309418267761 4.670299308701448 7.08986216440412 GSH+GSSG-4_10 21.92837062442353 37.47955644353178 38.34330661147948 19.04872796470181 15.2532058440204 68.2727941054247 20.91267715855185 13.38140639963268 90.31357240426634 66.83769410739595 45.46869393607571 60.95997292098758 GSH+GSSG-4_11 12.26104935132448 48.51651298556015 45.01769482285117 9.528596858975119 6.111512745111447 53.41996920356458 9.78390310814622 267.5148359791383 27.15059831351349 20.14723968122127 67.76640627132079 122.4745884275764 GSH+GSSG-4_12 7.065552628763167 23.55698535161145 6.681555461888623 27.57998731531416 54.10435622420931 31.99233680666984 27.68926591830745 36.74305837816914 264.5990011001002 GSH+GSSG-4_13 18.81858004618762 5.900880081395814 17.16563297686875 12.31017977663374 55.99583438093689 GSH+GSSG-4_14 48.35706579967633 24.31625583576162 17.1494595328982 GSH+GSSG-4_15 16.8797348349221 GSH+GSSG-4_16 38.28354788401473 GSH+GSSG-4_2 5.640181279193561 13.80309773571473 51.79474152603952 38.56265136253172 16.63765275069322 17.12695889692146 64.25116509714823 21.84515522878211 44.96716633595933 29.28975564804477 26.03695969058669 57.77440369460737 41.86999851550288 14.82442760346055 8.632204183570312 GSH+GSSG-4_3 19.20012665607295 37.60806119501022 121.3835014098166 97.07277800570326 43.40861858957622 43.30067816230848 132.3443812953165 55.57979867963752 15.30523062043186 74.81651275044695 51.50708924286145 168.5585514457127 25.76530378123678 28.74200434561061 24.25716735130976 GSH+GSSG-4_4 30.99518739673618 58.78531216473732 205.1554499199283 177.230165713495 66.73572931667653 76.69181431400668 253.177841530816 93.7644984081745 100.5932988090908 120.5377133183343 101.7731762980147 242.0247537314388 107.9371434585417 5.564196828064189 41.69360609340865 GSH+GSSG-4_5 67.52587719330769 28.91605456429012 86.63363844740138 94.9535556621532 23.44005041634317 38.912245895196 127.8010105602942 46.73463426606413 185.5471455522559 74.72371575336238 49.15525809404288 141.8570065644023 214.0410560296864 5.216528524933443 17.17712694939222 GSH+GSSG-4_6 34.92597957866094 65.32361705337415 191.7059746794524 80.39667953062408 129.5428358880271 70.3853094511129 186.547648294523 73.94998800508247 114.817482870346 64.50543581610532 158.7770755101962 185.9875206868871 118.7085217958357 4.93859424498207 32.89957808814899 GSH+GSSG-4_7 19.23077919782698 59.16250794607571 209.8946270349299 37.48043756082804 65.17845576356937 71.6441139766562 270.1601340883542 95.20730729279447 128.8483385165515 20.52474692654007 104.4633364613495 306.4757108949633 125.6476548939709 32.53391164491126 GSH+GSSG-4_8 29.56094856718377 7.191092372964368 11.87406030901468 167.1140245378258 40.0983225757949 42.08280596849294 20.45132389636104 50.01463185208338 30.64895619659589 144.7050395505371 13.86017105435632 25.04091240687302 96.05948549680114 16.21664465668223 GSH+GSSG-4_9 36.47385283593241 131.6544274801462 127.8462273819662 21.89810529756595 25.60442162791357 132.9731863942378 10.91591157248292 212.9785356004275 11.08734201943202 3.571315906912745 154.3725884016775 182.0827536682998 5.557251217710107 GSSG-12_1 181.4577573529874 154.059308172634 570.4595580725362 638.9334172268959 155.6386653147935 281.4008370798713 929.2171054389096 423.4723113126409 799.411872273686 292.8081580266581 436.0926488893341 688.0727283206669 688.9800357731039 21.88955413652176 133.92966090183 GSSG-12_2 236.9637619621245 276.4263832643381 756.99451219272 682.0228386893416 328.8272288914422 356.8780970596646 1009.775433944949 416.860316740053 906.0073531240531 467.8561363492926 608.9714895979739 651.52377580396 883.8442699757518 40.70858528871454 163.3676413642239 GSSG-12_3 387.7339259585188 449.7007519619664 1010.411544834059 998.9807258786394 524.1846065357371 419.453034413926 879.1221647286599 509.8742382968918 942.0568528534984 801.9975139380672 640.3334516480293 868.8835479369978 825.9024974782146 51.73413511619741 227.4480279703358 GSSG-12_4 369.3824887254434 404.3796324158309 792.1501224846265 717.03051525616 479.5818559470879 393.5112709129109 1255.351949301576 454.1728728534225 858.1065804068337 552.0827833673652 620.8959127279622 1172.445776845255 843.0674482178299 63.50744236110803 208.4487208912842 Gln+Glu-2_1 64.23797224895426 126.6241115887445 250.3577400404079 5.468867706539573 29.56560001731572 36.90915363009703 112.9606866953722 7.21450956044647 72.78643789446326 95.17264032152684 578.267105231187 106.9617217503704 64.32519742797287 30.04477049344044 45.3329442054598 Gln+Glu-2_10 1038.804442947073 396.6023878611547 714.0727955596776 132.4882932880006 Gln+Glu-2_2 310.0946034606672 171.2199823510167 442.073125309425 242.878153719775 110.5641527321083 103.9886274264197 261.2420287027167 58.92711709204023 66.82069191585283 83.95414092167174 85.89697359906889 50.7506149453267 698.4733134981503 67.4247365633064 11.77883094608914 Gln+Glu-2_3 55.67251701493444 96.92387151518017 196.2290057453752 94.47615517930763 104.3570624440819 110.7408079071555 487.876513631757 141.5084044569067 750.9654106530033 624.3181617699917 316.7401229569276 135.3218330017017 143.5989728646041 12.41215835655616 57.12640291909783 Gln+Glu-2_4 79.68624798554107 307.2227019284488 322.4234412701875 105.2160024373004 287.8791363832654 78.2450165928475 168.0026805281343 135.2360283853475 291.1110562055978 257.959535164749 396.149887809383 65.0879005459384 156.6692920305294 102.9934684359295 Gln+Glu-2_5 59.3429274595946 77.6338699474323 271.3452204630175 191.2302053124971 247.4798850466793 43.2449141760297 359.0484885536225 98.51897037098406 296.8748088961673 75.69212434555693 101.4011477012408 982.7283490558647 410.0106361283515 42.0540987345981 Gln+Glu-2_6 50.7661822541927 81.49248080336969 270.7808139903412 359.1214610307413 47.10451577463905 65.22177821958307 63.98927887710563 42.85072351523088 430.8574288147287 315.4465710676879 386.0542379077578 194.3109867491946 311.7189926890699 21.28337533150723 Gln+Glu-2_7 953.1253497672583 73.75630141981021 223.0910249906639 61.19153530066712 99.63468762665354 47.87483378203367 151.4951461852885 124.4485048540482 413.4756610542645 555.4122566484804 208.4816703138148 192.7988992668711 93.78012628111888 Gln+Glu-2_8 17.5684399547362 165.9154735850042 91.65333632926871 284.3709778525507 62.30231891834517 245.6901147365649 139.4449288247448 555.8679889790209 1182.47001168302 160.6089107744581 Gln+Glu-2_9 153.1663696088335 34.77097972616655 146.0907320179033 282.2577831434618 263.3369696813763 77.25969464644233 51.87549778389815 Gln-4_1 10.42458081456141 64.8409562817261 139.7387542419439 161.7022653610399 87.94078482918445 30.46618108146992 52.22841344562125 43.33634872036692 76.0292918825514 65.0912188915254 56.77827940859333 122.1461901331273 26.97918614314156 7.956895834250051 27.71601398157793 Gln-4_10 13.41905481154141 66.19882470128277 24.02772163179021 205.3699303220839 Gln-4_11 26.02549312859471 56.94229353570599 236.0119024700905 Gln-4_12 13.44506043363516 110.5106500547987 Gln-4_13 24.32985087673652 Gln-4_14 70.52340186657021 Gln-4_2 45.37435524247646 26.57509212705449 65.63156904478143 98.5353217059798 39.36797489190398 129.3952276536892 253.9299927714825 65.78319762510277 264.7093520237802 22.86262665087731 15.46718202959351 27.04735372253958 39.30240413063075 39.21879732863579 23.44258861298287 Gln-4_3 234.8215711463337 77.89416731993576 211.260823970237 240.7481565934552 109.3239530293368 188.9730578322144 298.7932425165907 88.16868287630264 591.7783900875313 52.91707088791967 341.2801077025532 93.54836513705568 243.7497631165203 29.29170025764039 36.6578248253876 Gln-4_4 257.1136720439108 190.8932331830692 51.41723737408665 153.2268998233527 68.93473498094974 29.64809135227512 429.3142353833584 29.72385683171112 170.0279172812174 134.9865610996865 513.7004073146286 200.7371794608306 458.7655668135989 9.543322343542647 198.135072134972 Gln-4_5 56.19259309802367 66.93045605800285 91.47670245000027 232.7204990924073 135.0798967442814 54.83709661007605 68.3228718770225 188.1001559368165 91.71820558516208 492.8425113973029 10.41534463807034 214.8426548570353 22.16746523927883 Gln-4_6 202.5047896552721 23.41193973015181 221.1476233330491 267.260511163549 111.9714366908514 154.4064773589355 174.0616413524422 56.87215318622766 215.7761015480261 268.4258680657808 Gln-4_7 83.53932914128163 126.5164322321735 366.2329035516258 103.0924469743537 585.6605254799867 227.9436991548872 48.66886186434149 326.2217847496204 257.2225772851508 Gln-4_8 119.4533341031803 10.80062873752892 109.089304050867 36.50850046501278 503.5515743850865 173.0801869464287 230.0892734128251 450.7706748386189 Gln-4_9 236.4532669229223 426.5998866903051 16.58385394083458 256.9501159336094 310.9112720679254 Glu-3-a_1 206.3810988861013 38.47748519128363 104.1451208194277 101.8711969894939 53.85138874800585 68.58035582651436 118.9514903774486 44.92983573418888 40.54709187137096 55.24539849206101 418.4396420905093 79.00857516542062 554.4392407325893 35.82378408980098 28.99405877225656 Glu-3-a_10 213.3546089842597 559.636311333857 509.2705981782679 223.3427516426541 104.2797981112086 199.0391552987151 64.04780409472085 660.5992760851892 266.5262759197573 130.9443828493659 351.6583727165309 Glu-3-a_11 276.0572591176106 598.9970476496158 436.9211098141031 229.6949995556953 351.993062545411 77.72686021422966 110.0741748873607 308.2823509434918 419.1945872738016 478.7566283123973 Glu-3-a_12 261.5202318271535 18.14787328544773 510.4246847356068 280.5028518270972 589.7966209518095 167.3437118103624 542.7581477005458 292.5842388878432 479.8587042131808 Glu-3-a_13 142.0284288338678 519.2188386839928 220.1756291564822 176.2066665092494 294.0330962737528 36.57930586290364 158.7339354088286 237.1080043716063 59.25270050819644 Glu-3-a_14 274.1508334556692 347.7368028260078 112.9516215634672 428.7970321428051 467.1514750706768 Glu-3-a_15 284.9204137146717 119.7894625472094 465.2911570171221 Glu-3-a_16 117.1987042120931 Glu-3-a_2 682.8676772269907 83.48644783247806 191.6258303261351 251.7542341613013 68.30335429945117 295.5902845275592 382.1041835814343 168.208934941444 337.8160475647381 73.47292791978741 803.1607084357653 351.1309048831093 2553.774149345644 60.55448705543986 17.2702648637596 Glu-3-a_3 964.0903421603726 98.19959958535388 205.049649674449 129.1123036551868 42.47474543390172 436.3794418397426 409.3793121593391 150.3720121056051 553.5892373802947 75.47154055145086 180.465282838876 364.4096927168367 2728.282521283517 93.42272026638993 441.4566560972913 Glu-3-a_4 287.2209695981314 317.141077815295 970.9814916157363 1003.453909931629 680.7189074516916 257.2122146384485 1371.875640980635 547.8021958756925 447.2793569495044 690.830587583126 2423.879053742587 419.8958539907136 2353.599412347319 20.04885976134631 229.7339621403158 Glu-3-a_5 468.626387223097 662.842522437549 1470.48243152068 1576.884089162332 719.9746140290408 392.990077519441 2001.382449956501 601.2433079269534 226.7865579685561 806.7433478175608 914.7053637542276 338.3754958056212 1290.685098629494 16.24698874977015 410.8387262574019 Glu-3-a_6 261.0301535866609 47.95900463960074 171.2926564813016 129.7017468975232 112.1132712659882 35.70777180728511 345.7985978026148 243.0712892291803 1711.602946477223 131.251050324557 497.1433421815022 1496.82076295088 63.06907819302732 86.0343920306644 Glu-3-a_7 110.5744474131395 425.8524508416883 1146.542060044639 884.7308410952584 415.9014741427477 195.5849824641721 1167.121744140456 320.6711128410209 531.0807594672223 510.2895819928073 185.2571757281202 521.3016390157704 403.5734350138924 200.8223029259597 Glu-3-a_8 199.0032062926115 179.0848756399178 370.5256344100973 329.7968461800334 235.5005462102074 106.0309563953329 489.8581219314501 93.563938549503 991.0648711836604 269.5252214518461 204.4865301158102 996.4841716202988 84.40109239933047 Glu-3-a_9 106.1992289472298 210.2846707247721 154.5868173416722 162.6823174870766 107.0683604818373 167.2273235331452 146.1641930203767 402.6135255156442 193.2977661012448 639.2512413494428 359.9200753952862 59.58664935524907 Glu-4_1 269.1683364911818 300.4315102019402 42.40730278875773 27.39055802895415 24.90461033796637 173.7556423115151 837.6648255436411 13.94186186474042 48.02146763815209 16.59158381788298 944.2088259702699 28.11173314144168 32.13663270055534 24.80924943105999 129.8300184104287 Glu-4_10 336.2046802358233 257.7975961360958 158.2945715768323 118.4254945220938 370.7741501231746 192.2102221601395 63.96067199906222 302.5093829898852 64.20750286329736 Glu-4_11 111.6266208012676 35.67739397848983 Glu-4_2 207.0757769740967 233.0545901692648 594.5001619594572 485.9434284857891 249.01718372551 151.6974493946365 547.9755177559484 261.7919533741231 705.3244108894695 390.9917103320836 720.4187551453031 702.0493264363644 595.7517695035394 15.98849339786022 109.26060138205 Glu-4_3 170.3463340016913 226.3422886648349 806.0434262298687 406.7908247586001 437.9625100987016 197.5943132423099 535.0551023737436 206.2455515245358 1140.453520464319 375.0761504088876 591.0600255690977 672.4285363875643 945.3545090607377 53.60000443699683 118.4314130501946 Glu-4_4 237.9987855656443 260.6972142166115 405.8359181863117 363.9199872154904 216.1941900719293 165.6413092438899 579.40608865065 208.502835521497 560.8092822061842 322.6871014414017 761.563025852666 560.7996351785637 582.5758369953041 92.8664375525014 102.6042717691818 Glu-4_5 180.8986556020262 223.4051219690155 653.7957286806655 417.263849702132 298.4815898005131 177.80599490971 545.5677190868398 252.802095753214 808.6722829380165 381.7389546816253 683.6112807385434 572.3965015647466 669.0298021774076 14.38737539340316 119.2183356542984 Glu-4_6 187.742160452204 216.3470143515366 492.8700587239903 372.0281890521617 261.3461136780777 158.6537545100688 483.1345243906061 205.1063844985282 777.1639503421794 300.0040253934558 546.1524791965635 648.658492599951 487.1347050463545 93.781505770029 Glu-4_7 131.3878058622135 160.2389409174094 594.4373460988471 373.5554956300124 283.1459511174363 112.3683440778955 564.0435117722288 171.6764477298066 572.7612625097446 330.850287318724 547.0901614476691 506.31384066393 562.9873988035465 67.3362201554978 Glu-4_8 113.3940699239923 12.26801108396759 404.6535892759884 300.4987968359599 185.8601485149287 11.82841315466294 375.1863726852653 151.6712629876195 603.5249099511016 238.5194394451628 99.76133803142741 423.1437697348396 550.8676470957894 6.952453941531759 Glu-4_9 154.8276985631615 38.44958845966531 11.71152239043243 23.44321630016164 98.1324381530953 13.37843240204506 147.5862964409665 25.93389373145712 389.9651769895882 75.69188874204977 466.1630221051438 64.5049921397348 Gly_1 1073.447385967083 651.43488447717 1523.285614689594 1927.700096650125 798.419630059479 776.713119816808 3797.124640423496 1097.369496516931 2318.278142861639 902.2921629177035 1557.525356865222 2232.231925574717 2205.730853084535 95.72524175166227 392.3807315660725 Glycogen_1 109.8707043940333 61.69091246733249 243.2258858336528 273.0312456567872 49.72650878887978 137.1385516490255 237.5408085703278 89.09683603155634 28.231754 81.57618587098658 72.91756623607215 112.7628594976525 91.78137753266478 118.598149493125 Glycogen_2 74.32107166954461 43.51765267279232 44.04221711069431 133.7123990998401 17.089852 38.35939266403067 79.5132749025463 Ile_1 106.6156902712983 40.06514716998429 89.2494246727049 101.5028555367386 52.98007977321853 37.29514589885228 173.4165974777977 69.40871233802098 183.8473514149315 61.38940673217636 92.32554542976938 150.8308513658337 203.9778043311718 15.8318490831426 23.42316615614137 Ile_2 103.5149524990755 40.2354819232568 93.72267789482997 96.09424706989533 53.56172514140902 38.41850989057051 195.1581798862631 57.65917463048226 162.1221304301366 67.83087695873229 88.23128878356727 165.4968002316067 154.6090737241151 12.82403276507743 25.25380426515179 Itaconate-5a_1 14.118555 30.56279902663152 10.956153 11.772677 44.53578386426446 13.149592 26.620186 13.558388 44.87012186676682 40.32490159728324 30.86133823170088 Lac-2 13C-B_1 74.3388068952243 138.6729209069714 151.8964586019819 84.83108423453147 331.9793221419819 49.21519049161182 133.159438875175 90.82970456100706 209.03815415465 344.3284511394559 117.0646773175256 38.94127536534142 150.2030774015898 44.91085737860293 Lac-2 13C-B_10 210.6376059915408 312.9410926195039 716.5868411819198 249.0222692499508 68.26388045550779 541.5014072023065 177.5563679954741 Lac-2 13C-B_11 76.27700163176489 297.4040573051514 125.8654436672511 70.68241082688652 197.6310460193171 Lac-2 13C-B_12 121.2710913841481 248.8195128729378 227.6632909958253 Lac-2 13C-B_13 37.99285170167573 103.4077610726093 400.7197898668434 Lac-2 13C-B_14 47.7849556179481 Lac-2 13C-B_2 214.9349818555745 195.8616424376586 247.1934650432942 56.94753912713802 336.0647757635127 93.59431305324092 462.7073369168121 287.6204702568951 629.2379957244768 209.4968269856236 264.2040890508356 68.40317847121067 396.0940928023284 259.1527313603021 Lac-2 13C-B_3 351.913420437297 844.6916771512774 624.8778942220432 247.0178510972076 1132.711148254207 390.9535213154284 669.3731512691738 419.4823174073057 1031.558182606166 806.9419142622256 429.5427911383125 834.8834942435549 864.3000747788525 119.1379747346645 Lac-2 13C-B_4 894.4503066926856 244.9193752280623 745.913039401633 369.8457263621743 205.50151431251 165.0257736329018 560.558745363365 915.1271016954142 2180.482927504104 214.5984245046996 1006.611613542781 436.4371981241124 1574.791524442483 93.43969634227712 Lac-2 13C-B_5 437.6358134336534 65.30760521543716 480.7896678128549 188.5803684330844 436.3114412282633 218.3092563084744 1016.276330342634 677.879866765802 1513.0401882235 277.5867229414894 804.8703752963117 443.381709294233 1539.813651904445 139.6382015155853 Lac-2 13C-B_6 257.745539549094 76.82511823212127 739.6490521931984 356.6148825568118 780.8022212213432 1742.465509413332 663.8665387787125 2324.754326600302 565.0364098108585 942.1140404390505 1584.011874568471 1491.654759722382 Lac-2 13C-B_7 109.739851394064 452.3183905642894 434.6050329000821 530.3872696847268 826.6414273556294 1169.983562489035 1045.636331514186 597.6976347934419 1902.821569998943 Lac-2 13C-B_8 275.2160907166897 595.8374825013236 144.9134157966298 460.0675143980613 248.7983024117478 1738.548723443604 700.2449319427974 184.5643311220111 1189.608599913868 Lac-2 13C-B_9 203.0446561244937 157.809107541158 665.000959754875 693.7470075483558 246.1708385498434 750.278979479415 592.9462769999851 640.2055375244221 758.3899634326413 Lac-2_1 126.7513354410994 174.904955758672 335.4856746924317 384.0003591136217 152.8764921372358 62.43459527469463 405.5513674879334 73.5865472185604 536.0814849682155 147.9483351278157 179.1091447023602 254.4337008259453 63.05637945387642 23.16215548838693 51.71846173719481 Lac-2_2 604.8249530304643 383.4518789826365 903.4261115127663 979.6606810689475 275.2244896109385 373.7438657851504 1441.491001112657 451.9890829219902 542.1439744719935 227.2276542076382 700.9781851821496 520.5014019538932 429.9154405899826 88.48251427405623 166.2681751430046 Lac-2_3 701.9501800151768 321.6584627331918 971.6129122941264 959.8096118774898 233.1704380679512 347.8870817488033 1334.58306201286 474.0487155421668 1223.726511511905 260.6966331810778 1251.24343450111 659.3078330195558 1183.219720308516 88.26809508884483 125.6194634546745 Lac-2_4 156.1987851816949 133.9385198334929 406.2583237401323 446.6681947088522 96.59981396684175 87.82134602337737 1181.954073478857 140.2597037306254 291.2024662744157 152.8052341178559 507.989335818755 531.4255099845611 477.6113571597033 35.78658838986823 55.2911752409842 Lac-2_5 513.3475666206708 291.2024662744157 Lac-3_1 1064.467783983311 745.6898698689841 1704.94921455797 2211.513008845195 557.917343909213 533.459593519645 3637.03719206397 642.1170236997214 1030.167221986879 567.5347034237808 1600.762531674952 1127.089151966371 795.9187820052049 134.4041425710822 300.4750112647172 Lac-3_2 1105.611325779371 745.6898698689841 1704.94921455797 1846.734321395446 557.917343909213 518.2630125204212 2371.681756854685 559.3834592772233 1029.537906439515 567.5347034237808 1552.176724691037 1127.089151966371 832.5236846020721 173.3573762002545 301.7017110274771 Lac13C-A_1 302.3696865183621 34.84650042206462 235.3754608962596 284.8702271857421 296.9228129511471 214.5302086666667 771.8883328610506 464.9969571304719 1358.170710358079 330.6562107593099 922.0542817691706 1255.021171188697 1408.743501835308 27.89182329709726 92.59351115863326 Lac13C-A_2 538.0886839547965 99.56042399004474 98.31624702810679 114.5710155260761 656.1896995508204 40.9399 219.7604351372993 857.1971165144222 2777.382687252541 751.496968378055 1441.938710287189 1382.765060106413 1816.315511699122 140.7939193822962 26.14841732105144 Lac13C-A_3 743.6073007703027 78.06587663285127 603.1196929522142 710.0588473160774 237.946513211215 491.3349566666666 1393.154350634551 421.7689885164855 1101.747444200117 250.5841753213242 677.8167380746172 648.1203961925777 980.4398931595834 22.81187260105926 229.493481725126 Lac13C-A_4 353.3880661813333 274.4621105465422 230.959623498558 314.0529997538299 302.1728902841034 201.1344606666667 699.2840503063682 447.0072114485405 1130.331643175314 335.191400564239 615.294489772603 788.0965009815018 804.8924572493314 32.71169433119224 109.3534199685076 Lac13C-A_5 448.301743103689 112.6670409197408 323.6995941241189 374.4531294509964 562.6132573698881 236.890038 685.1440755106202 867.3882444949803 2757.238610569366 617.249538074227 1436.789504468687 1495.340751080553 2153.744016773114 80.80536370745138 117.7116241598718 Lac13C-A_6 795.6250882107828 205.8176587058878 596.8450499149627 710.6567136377445 364.3524387197157 439.831616 1470.13576935908 450.5686853947489 1205.243375506387 426.4795173984629 67.8372378354686 897.0166810583046 916.7805217061572 23.95045926123337 206.864981116538 Lac13C-A_7 57.61203341348568 277.0023726548663 23.20108534309424 57.55191161299189 33.94579466666666 153.9696939392645 625.7890905203377 12.02330914354176 Lac13C-A_8 381.6393806930535 16.23840289523827 345.7755680044763 401.3555269621788 213.2143186666667 627.8799599065858 109.1352075537143 Lac13C-A_9 154.4216574035947 Lac13C-B_1 279.1470711327599 90.79986838127074 175.1763548842638 199.6632875637392 217.2894663592013 176.480762593153 456.481836800219 319.9589980645085 1049.461599867207 251.4015281868897 548.6655566547893 606.1546784060281 922.4778325743868 16.4438604706408 148.3439139473657 Lac13C-B_2 77.18712945200988 11.57892096019624 43.81498760057107 48.81717533209751 486.855639535436 23.21780684881393 178.0514289846249 829.0123205231971 2565.273713281385 507.9414403754485 1258.347652251191 1239.988580200088 1830.172534967093 51.82067365588531 86.20887524415491 Lac13C-B_3 636.1430018159723 229.2571877469088 464.0357028659723 564.9573150306255 244.2825298167279 372.6747667055739 1192.270913907864 344.5434479167624 1021.813858395701 289.5079588576079 561.0033094056035 577.1667901827083 871.6196217708208 70.93932072391877 116.4165688394153 Lac13C-B_4 379.6477410163962 131.1061428090071 234.8433415412303 264.5575226083966 264.487375448929 207.7576993277805 629.062989161219 437.6129376647639 1182.750438213189 279.2223598002755 647.8374531386049 760.6584426458174 836.1752651166727 59.8187638261391 178.9527883307934 Lac13C-B_5 389.2112190334767 137.3614604882251 263.360532995403 315.6362207981959 471.7302398497347 205.0177842986622 650.885055787443 742.6589922048023 2455.860041343225 541.8826418011853 1231.913493292159 1153.99630006847 1962.922815096501 17.27398397869407 18.46281040767464 Lac13C-B_6 790.4559199133478 222.057525048136 500.3502211580649 592.1160445093686 222.7454082338797 380.2318001246928 1184.772204281216 324.8244793213194 1051.76243456112 245.4766460527526 78.29658916657122 557.6930102707391 787.9201560434448 89.74299276328315 Lac13C-B_7 53.26500176503501 33.59766911136732 40.18328693661439 70.6121197191751 33.37142016439432 159.5985189798451 515.3270881120476 89.74299276328315 Lac13C-B_8 350.0567991873745 84.52522644734451 195.7815764047252 221.1963799889549 149.8038016554258 430.2526241058521 Me-His A_1 108.4783148993018 74.74018015151464 128.49214227751 117.5446059059187 94.70558663178278 64.55171410002372 159.8079540174686 116.0368465964997 191.5022527275654 103.7294881217091 154.8907559730055 184.4999553544544 174.1002421085099 9.272699194192422 44.65496199547994 Me-His B_1 576.4205985956913 137.2509268877818 176.524943568216 116.919804161951 194.0299270063765 95.01138112217427 422.7648330465314 185.4302642653014 379.8049385678204 140.3537055365916 167.283991488164 356.878687038203 366.3352159708767 54.43464777881233 NAD+-A1'_1 68.50947108076082 52.46146173932383 111.3412543175106 84.53793081972384 76.21114642529794 29.26473455937215 147.7300536068797 72.74179034459974 108.0596249561792 85.40474513818859 94.7610792109705 123.1465132005461 99.24887242519505 11.59343681309624 NAD+-A1'_2 68.50947108076082 59.11966452932624 76.33912576114764 78.4387869873319 169.3630279648413 45.65706587985982 347.5227505353607 75.20749413278756 122.8744394477477 19.58826675377692 51.74890874782989 217.4644963563551 105.9161260390931 8.099206468802212 NAD+-N1' 13C-B_1 233.7791349629247 219.4767223177071 440.3425643415996 380.547469085403 552.6834075550021 NAD+-N1'_1 66.67868185619174 84.70188255401978 300.0595520926335 195.3759908503896 176.565392226816 28.68930161111656 222.90114643565 45.23893421169302 79.82155510835726 265.353804077437 82.73415513371584 337.0352018592432 125.6215775767358 11.96687379767157 NAD+-N1'_2 25.32037961979211 53.19078907943413 181.3547753085177 85.76069871590852 58.89201883842564 77.62735082392132 33.39324044036636 205.5796900858189 186.7639416540744 100.5150953594394 184.7115431422771 41.11690924891114 4.966535567362781 NAD-N2_1 131.0039372521192 136.4926138976661 208.4823359523455 114.5914111409926 174.7245639739105 89.65780680489188 166.3371579626241 147.4939018609496 311.8497250878017 205.2865751734242 224.2542805479655 296.3799639963032 232.0263111355483 5.992111304268938 49.3715501223793 NAD-N6_1 80.68632527630166 55.94963062591692 100.4099541657287 53.24387382492907 106.9254706430731 38.07239427830064 114.705110610408 111.2714960091267 151.2936729126548 92.71549856580496 107.1388378123449 156.6319028199199 102.0919630521407 7.066123126022111 29.95732346186986 NAD-N6_2 81.37772627871531 51.11391114444419 80.60040123917288 53.04987017610243 53.0837301622975 60.62955744633373 78.03981733846466 55.38290319276059 171.0944960372651 87.48471486090253 86.66622318066014 134.8797367379767 163.416252684533 47.86097960383567 NADP-N2_1 15.07970594095107 9.754932208322174 52.86536452863925 25.82406608533035 31.72827097323015 8.189837925578619 67.81700757314731 16.67787790693362 98.62212067018626 39.45877654768081 41.08492465789118 78.82149769691978 43.80796293844991 3.195847132277693 NADP-N6_1 16.69177911324711 2.654601708665019 13.07003883831395 23.95388953742093 9.618901605952555 7.073369019735323 13.05571107352555 8.189860376973874 26.28906506731025 16.1827209500449 14.98929073661747 52.2805315706893 5.483569750101512 5.972155787400496 NADP-N6_2 13.78655195876574 1.700175965547984 18.92447519364694 5.035057845485837 5.65972689983845 2.903787703320795 7.938719903194637 8.185021083370147 57.80172696894481 12.85563722184942 29.65377360387814 36.10254892377701 21.87689525396075 4.85960549012484 Nicotin-5_1 37.10299825648501 74.51918179191007 28.60163052227038 40.58477612317953 P-Cho A_1 563.5428579037775 1893.210752750015 3645.067643725253 1379.336813855539 2199.643508984617 504.5462908808304 2253.71670849967 636.7994065695608 1122.017299221575 2879.587011939333 778.7511523381147 5351.478369462681 1120.917329179171 54.80830295996674 568.9005524486006 P-Cho B_1 26.9626015 41.22399208900083 105.2684228164415 24.69852840637581 77.57456177182448 15.37846840940069 56.79349886591446 34.08015918016986 45.14371252675787 118.598329662894 23.88518140452704 162.7655115352837 222.6024578583163 30.22035427791724 P-Cho B_2 507.1950095 57.67027574177321 119.0122776896086 104.530450969354 96.73837840480253 27.25999986896657 156.0260005166581 89.73255026087679 169.3127285579932 139.4066063575883 95.42281882358033 162.7363807950397 262.1091291536572 78.97000930359341 P-Cho B_3 136.7583268908228 311.336964553268 62.29398065039464 258.7511887796819 64.85374996217132 173.2065839233365 117.285096846538 211.4064383273206 265.5858041005955 107.9740399380678 554.0986734782044 336.7819342233787 86.0930676551762 P-Cho B_4 264.6251669100365 443.0060869921301 134.1571886854473 304.4550645918826 11.1436904886967 229.5647857657456 105.7483334023236 340.6167260856839 331.4718697742019 167.6816183614569 626.1888686671105 252.9607246971555 99.66389920848049 P-Cho B_5 168.1826509008507 465.8108732349331 79.70947851369517 288.3269607198009 264.0967824621286 170.3897173653802 86.57608698569518 224.5219618036359 342.7561440770865 141.8900052324703 596.768923985578 179.3552771214583 87.81998909478591 P-Cho B_6 144.0321089274552 287.6483237232338 43.97178521964049 214.1519954761651 37.68353685964591 76.65015147496182 52.07572810137985 169.0986229226365 240.2342994814651 116.5086305814766 505.8312815967836 40.97694586868373 58.72617057949999 P-Cho B_7 163.3546525251691 279.1768412006129 8.122092031465252 188.177842235971 18.71250248153823 8.284397415210774 31.74398151084257 198.3726634574546 18.4564779129486 411.6817572294998 14.84428005528544 13.73832039609447 P-Cho B_8 32.96450337495778 57.68220002528643 47.5235734728572 12.52972403608863 39.38836293251575 6.904452049872972 97.0189032800551 P-Cho B_9 25.75217248230207 30.37305957496627 23.83745616689483 23.96469705267452 43.48744248743169 Phe-2,6_1 223.4540080344229 46.47726413021935 88.12952553344942 69.55334926706115 55.0974172310188 29.70428956871762 141.4584928544274 59.21918623152532 116.9972335075573 65.73872166459442 105.2371821630696 133.3196691092848 114.049479819898 28.19538996690376 Phe-2,6_2 165.8679317670711 27.12315344900836 52.35855401102567 43.03354309604287 32.85598105179629 24.34567260553563 102.8722258891724 35.63561153316274 88.43894566762506 34.57727956303896 102.1579593740276 89.3754878603827 111.937226452289 15.54016564634817 Phe-3,5_1 139.8127251750017 31.05807329655898 51.55276703280343 51.81654372557281 36.21941863977936 22.13446144508218 100.3518653984422 31.26207315958183 89.94538887274315 40.94335009608808 73.93712906310743 92.41646304123388 99.44882467532986 15.93170484533119 Phe-3,5_2 191.7706595971017 36.39487633306816 68.9067535973184 63.47131762064964 38.59135756273653 25.88569041092271 136.496600366143 50.11104310335215 114.8402299952258 48.71377178174628 99.42275270818125 109.7091810658762 122.5901730789142 12.97108476053051 Phe-3,5_3 65.87591061422206 16.38893823913245 28.23449878036361 28.3541643425321 15.06290546930993 12.6680535 44.57924152906768 21.10911622987951 49.83831887272241 22.93577349167667 36.80806440093251 41.05039967923479 53.64971539454949 9.722381 Pro-5 A_1 217.599058006901 235.7116281078365 444.856219173845 611.5555220974347 251.6847335305658 282.8752452361597 1316.389685032772 344.1168801575678 274.5905425219137 422.4581183950227 1486.176115240956 558.7086501927371 1633.58923974095 19.63637971729505 161.6063962163547 Pro-5 A_2 256.2005997392779 137.7833784191907 581.1191292169976 693.0965527923399 183.5675234323137 261.598939819082 914.998350199273 354.8543853030794 467.9810427655884 349.207410429621 602.167465147581 755.915769830669 775.9651588558244 20.32147685290384 153.4205334566948 Pro-5 A_3 164.3078253438279 192.3768581998905 658.5606617067791 688.5393087912502 214.5904683460724 275.8090103656887 957.4299891078473 387.5796035506353 781.3882361435025 367.5656188178895 505.6205724311019 762.3443747322765 706.1504735402125 37.53743869942524 147.6832279684602 Pro-5 A_4 191.1941075338387 195.8331429758834 772.1816958528161 676.0187603789951 263.9930184847681 304.8496914511524 1044.106659278778 444.946032630892 798.6255133761823 453.9337741987799 656.6835016321314 1002.40909925162 875.0330756193182 35.47094441564257 160.9194941944605 Pro-5 A_5 156.7446122217396 196.5570413593185 627.0269646707707 723.2628488055943 227.3953834187541 280.2347848089484 1014.650019446261 397.8313290871561 1048.998703596129 506.7960904144449 682.4658378511344 1225.317790477914 896.7250552549235 132.5723913481266 Pro-5 A_6 53.86996832189745 181.9175996493204 443.2049518104891 210.0842584293435 206.0299906287413 46.37684225007011 256.1228364611195 150.2830203685399 966.8389613684186 335.3656831718745 217.0089426796135 839.9638358223401 285.4067317952196 71.25999021338913 Pro-5 A_7 41.32288815166911 277.8619302871944 841.0910509243889 Pro-5 A_8 50.16661558793149 Ser-2_1 275.3351652729064 392.8410402505331 812.2810611756172 397.2071060294352 501.9591470396891 231.3473715079483 46.15764171218804 305.8482443550343 919.8587351568807 624.7438312902475 445.1508080151561 1080.483836891265 750.470406809584 39.91626268807457 157.6015771858042 Ser-2_2 496.8339708588038 73.14479235059738 206.4692582673079 19.62319582397127 74.12043080179771 87.64925313068787 462.4773649820481 118.3284804879457 1382.47896388708 682.7079117990424 199.2284869069286 270.9861710555884 1160.685702042454 84.61500261903917 75.98759249983576 Ser-2_3 350.8185821552375 92.16427938330423 650.4387112949472 488.5784077350618 598.5183765994302 261.4544176448088 429.096014037978 372.1527208592804 1416.072858324216 969.1210457789612 686.3580188541624 1262.055141841128 770.7907377628195 25.23347622524179 241.4730102172551 Ser-2_4 330.0764702126478 347.6028906687058 1250.054756970118 558.8717985142412 802.4511400908591 344.863331873658 727.5831191389274 377.7186837813395 1213.630105316624 827.779112026786 864.1542394835154 1912.251139090403 1132.997674637414 37.76908537924984 266.7459587033247 Ser-2_5 569.7175553861639 595.8789509861247 1073.406012926196 471.450410918666 538.6503348887366 307.8648422600727 854.4624611238047 339.3708690696449 1581.853302242946 604.0681791430184 684.5714879832452 1557.603706952021 1106.720374627832 98.86829699897388 185.4056034325405 Ser-2_6 283.1443091981457 553.8884724160051 761.9797473354606 448.1612078364554 865.118621522463 263.5499201567566 853.851603202616 593.7207617613909 884.6448174392891 202.8233643766055 1236.629751549158 1108.164171558392 661.5420771657292 26.86187850704528 373.8032962223064 Ser-2_7 5.076874639059286 381.195972932499 216.5298160115929 106.9256107567336 363.169143294882 70.7504970401574 661.1283929645954 245.6921331433664 494.6280063400985 649.3202051003975 384.058158726047 145.5084103115518 Ser-2_8 104.3712721833823 616.4769529473348 274.7914064114851 7.859593174993327 298.0664085104109 28.05822045774445 975.7978901224106 Ser-2_9 325.9578734347032 195.4579848303052 507.8995269897864 Succinate-2,3_1 155.4413714515622 135.7342645750292 255.5990623703094 275.7701554057568 141.9269256502099 107.3617609062789 468.2729390821507 139.7339721444634 266.0949862587875 148.7856252198584 283.243191766692 328.442580626391 206.4532073370372 25.46680577004097 59.36514339803657 Tau-1 (SCH2)_1 1906.350527790205 5693.085272449555 11138.16854030527 6662.71459391833 7746.338159543985 4254.200726274736 6586.234791432548 4696.198463232385 3301.264786268076 13804.01694129064 3342.877755178347 19082.21684267255 4210.695407834183 335.0930024414852 1337.262174802885 Tau-1 (SCH2)_2 4366.820703150295 3438.40776816973 6653.121380200536 4014.501731086051 4161.7214158773 3593.19578299768 4105.987735022257 2803.422620951952 11120.24293214968 5221.778243844834 7791.732265545457 9549.964053548774 10277.10010513266 575.9408999720162 2627.261562771979 Tau-1 (SCH2)_3 2438.967150532454 3438.40776816973 6653.121380200536 2119.988286244813 4161.7214158773 2254.174094665372 4105.987735022257 2803.422620951952 6479.40629824291 5221.778243844834 4293.217535007891 9549.964053548774 5593.203872951827 333.2791929833099 1559.312595902107 Tau-2 (NCH2)_1 2439.885984383551 3284.51270043043 6459.25782122138 3994.667320895621 4163.763158156659 2092.498693385968 6332.899711862795 2687.412508007639 6411.53660720305 5416.409666250115 4457.38479406876 9973.767089038065 5869.222538342585 355.7239438915246 1523.676834753773 Tau-2 (NCH2)_2 4392.040782838734 5567.60895190545 11176.02464987009 6607.42837396382 7282.15551481615 3604.289425910712 11090.02980407076 4658.506838077195 11811.62284583728 9246.994609578305 7763.248938596314 16293.63960644197 10476.30816796146 618.792146403584 2608.901030497993 Tau-2 (NCH2)_3 1779.518184 2327.663519111643 4674.877078181657 2698.031987796242 2923.675787155044 1524.49287178541 4727.639095769193 1905.980599160622 4726.2571805 3594.802690508364 3518.30963807804 6953.563601433945 4404.671059869652 257.4219967062901 1115.914986983885 Thr_1 186.4570654903893 109.0716777844667 324.0651041331365 307.2347355574166 172.509697649787 102.978223472008 526.1500462240057 296.8141828026067 530.1806712520057 171.3727039609556 279.3571437849569 465.1871670711973 634.868584510249 78.779127263665 Thr_2 274.9443398208388 109.0716777844667 324.0651041331365 98.78281502306031 172.509697649787 164.497687016714 214.5798935158896 313.174632855951 629.1188861511547 171.3727039609556 321.5893382367845 465.1871670711973 660.9940032134937 82.31171278155387 Trp-4_1 51.61638837020047 15.63332154579185 38.86708827723675 28.83974927146294 46.466965 18.97127147398427 38.49884229368193 99.0747427982762 102.8293558458443 44.822615 50.79091127635968 64.45190489035446 Trp-4_2 31.17584299423807 16.29370144298067 27.96486501974068 22.47467875297572 47.35061 14.59183861582957 35.57474784815608 96.23947559727594 55.20742546279373 49.538734 65.15410268832821 72.08928738038995 Tyr-2,6_1 176.993065 43.67329502565926 94.6758258167835 63.26738072250055 45.02354258968626 32.98896178007177 140.0811000194806 74.60122818983297 114.8325279816729 44.05871788118015 69.10368661410732 167.4693058726525 106.1732103545309 15.24416971958357 Tyr-2,6_2 184.662646 50.91249331432054 94.08044458460283 67.07005777847888 41.42858138083454 38.36355308934276 130.5586428093592 76.20565957426217 110.1714547443286 41.5648501967766 78.8970921299417 169.24044802926 87.98497128192379 15.03943654954483 Tyr-3,5_1 193.4989518504927 31.103786983348 78.836450780174 52.9865297360649 36.52705565827711 25.66791606221429 114.9149779605035 63.86645918456775 106.2012064471744 40.3640481441918 69.1564447334404 160.9533861001954 90.098979477389 12.72400056454356 12.4493052544372 Tyr-3,5_2 160.1381127820463 38.17729903378874 83.13812814245264 69.12462612372224 37.51953012021027 31.90876281999304 142.0722448717115 70.04556340986944 100.9612884912522 45.01003309166565 75.63294419454299 138.0891162626335 104.2094063169871 8.703121600041628 19.35034115940021 UXP-1'_1 167.053316973404 122.8478072722545 292.9693964754088 88.88361181602914 124.3877467033418 174.8905663079301 55.33266304826424 88.57510295123734 317.597565837908 67.29417571901863 UXP-1'_2 167.053316973404 30.83253624572563 69.15242683118817 245.794390689523 55.33266304826424 88.57510295123734 171.3733249885278 UXP-5_1 46.28172265750325 44.01004682682287 100.8788241488568 92.47504124514313 101.1790694618452 39.94464676760568 136.2491637494699 33.8158283182808 82.81048717548921 72.19043766542104 67.24575856709133 110.38849055439 88.30298408153902 23.05501610489565 UXP-5_2 26.50126840876026 38.46958092253367 76.62371883138474 31.27846994897931 97.64450773770702 21.33864089663554 66.70476038579476 30.00309674549561 44.762656727859 56.99524931876934 30.90106583308367 94.66969219195329 38.34937882642845 12.56861174535391 UXP-5_3 66.01224146509817 141.4377885907097 70.32937974277513 123.5932086703062 UXP-5_4 65.7841689675245 UXP-6_1 175.7224074574727 92.58994448228965 134.2588788712885 144.9916297705169 147.0214345378403 33.75026509787312 314.1690711545323 81.86246532059495 86.88689126942629 95.02753587557439 54.01415053420759 148.2349192534026 68.77543467243693 43.98491656341532 UXP-6_2 168.6898688476351 86.24286886960991 118.7804814344699 99.82875177433878 176.7197057137374 20.35100634972758 316.6633105684958 66.93957924825301 74.41109665739111 91.11686761236982 26.40411171781826 116.1092287765138 62.63114878920872 36.25166388094237 UXP-6_3 264.007171584468 Val-B_1 172.1017806411838 93.03992022884921 199.3834879280715 164.0995173215612 112.8593192966061 77.38500272691464 310.7734790335977 130.0252569371546 330.232143766561 152.2602261966109 204.7257158664867 371.6615018384798 340.6460859799147 6.38810397011961 50.010178 Val-B_2 179.621959634931 102.98584012642 230.9891904287776 169.8180543726999 131.6147813815073 78.57119141291754 328.1638291768563 151.5772040617367 336.9991195190615 173.3235845042551 224.1916015189259 407.3082305125048 350.1205976046165 5.752504075598613 57.95255599999999 aGlc 13C-A_1 389.1920033517057 1723.384059591627 1000.313205979091 1105.363016655289 121.1063749645945 450.878314622881 aGlc 13C-B_1 1318.836445714286 677.2343028571429 153.7264114285714 2454.704359375685 392.9782 1009.088388571429 558.1777085714286 875.7046077623763 1363.928522355229 aGlc_1 265.6554918398891 95.48069996818782 249.4325075362553 191.0460410777706 88.93045018348717 79.28874325817684 508.3735848780677 65.79918571428571 65.9399142857143 93.65427823563066 107.9973114285714 139.3472007196168 9.269565714285715 23.23898 aGlc_2 304.4816215995042 111.096668622863 299.2549649653517 272.6996093575747 120.0263783607858 82.02764148508717 568.1095287063129 101.3097414779482 129.82068 146.8185982883354 56.22693142857143 248.0454329813387 13.23824285714286 70.05547215772307 bGlc 13C-A_1 106.0860005875572 368.0138674400976 727.248489738913 439.1079016300935 454.193546000843 137.7081957877297 447.3538536322876 163.1891700225618 349.4917291526709 562.9652611698468 324.2167477839036 976.8400117338882 272.0294818320604 105.4900087040001 913.0954921182532 bGlc 13C-A_2 608.3431513067045 1044.807578344937 1797.426598746509 629.7896701695574 971.6147815134498 558.9045663701731 1173.855082726594 480.5735677489562 1192.107572867531 1709.994265081715 1150.571441129928 2784.563486839048 1418.340062979366 76.94633188125225 bGlc 13C-A_3 570.5996898648251 1014.899832851249 2722.271902007512 710.6358199211355 1119.659290830973 331.9501531738064 1277.792658829733 194.70579624558 1142.752691240031 2221.855748606555 1104.464082696659 2833.572149516247 1172.982982752508 bGlc 13C-A_4 470.222500283157 873.9564150011887 503.523399949618 429.7632399912173 749.7659453804761 196.1261558374172 340.4234737756918 651.083994160392 274.5664999780653 903.2505376572359 bGlc_1 169.5495447531421 511.5839990970078 255.2012018040967 402.4729282968344 322.0576191329332 56.38438012008339 365.8198017462411 199.6352226450784 1407.291913558286 366.3343915149547 790.476692447757 174.1985830769231 914.8088967493833 17.4468369753184 508.1597975260794 bGlc_2 244.7027136372241 175.4019727214579 1110.100678927356 228.0460473202472 299.9954754211864 87.14401233530862 501.4235444397455 61.40841706183815 79.40602429985306 631.1204704325238 118.2474685703267 174.1985830769231 30.3186211448811 59.97916078007566 bOH-butyrate_1 10.36802333333333 bOH-butyrate_2 21.5217704591015 m-Ins-1,3_1 146.7811041075188 159.0626164095827 294.3302076856073 305.9000678764591 206.5481664335453 97.77370529472361 750.3586885561831 267.8293903072137 180.4803404885665 283.9884686809615 135.0787717743061 381.7737590997154 194.3851892707715 14.14654123437687 184.3801230269064 m-Ins-1,3_2 137.9439633726411 192.0082138387794 368.1865153592882 298.4304200133813 232.2562560960222 455.2706886602822 838.0530094304211 631.7921017316963 239.251814329723 317.7960647534435 132.4439328067973 449.7671004964532 145.8927188485142 14.55083114295203 318.1466397389628 m-Ins-1,3_3 185.1298774383625 210.3074689247976 311.9282253149444 356.2931138366818 256.2467616125772 109.4899740380749 720.3061146092674 302.5744939909334 316.0563108875488 411.5571417374711 126.9889511299611 804.9484322691866 101.7898939905809 39.07332015324027 52.80437143003426 m-Ins-1,3_4 250.5687555059029 370.5668725466678 569.2307561691849 605.5033625956659 396.6560050351502 172.9255564054775 1000.674473034301 386.1357757992149 460.7981572628711 364.5500916790174 159.2673517925925 608.6646057506455 190.7857536276648 121.146647371892 m-Ins-2?_1 67.57639304986917 153.9153585621425 282.7717024466322 233.8832505860736 189.8384274282448 75.87101519384285 497.7154248738055 181.2947761684054 98.82802375503762 242.0399096496531 56.78619141204245 417.4838102474229 66.7953111620876 39.20041619643538 37.97471942398881 m-Ins-2?_2 201.3334987578599 384.6848532501589 701.0806847221287 708.4161958533309 462.0277998458173 240.3456163720321 1291.549491686329 549.6531220991052 369.6774495039266 630.6944132105332 227.4997361885474 1068.088960006747 285.5787862443939 132.4864066591655 m-Ins-2?_3 152.995268075531 239.8071720654483 462.8262269861747 379.811853449749 275.9285762827844 174.5081608575814 685.4735331813627 311.3549763914291 256.3189280603135 375.420126178077 259.0340430871482 578.6666918582589 242.4405950000855 109.7973323574126 pyruvate-3_1 14.46232349914288 16.31981413024922 42.41773886446047 25.63079025301125 19.96031715200143 14.04207697267729 32.77062774718315 16.89130382974319 38.1751401280169 21.52793802026115 35.24947092593673 45.41020213768383 33.31652358147164 5.099508842648947 NMR_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name base_inchi isotopic_inchi peak_description peak_pattern proton_count representative_inchi transient_peak transient_peak%type AXP-1' 13C-A_1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] ['InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i7H,10+1H/fC10H12N5O7P/h11H2/q-2', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/i7H,10+1H/fC10H12N5O10P2/h11H2/q-3', ' InChI=1/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1/i7H,10+1H/fC10H12N5O13P3/h11H2/q-4'] ['[1H31:C10]HResonance + [1H31:13C10]J1CH + [1H31:1H30]J3HH', ' [1H35:13C10]HResonance + [1H35:13C10]J1CH + [1H35:1H34]J3HH', ' [1H39:13C10]HResonance + [1H39:13C10]J1CH + [1H39:1H38]J3HH'] multiplets 0.5 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 1 integer AXP-1' 13C-B_1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] ['InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i7H,10+1H/fC10H12N5O7P/h11H2/q-2', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/i7H,10+1H/fC10H12N5O10P2/h11H2/q-3', ' InChI=1/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1/i7H,10+1H/fC10H12N5O13P3/h11H2/q-4'] ['[1H31:C10]HResonance + [1H31:13C10]J1CH + [1H31:1H30]J3HH', ' [1H35:13C10]HResonance + [1H35:13C10]J1CH + [1H35:1H34]J3HH', ' [1H39:13C10]HResonance + [1H39:13C10]J1CH + [1H39:1H38]J3HH'] multiplets 0.5 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 1 integer AXP-1'_1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] ['InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O7P/h11H2/q-2', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O10P2/h11H2/q-3', ' InChI=1/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O13P3/h11H2/q-4'] ['[1H31:C10]HResonance + [1H31:1H30]J3HH', ' [1H35:C10]HResonance + [1H35:1H34]J3HH', ' [1H39:C10]HResonance + [1H39:1H38]J3HH'] doublets 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 1 integer AXP-1'_2 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] ['InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O7P/h11H2/q-2', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O10P2/h11H2/q-3', ' InChI=1/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O13P3/h11H2/q-4'] ['[1H31:C10]HResonance + [1H31:1H30]J3HH', ' [1H35:C10]HResonance + [1H35:1H34]J3HH', ' [1H39:C10]HResonance + [1H39:1H38]J3HH'] doublets 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 2 integer AXP-1'_3 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] ['InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O7P/h11H2/q-2', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O10P2/h11H2/q-3', ' InChI=1/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O13P3/h11H2/q-4'] ['[1H31:C10]HResonance + [1H31:1H30]J3HH', ' [1H35:C10]HResonance + [1H35:1H34]J3HH', ' [1H39:C10]HResonance + [1H39:1H38]J3HH'] doublets 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 3 integer AXP-1'_4 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] ['InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O7P/h11H2/q-2', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O10P2/h11H2/q-3', ' InChI=1/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1/i7H,10H/fC10H12N5O13P3/h11H2/q-4'] ['[1H31:C10]HResonance + [1H31:1H30]J3HH', ' [1H35:C10]HResonance + [1H35:1H34]J3HH', ' [1H39:C10]HResonance + [1H39:1H38]J3HH'] doublets 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 4 integer AXP-2_1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i2H/fC10H12N5O7P/h11H2/q-2 [1H26:C2]HResonance singlet 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 1 integer AXP-2_2 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i2H/fC10H12N5O7P/h11H2/q-2 [1H26:C2]HResonance singlet 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 2 integer AXP-2_3 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i2H/fC10H12N5O7P/h11H2/q-2 [1H26:C2]HResonance singlet 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 3 integer AXP-2_4 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i2H/fC10H12N5O7P/h11H2/q-2 [1H26:C2]HResonance singlet 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 4 integer AXP-2_5 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i2H/fC10H12N5O7P/h11H2/q-2 [1H26:C2]HResonance singlet 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 5 integer AXP-8_1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] ['InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i3H/fC10H12N5O7P/h11H2/q-2', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/i3H/fC10H12N5O10P2/h11H2/q-3', ' InChI=1/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1/i3H/fC10H12N5O13P3/h11H2/q-4'] ['[1H27:C3]Hresonance', ' [1H30:C2]Hresonance', ' [1H35:C3]Hresonance'] singlet 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 1 integer AXP-8_2 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] ['InChI=1/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1/i3H/fC10H12N5O7P/h11H2/q-2', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/i3H/fC10H12N5O10P2/h11H2/q-3', ' InChI=1/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1/i3H/fC10H12N5O13P3/h11H2/q-4'] ['[1H27:C3]Hresonance', ' [1H30:C2]Hresonance', ' [1H35:C3]Hresonance'] singlet 1 ['InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/p-2/t4-,6-,7-,10-/m1/s1', ' InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/p-3/t4-,6-,7-,10-/m1/s1/fC10H12N5O10P2/h11H2/q-3', ' InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,6-,7-,10-/m1/s1'] 2 integer Ace-2_1 InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1 InChI=1/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1/i1H3/fC2H3O2/q-1 ['[1H5', '1H6', '1H7:C1]HResonance'] singlet 3 InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1 1 integer Ala-3_1 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:1H10]J3HH'] doublets 3 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 1 integer Ala-3_2 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:1H10]J3HH'] doublets 3 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 2 integer Ala13C-A_1 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 1 integer Ala13C-A_2 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 2 integer Ala13C-A_3 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 3 integer Ala13C-A_4 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 4 integer Ala13C-A_5 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 5 integer Ala13C-A_6 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 6 integer Ala13C-A_7 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 7 integer Ala13C-B_1 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 1 integer Ala13C-B_2 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 2 integer Ala13C-B_3 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 3 integer Ala13C-B_4 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 4 integer Ala13C-B_5 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 5 integer Ala13C-B_6 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1H3,2H/f/h4H ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH + [1H7', '1H8', '1H9:1H10]J3HH'] ddd 1.5 InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/f/h4H 6 integer Asp-3a_1 InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/i1H2,2H/fC4H6NO4/h5H/q-1 ['1H10', '1H11:C1]HResonance + [1H10:1H11]J2HH + [1H10', '1H11:1H12]J3HH'] dd 1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/fC4H6NO4/h5H/q-1 1 integer Asp-3a_2 InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/i1H2,2H/fC4H6NO4/h5H/q-1 ['1H10', '1H11:C1]HResonance + [1H10:1H11]J2HH + [1H10', '1H11:1H12]J3HH'] dd 1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/fC4H6NO4/h5H/q-1 2 integer Asp-3a_3 InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/i1H2,2H/fC4H6NO4/h5H/q-1 ['1H10', '1H11:C1]HResonance + [1H10:1H11]J2HH + [1H10', '1H11:1H12]J3HH'] dd 1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/fC4H6NO4/h5H/q-1 3 integer Asp-3a_4 InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/i1H2,2H/fC4H6NO4/h5H/q-1 ['1H10', '1H11:C1]HResonance + [1H10:1H11]J2HH + [1H10', '1H11:1H12]J3HH'] dd 1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/fC4H6NO4/h5H/q-1 4 integer Asp-3b_1 InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/i1H2,2H/fC4H6NO4/h5H/q-1 ['1H10', '1H11:C1]HResonance + [1H10:1H11]J2HH + [1H10', '1H11:1H12]J3HH'] dd 1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/fC4H6NO4/h5H/q-1 1 integer Asp-3b_2 InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/i1H2,2H/fC4H6NO4/h5H/q-1 ['1H10', '1H11:C1]HResonance + [1H10:1H11]J2HH + [1H10', '1H11:1H12]J3HH'] dd 1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/fC4H6NO4/h5H/q-1 2 integer Asp-3b_3 InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/i1H2,2H/fC4H6NO4/h5H/q-1 ['1H10', '1H11:C1]HResonance + [1H10:1H11]J2HH + [1H10', '1H11:1H12]J3HH'] dd 1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/fC4H6NO4/h5H/q-1 3 integer Asp-3b_4 InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/i1H2,2H/fC4H6NO4/h5H/q-1 ['1H10', '1H11:C1]HResonance + [1H10:1H11]J2HH + [1H10', '1H11:1H12]J3HH'] dd 1 InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1/t2-/m0/s1/fC4H6NO4/h5H/q-1 4 integer CXP-6_1 ['InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N3O11P2/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H16N3O14P3/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H2,10,11,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H12N3O8P/h10H2/q-2', ' InChI=1/C9H15N3O11P2/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H12N3O11P2/h10H2/q-3', ' InChI=1/C9H16N3O14P3/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H2,10,11,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H12N3O14P3/h10H2/q-4'] ['[1H23:C2]HResonance + [1H23:1H22]J3HH', ' [1H27:C2]HResonance + [1H27:1H26]J3HH', ' [1H31:C2]HResonance + [1H31:1H30]J3HH'] doublets 1 ['InChI=1/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H12N3O8P/h10H2/q-2', ' InChI=1/C9H15N3O11P2/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H12N3O11P2/h10H2/q-3', ' InChI=1/C9H16N3O14P3/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H2,10,11,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H12N3O14P3/h10H2/q-4'] 1 integer CXP-6_2 ['InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N3O11P2/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H16N3O14P3/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H2,10,11,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H12N3O8P/h10H2/q-2', ' InChI=1/C9H15N3O11P2/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H12N3O11P2/h10H2/q-3', ' InChI=1/C9H16N3O14P3/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H2,10,11,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H12N3O14P3/h10H2/q-4'] ['[1H23:C2]HResonance + [1H23:1H22]J3HH', ' [1H27:C2]HResonance + [1H27:1H26]J3HH', ' [1H31:C2]HResonance + [1H31:1H30]J3HH'] doublets 1 ['InChI=1/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H12N3O8P/h10H2/q-2', ' InChI=1/C9H15N3O11P2/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H12N3O11P2/h10H2/q-3', ' InChI=1/C9H16N3O14P3/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H2,10,11,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H12N3O14P3/h10H2/q-4'] 2 integer Creat_1 InChI=1S/C4H9N3O2/c1-7(4(5)6)2-3(8)9/h2H2,1H3,(H3,5,6)(H,8,9) InChI=1S/C4H9N3O2/c1-7(4(5)6)2-3(8)9/h2H2,1H3,(H3,5,6)(H,8,9)/i1H3 ['[1H10', '1H11', '1H12:C1]HResonance'] singlet 3 InChI=1S/C4H9N3O2/c1-7(4(5)6)2-3(8)9/h2H2,1H3,(H3,5,6)(H,8,9) 1 integer Cys-3-GSH_1 InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1 InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i4H2,6H/fC10H16N3O6S/h11-13H/q-1 ['[1H27', '1H28:C4]HResonance + [1H27', '1H28:1H30]J3HH'] triplet 2 InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1 1 integer Cys-3-GSH_2 InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1 InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i4H2,6H/fC10H16N3O6S/h11-13H/q-1 ['[1H27', '1H28:C4]HResonance + [1H27', '1H28:1H30]J3HH'] triplet 2 InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1 2 integer Cys-3-GSH_3 InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1 InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i4H2,6H/fC10H16N3O6S/h11-13H/q-1 ['[1H27', '1H28:C4]HResonance + [1H27', '1H28:1H30]J3HH'] triplet 2 InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1 3 integer Cys-3-GSH_4 InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1 InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i4H2,6H/fC10H16N3O6S/h11-13H/q-1 ['[1H27', '1H28:C4]HResonance + [1H27', '1H28:1H30]J3HH'] triplet 2 InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1 4 integer DSS_1 InChI=1S/C6H16O3SSi/c1-11(2,3)6-4-5-10(7,8)9/h4-6H2,1-3H3,(H,7,8,9)/i4D2,5D2,6D2 InChI=1/C6H16O3SSi/c1-11(2,3)6-4-5-10(7,8)9/h4-6H2,1-3H3,(H,7,8,9)/p-1/i1H3,2H3,3H3,4D2,5D2,6D2/fC6H15O3SSi/q-1 ['[1H12', '1H13', '1H14:C1+1H15', '1H16', '1H17:C2+1H18', '1H19', '1H20:C3]Hresonance'] Singlet 9 InChI=1/C6H16O3SSi/c1-11(2,3)6-4-5-10(7,8)9/h4-6H2,1-3H3,(H,7,8,9)/p-1/i4D2,5D2,6D2/fC6H15O3SSi/q-1 1 integer For_1 InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)/p-1 InChI=1/CH2O2/c2-1-3/h1H,(H,2,3)/p-1/i1H/fCHO2/q-1 [1H4:C1]Hresonance singlet 1 InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)/p-1 1 integer Fum_1 InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/p-2/b2-1+ InChI=1/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/p-2/b2-1+/i1H,2H/fC4H2O4/q-2 [1H9:C1+1H10:C2]Hresonance singlet 2 InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/p-2/b2-1+ 1 integer GSH+GSSG-3_1 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2,5H/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2,,9H,10H/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H21,1H22:C1]HResonance + [1H21,1H22:1H23,1H24]J3HH + [1H21,1H22:1H29]J3HH', ' [1H41,1H42:C1+1H43,1H44:C2]HResonance + [1H41,1H42:1H45,1H46]J3HH + [1H41,1H42:1H57]J3HH + [1H43,1H44:1H47,1H48]J3HH + [1H43,1H44:1H58]J3HH'] multiplets 2 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 1 integer GSH+GSSG-3_2 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2,5H/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2,,9H,10H/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H21,1H22:C1]HResonance + [1H21,1H22:1H23,1H24]J3HH + [1H21,1H22:1H29]J3HH', ' [1H41,1H42:C1+1H43,1H44:C2]HResonance + [1H41,1H42:1H45,1H46]J3HH + [1H41,1H42:1H57]J3HH + [1H43,1H44:1H47,1H48]J3HH + [1H43,1H44:1H58]J3HH'] multiplets 2 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 2 integer GSH+GSSG-3_3 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2,5H/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2,,9H,10H/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H21,1H22:C1]HResonance + [1H21,1H22:1H23,1H24]J3HH + [1H21,1H22:1H29]J3HH', ' [1H41,1H42:C1+1H43,1H44:C2]HResonance + [1H41,1H42:1H45,1H46]J3HH + [1H41,1H42:1H57]J3HH + [1H43,1H44:1H47,1H48]J3HH + [1H43,1H44:1H58]J3HH'] multiplets 2 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 3 integer GSH+GSSG-3_4 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2,5H/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2,,9H,10H/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H21,1H22:C1]HResonance + [1H21,1H22:1H23,1H24]J3HH + [1H21,1H22:1H29]J3HH', ' [1H41,1H42:C1+1H43,1H44:C2]HResonance + [1H41,1H42:1H45,1H46]J3HH + [1H41,1H42:1H57]J3HH + [1H43,1H44:1H47,1H48]J3HH + [1H43,1H44:1H58]J3HH'] multiplets 2 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 4 integer GSH+GSSG-4_1 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 1 integer GSH+GSSG-4_10 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 10 integer GSH+GSSG-4_11 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 11 integer GSH+GSSG-4_12 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 12 integer GSH+GSSG-4_13 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 13 integer GSH+GSSG-4_14 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 14 integer GSH+GSSG-4_15 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 15 integer GSH+GSSG-4_16 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 16 integer GSH+GSSG-4_2 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 2 integer GSH+GSSG-4_3 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 3 integer GSH+GSSG-4_4 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 4 integer GSH+GSSG-4_5 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 5 integer GSH+GSSG-4_6 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 6 integer GSH+GSSG-4_7 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 7 integer GSH+GSSG-4_8 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 8 integer GSH+GSSG-4_9 ['InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1', ' InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2'] ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/i1H2,2H2/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i1H2,2H2,3H2,4H2/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] ['[1H23,1H24:C2]HResonance + [1H23:1H24]J2HH + [1H23,1H24:1H21,1H22]J3HH', ' [1H45,1H46:C3+1H47,1H48:C4]HResonance + [1H45:1H46]J2HH + [1H45,1H46:1H41,1H42]J3HH + [1H47:1H48]J2HH + [1H47,1H48:1H43,1H44]J3HH'] multiplets 4 ['InChI=1/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1/fC10H16N3O6S/h11-13H/q-1', ' InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2'] 9 integer GSSG-12_1 InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2 InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i7H2,8H2,11H,12H/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2 ['[1H59:C11+1H60:C12]HResonance + [1H59:1H53', '1H54]J3HH + [1H60:1H55', '1H56]J3HH'] q 0.5 InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2 1 integer GSSG-12_2 InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2 InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i7H2,8H2,11H,12H/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2 ['[1H59:C11+1H60:C12]HResonance + [1H59:1H53', '1H54]J3HH + [1H60:1H55', '1H56]J3HH'] q 0.5 InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2 2 integer GSSG-12_3 InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2 InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i7H2,8H2,11H,12H/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2 ['[1H59:C11+1H60:C12]HResonance + [1H59:1H53', '1H54]J3HH + [1H60:1H55', '1H56]J3HH'] q 0.5 InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2 3 integer GSSG-12_4 InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2 InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/i7H2,8H2,11H,12H/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2 ['[1H59:C11+1H60:C12]HResonance + [1H59:1H53', '1H54]J3HH + [1H60:1H55', '1H56]J3HH'] q 0.5 InChI=1/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/p-2/t9-,10-,11-,12-/m0/s1/fC20H30N6O12S2/h21-22,27-28,33-34H/q-2 4 integer Gln+Glu-2_1 ['InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1', ' InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1'] ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,3H/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,3H/fC5H8NO4/h6H/q-1'] ['[1H15:C3]HResonance + [1H15:1H11,1H12]J3HH', ' [1H15:C3]HResonance + [1H15:1H11,1H12]J3HH'] triplet 3 ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1'] 1 integer Gln+Glu-2_10 ['InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1', ' InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1'] ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,3H/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,3H/fC5H8NO4/h6H/q-1'] ['[1H15:C3]HResonance + [1H15:1H11,1H12]J3HH', ' [1H15:C3]HResonance + [1H15:1H11,1H12]J3HH'] triplet 3 ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1'] 10 integer Gln+Glu-2_2 ['InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1', ' InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1'] ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,3H/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,3H/fC5H8NO4/h6H/q-1'] ['[1H15:C3]HResonance + [1H15:1H11,1H12]J3HH', ' [1H15:C3]HResonance + [1H15:1H11,1H12]J3HH'] triplet 3 ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1'] 2 integer Gln+Glu-2_3 ['InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1', ' InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1'] ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,3H/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,3H/fC5H8NO4/h6H/q-1'] ['[1H15:C3]HResonance + [1H15:1H11,1H12]J3HH', ' [1H15:C3]HResonance + [1H15:1H11,1H12]J3HH'] triplet 3 ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1'] 3 integer Gln+Glu-2_4 ['InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1', ' InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1'] ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,3H/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,3H/fC5H8NO4/h6H/q-1'] ['[1H15:C3]HResonance + [1H15:1H11,1H12]J3HH', ' [1H15:C3]HResonance + [1H15:1H11,1H12]J3HH'] triplet 3 ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1'] 4 integer Gln+Glu-2_5 ['InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1', ' InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1'] ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,3H/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,3H/fC5H8NO4/h6H/q-1'] ['[1H15:C3]HResonance + [1H15:1H11,1H12]J3HH', ' [1H15:C3]HResonance + [1H15:1H11,1H12]J3HH'] triplet 3 ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1'] 5 integer Gln+Glu-2_6 ['InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1', ' InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1'] ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,3H/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,3H/fC5H8NO4/h6H/q-1'] ['[1H15:C3]HResonance + [1H15:1H11,1H12]J3HH', ' [1H15:C3]HResonance + [1H15:1H11,1H12]J3HH'] triplet 3 ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1'] 6 integer Gln+Glu-2_7 ['InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1', ' InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1'] ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,3H/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,3H/fC5H8NO4/h6H/q-1'] ['[1H15:C3]HResonance + [1H15:1H11,1H12]J3HH', ' [1H15:C3]HResonance + [1H15:1H11,1H12]J3HH'] triplet 3 ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1'] 7 integer Gln+Glu-2_8 ['InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1', ' InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1'] ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,3H/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,3H/fC5H8NO4/h6H/q-1'] ['[1H15:C3]HResonance + [1H15:1H11,1H12]J3HH', ' [1H15:C3]HResonance + [1H15:1H11,1H12]J3HH'] triplet 3 ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1'] 8 integer Gln+Glu-2_9 ['InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1', ' InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1'] ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,3H/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,3H/fC5H8NO4/h6H/q-1'] ['[1H15:C3]HResonance + [1H15:1H11,1H12]J3HH', ' [1H15:C3]HResonance + [1H15:1H11,1H12]J3HH'] triplet 3 ['InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+', ' InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1'] 9 integer Gln-4_1 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 1 integer Gln-4_10 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 10 integer Gln-4_11 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 11 integer Gln-4_12 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 12 integer Gln-4_13 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 13 integer Gln-4_14 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 14 integer Gln-4_2 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 2 integer Gln-4_3 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 3 integer Gln-4_4 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 4 integer Gln-4_5 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 5 integer Gln-4_6 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 6 integer Gln-4_7 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 7 integer Gln-4_8 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 8 integer Gln-4_9 InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i1H2,2H2/f/h6-8H/b7-4+ ['[1H13', '1H14:C2]HResonance + [1H13', '1H14:1H11', '1H12]J3HH'] ddd 2 InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/f/h6-8H/b7-4+ 9 integer Glu-3-a_1 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 1 integer Glu-3-a_10 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 10 integer Glu-3-a_11 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 11 integer Glu-3-a_12 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 12 integer Glu-3-a_13 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 13 integer Glu-3-a_14 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 14 integer Glu-3-a_15 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 15 integer Glu-3-a_16 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 16 integer Glu-3-a_2 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 2 integer Glu-3-a_3 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 3 integer Glu-3-a_4 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 4 integer Glu-3-a_5 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 5 integer Glu-3-a_6 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 6 integer Glu-3-a_7 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 7 integer Glu-3-a_8 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 8 integer Glu-3-a_9 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2,3H/fC5H8NO4/h6H/q-1 ['[1H11', '1H12:C1]HResonance + [1H11:1H12]J2HH + [1H11', '1H12:1H13', '1H14]J3HH + [1H11', '1H12:1H15]J3HH'] multiplets 1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 9 integer Glu-4_1 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 1 integer Glu-4_10 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 10 integer Glu-4_11 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 11 integer Glu-4_2 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 2 integer Glu-4_3 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 3 integer Glu-4_4 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 4 integer Glu-4_5 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 5 integer Glu-4_6 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 6 integer Glu-4_7 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 7 integer Glu-4_8 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 8 integer Glu-4_9 InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/i1H2,2H2/fC5H8NO4/h6H/q-1 ['[1H13', '1H14:C2]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H11', '1H12]J3HH'] multiplets 2 InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1/fC5H8NO4/h6H/q-1 9 integer Gly_1 InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5) InChI=1/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/i1H2/f/h3H ['[1H6', '1H7:C1]HResonance'] singlet 2 InChI=1/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/f/h3H 1 integer Glycogen_1 InChI=1S/C24H42O21/c25-1-5-9(28)11(30)16(35)22(41-5)39-4-8-20(45-23-17(36)12(31)10(29)6(2-26)42-23)14(33)18(37)24(43-8)44-19-7(3-27)40-21(38)15(34)13(19)32/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23-,24-/m1/s1 InChI=1S/C24H42O21/c25-1-5-9(28)11(30)16(35)22(41-5)39-4-8-20(45-23-17(36)12(31)10(29)6(2-26)42-23)14(33)18(37)24(43-8)44-19-7(3-27)40-21(38)15(34)13(19)32/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23-,24-/m1/s1/i17H,23H [1H72:C23]HResonance + [1H72:1H66]J3HH multiplets 1 InChI=1S/C24H42O21/c25-1-5-9(28)11(30)16(35)22(41-5)39-4-8-20(45-23-17(36)12(31)10(29)6(2-26)42-23)14(33)18(37)24(43-8)44-19-7(3-27)40-21(38)15(34)13(19)32/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23-,24-/m1/s1 1 integer Glycogen_2 InChI=1S/C24H42O21/c25-1-5-9(28)11(30)16(35)22(41-5)39-4-8-20(45-23-17(36)12(31)10(29)6(2-26)42-23)14(33)18(37)24(43-8)44-19-7(3-27)40-21(38)15(34)13(19)32/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23-,24-/m1/s1 InChI=1S/C24H42O21/c25-1-5-9(28)11(30)16(35)22(41-5)39-4-8-20(45-23-17(36)12(31)10(29)6(2-26)42-23)14(33)18(37)24(43-8)44-19-7(3-27)40-21(38)15(34)13(19)32/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23-,24-/m1/s1/i17H,23H [1H72:C23]HResonance + [1H72:1H66]J3HH multiplets 1 InChI=1S/C24H42O21/c25-1-5-9(28)11(30)16(35)22(41-5)39-4-8-20(45-23-17(36)12(31)10(29)6(2-26)42-23)14(33)18(37)24(43-8)44-19-7(3-27)40-21(38)15(34)13(19)32/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23-,24-/m1/s1 2 integer Ile_1 InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1 InChI=1/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1/i2H3,4H/f/h7H ['[1H13', '1H14', '1H15:C2]HResonance + [1H13', '1H14', '1H15:1H18]J3HH'] doublets 3 InChI=1/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1/f/h7H 1 integer Ile_2 InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1 InChI=1/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1/i2H3,4H/f/h7H ['[1H13', '1H14', '1H15:C2]HResonance + [1H13', '1H14', '1H15:1H18]J3HH'] doublets 3 InChI=1/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1/f/h7H 2 integer Itaconate-5a_1 InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9)/p-2 InChI=1/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9)/p-2/i1H2/fC5H4O4/q-2 ['[1H10', '1H11:C1]HResonance + [1H10:1H11]J2HH'] singlet 1 InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9)/p-2 1 integer Lac-2 13C-B_1 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 1 integer Lac-2 13C-B_10 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 10 integer Lac-2 13C-B_11 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 11 integer Lac-2 13C-B_12 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 12 integer Lac-2 13C-B_13 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 13 integer Lac-2 13C-B_14 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 14 integer Lac-2 13C-B_2 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 2 integer Lac-2 13C-B_3 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 3 integer Lac-2 13C-B_4 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 4 integer Lac-2 13C-B_5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 5 integer Lac-2 13C-B_6 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 6 integer Lac-2 13C-B_7 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 7 integer Lac-2 13C-B_8 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 8 integer Lac-2 13C-B_9 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2+1H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:13C2]J1CH + [1H10:1H7', '1H8', '1H9]J3HH'] multiplets 0.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 9 integer Lac-2_1 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:1H7', '1H8', '1H9]J3HH'] quatet 1 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 1 integer Lac-2_2 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:1H7', '1H8', '1H9]J3HH'] quatet 1 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 2 integer Lac-2_3 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:1H7', '1H8', '1H9]J3HH'] quatet 1 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 3 integer Lac-2_4 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:1H7', '1H8', '1H9]J3HH'] quatet 1 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 4 integer Lac-2_5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2H/fC3H5O3/q-1 ['[1H10:C2]HResonance + [1H10:1H7', '1H8', '1H9]J3HH'] quatet 1 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 5 integer Lac-3_1 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2H/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:1H10]J3HH'] doublets 3 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 1 integer Lac-3_2 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1H3,2H/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:1H10]J3HH'] doublets 3 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 2 integer Lac13C-A_1 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 1 integer Lac13C-A_2 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 2 integer Lac13C-A_3 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 3 integer Lac13C-A_4 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 4 integer Lac13C-A_5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 5 integer Lac13C-A_6 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 6 integer Lac13C-A_7 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 7 integer Lac13C-A_8 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 8 integer Lac13C-A_9 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 9 integer Lac13C-B_1 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 1 integer Lac13C-B_2 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 2 integer Lac13C-B_3 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 3 integer Lac13C-B_4 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 4 integer Lac13C-B_5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 5 integer Lac13C-B_6 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 6 integer Lac13C-B_7 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 7 integer Lac13C-B_8 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1/t2-/m0/s1/i1+1H3/fC3H5O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance + [1H7', '1H8', '1H9:13C1]J1CH'] ddd 1.5 InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/p-1 8 integer Me-His A_1 InChI=1S/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1 InChI=1/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1/i4H/f/h8H [1H19:C4]HResonance singlet 1 InChI=1/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1/f/h8H 1 integer Me-His B_1 InChI=1S/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1 InChI=1/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1/i3H/f/h8H [1H18:C3]HResonance singlet 1 InChI=1/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1/f/h8H 1 integer NAD+-A1'_1 InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i16H,21H/fC21H28N7O14P2/h34,36H,22-23H2/q+1 [1H62:C21]HResonance + [1H62:1H60]J3HH doublets 1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H28N7O14P2/h34,36H,22-23H2/q+1 1 integer NAD+-A1'_2 InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i16H,21H/fC21H28N7O14P2/h34,36H,22-23H2/q+1 [1H62:C21]HResonance + [1H62:1H60]J3HH doublets 1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H28N7O14P2/h34,36H,22-23H2/q+1 2 integer NAD+-N1' 13C-B_1 InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i15H,20+1H/fC21H28N7O14P2/h34,36H,22-23H2/q+1 [1H61:C20]HResonance + [1H61:13C20]J1CH + [1H61:1H59]J3HH multiplets 0.5 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H28N7O14P2/h34,36H,22-23H2/q+1 1 integer NAD+-N1'_1 InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i15H,20H/fC21H28N7O14P2/h34,36H,22-23H2/q+1 [1H61:C20]HResonance + [1H61:1H59]J3HH doublets 1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H28N7O14P2/h34,36H,22-23H2/q+1 1 integer NAD+-N1'_2 InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i15H,20H/fC21H28N7O14P2/h34,36H,22-23H2/q+1 [1H61:C20]HResonance + [1H61:1H59]J3HH doublets 1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H28N7O14P2/h34,36H,22-23H2/q+1 2 integer NAD-N2_1 InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i4H/fC21H28N7O14P2/h34,36H,22-23H2/q+1 [1H48:C4]HResonance singlet 1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H28N7O14P2/h34,36H,22-23H2/q+1 1 integer NAD-N6_1 InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i1H,3H/fC21H28N7O14P2/h34,36H,22-23H2/q+1 [1H47:C3]HResonance + [1H47:1H45]J3HH doublets 1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H28N7O14P2/h34,36H,22-23H2/q+1 1 integer NAD-N6_2 InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i1H,3H/fC21H28N7O14P2/h34,36H,22-23H2/q+1 [1H47:C3]HResonance + [1H47:1H45]J3HH doublets 1 InChI=1/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H28N7O14P2/h34,36H,22-23H2/q+1 2 integer NADP-N2_1 InChI=1S/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i4H/fC21H29N7O17P3/h33-34,36,38H,22-23H2/q+1 [1H52:C4]HResonance singlet 1 InChI=1/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H29N7O17P3/h33-34,36,38H,22-23H2/q+1 1 integer NADP-N6_1 InChI=1S/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i1H,3H/fC21H29N7O17P3/h33-34,36,38H,22-23H2/q+1 [1H51:C3]HResonance + [1H51:1H49]J3HH doublets 1 InChI=1/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H29N7O17P3/h33-34,36,38H,22-23H2/q+1 1 integer NADP-N6_2 InChI=1S/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 InChI=1/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/i1H,3H/fC21H29N7O17P3/h33-34,36,38H,22-23H2/q+1 [1H51:C3]HResonance + [1H51:1H49]J3HH doublets 1 InChI=1/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1/fC21H29N7O17P3/h33-34,36,38H,22-23H2/q+1 2 integer Nicotin-5_1 InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1 InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1/i2H,4H,6H [1H16:C2]HResonance + [1H16:1H19]J3HH + [1H16:1H22]J3HH ddd 1 InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1 1 integer P-Cho A_1 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 InChI=1/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1/i1H3,2H3,3H3/fC5H13NO4P/q-1 ['[1H12', '1H13', '1H14:C1+1H15', '1H16', '1H17:C2+1H18', '1H19', '1H20:C3]Hresonance'] singlet 9 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 1 integer P-Cho B_1 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 InChI=1/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1/i4H2,5H2/fC5H13NO4P/q-1 ['[1H23', '1H24:C5]HResonance + [1H23:1H24]J2HH + [1H23', '1H24:1H21', '1H22]J3HH'] multiplets 2 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 1 integer P-Cho B_2 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 InChI=1/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1/i4H2,5H2/fC5H13NO4P/q-1 ['[1H23', '1H24:C5]HResonance + [1H23:1H24]J2HH + [1H23', '1H24:1H21', '1H22]J3HH'] multiplets 2 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 2 integer P-Cho B_3 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 InChI=1/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1/i4H2,5H2/fC5H13NO4P/q-1 ['[1H23', '1H24:C5]HResonance + [1H23:1H24]J2HH + [1H23', '1H24:1H21', '1H22]J3HH'] multiplets 2 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 3 integer P-Cho B_4 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 InChI=1/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1/i4H2,5H2/fC5H13NO4P/q-1 ['[1H23', '1H24:C5]HResonance + [1H23:1H24]J2HH + [1H23', '1H24:1H21', '1H22]J3HH'] multiplets 2 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 4 integer P-Cho B_5 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 InChI=1/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1/i4H2,5H2/fC5H13NO4P/q-1 ['[1H23', '1H24:C5]HResonance + [1H23:1H24]J2HH + [1H23', '1H24:1H21', '1H22]J3HH'] multiplets 2 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 5 integer P-Cho B_6 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 InChI=1/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1/i4H2,5H2/fC5H13NO4P/q-1 ['[1H23', '1H24:C5]HResonance + [1H23:1H24]J2HH + [1H23', '1H24:1H21', '1H22]J3HH'] multiplets 2 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 6 integer P-Cho B_7 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 InChI=1/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1/i4H2,5H2/fC5H13NO4P/q-1 ['[1H23', '1H24:C5]HResonance + [1H23:1H24]J2HH + [1H23', '1H24:1H21', '1H22]J3HH'] multiplets 2 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 7 integer P-Cho B_8 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 InChI=1/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1/i4H2,5H2/fC5H13NO4P/q-1 ['[1H23', '1H24:C5]HResonance + [1H23:1H24]J2HH + [1H23', '1H24:1H21', '1H22]J3HH'] multiplets 2 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 8 integer P-Cho B_9 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 InChI=1/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1/i4H2,5H2/fC5H13NO4P/q-1 ['[1H23', '1H24:C5]HResonance + [1H23:1H24]J2HH + [1H23', '1H24:1H21', '1H22]J3HH'] multiplets 2 InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1 9 integer Phe-2,6_1 InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1 InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/i2H,3H,4H,5H/f/h10H [1H16:C4+1H17:C5]HResonance + [1H16:1H14]J3HH + [1H17:1H15]J3HH doublets 2 InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/f/h10H 1 integer Phe-2,6_2 InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1 InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/i2H,3H,4H,5H/f/h10H [1H16:C4+1H17:C5]HResonance + [1H16:1H14]J3HH + [1H17:1H15]J3HH doublets 2 InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/f/h10H 2 integer Phe-3,5_1 InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1 InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/i1H,2H,3H,4H,5H/f/h10H [1H14:C2+1H15:C3]HResonance + [1H14:1H13]J3HH + [1H14:1H16]J3HH + [1H15:1H13]J3HH + [1H15:1H17]J3HH triplet 2 InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/f/h10H 1 integer Phe-3,5_2 InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1 InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/i1H,2H,3H,4H,5H/f/h10H [1H14:C2+1H15:C3]HResonance + [1H14:1H13]J3HH + [1H14:1H16]J3HH + [1H15:1H13]J3HH + [1H15:1H17]J3HH triplet 2 InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/f/h10H 2 integer Phe-3,5_3 InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1 InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/i1H,2H,3H,4H,5H/f/h10H [1H14:C2+1H15:C3]HResonance + [1H14:1H13]J3HH + [1H14:1H16]J3HH + [1H15:1H13]J3HH + [1H15:1H17]J3HH triplet 2 InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/f/h10H 3 integer Pro-5 A_1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/i1H2,3H2/f/h6H ['[1H13', '1H14:C3]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H9', '1H10]J3HH'] 1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/f/h6H 1 integer Pro-5 A_2 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/i1H2,3H2/f/h6H ['[1H13', '1H14:C3]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H9', '1H10]J3HH'] 1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/f/h6H 2 integer Pro-5 A_3 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/i1H2,3H2/f/h6H ['[1H13', '1H14:C3]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H9', '1H10]J3HH'] 1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/f/h6H 3 integer Pro-5 A_4 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/i1H2,3H2/f/h6H ['[1H13', '1H14:C3]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H9', '1H10]J3HH'] 1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/f/h6H 4 integer Pro-5 A_5 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/i1H2,3H2/f/h6H ['[1H13', '1H14:C3]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H9', '1H10]J3HH'] 1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/f/h6H 5 integer Pro-5 A_6 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/i1H2,3H2/f/h6H ['[1H13', '1H14:C3]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H9', '1H10]J3HH'] 1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/f/h6H 6 integer Pro-5 A_7 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/i1H2,3H2/f/h6H ['[1H13', '1H14:C3]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H9', '1H10]J3HH'] 1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/f/h6H 7 integer Pro-5 A_8 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/i1H2,3H2/f/h6H ['[1H13', '1H14:C3]HResonance + [1H13:1H14]J2HH + [1H13', '1H14:1H9', '1H10]J3HH'] 1 InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/f/h6H 8 integer Ser-2_1 InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1H2,2H/f/h4H ['[1H8', '1H9:C1]HResonance + [1H8:1H9]J2HH + [1H8', '1H9:1H10]J3HH'] ddd 2 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/f/h4H 1 integer Ser-2_2 InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1H2,2H/f/h4H ['[1H8', '1H9:C1]HResonance + [1H8:1H9]J2HH + [1H8', '1H9:1H10]J3HH'] ddd 2 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/f/h4H 2 integer Ser-2_3 InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1H2,2H/f/h4H ['[1H8', '1H9:C1]HResonance + [1H8:1H9]J2HH + [1H8', '1H9:1H10]J3HH'] ddd 2 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/f/h4H 3 integer Ser-2_4 InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1H2,2H/f/h4H ['[1H8', '1H9:C1]HResonance + [1H8:1H9]J2HH + [1H8', '1H9:1H10]J3HH'] ddd 2 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/f/h4H 4 integer Ser-2_5 InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1H2,2H/f/h4H ['[1H8', '1H9:C1]HResonance + [1H8:1H9]J2HH + [1H8', '1H9:1H10]J3HH'] ddd 2 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/f/h4H 5 integer Ser-2_6 InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1H2,2H/f/h4H ['[1H8', '1H9:C1]HResonance + [1H8:1H9]J2HH + [1H8', '1H9:1H10]J3HH'] ddd 2 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/f/h4H 6 integer Ser-2_7 InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1H2,2H/f/h4H ['[1H8', '1H9:C1]HResonance + [1H8:1H9]J2HH + [1H8', '1H9:1H10]J3HH'] ddd 2 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/f/h4H 7 integer Ser-2_8 InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1H2,2H/f/h4H ['[1H8', '1H9:C1]HResonance + [1H8:1H9]J2HH + [1H8', '1H9:1H10]J3HH'] ddd 2 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/f/h4H 8 integer Ser-2_9 InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1H2,2H/f/h4H ['[1H8', '1H9:C1]HResonance + [1H8:1H9]J2HH + [1H8', '1H9:1H10]J3HH'] ddd 2 InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/f/h4H 9 integer Succinate-2,3_1 InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)/p-2 InChI=1/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)/p-2/i1H2,2H2/fC4H4O4/q-2 ['[1H9', '1H10:C1+1H11', '1H12:C2]Hresonance'] singlet 4 InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)/p-2 1 integer Tau-1 (SCH2)_1 InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6) InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/i1H2,2H2/f/h3H ['[1H10', '1H11:C2]HResonance + [1H10', '1H11:1H8', '1H9]J3HH'] triplet 2 InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/f/h3H 1 integer Tau-1 (SCH2)_2 InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6) InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/i1H2,2H2/f/h3H ['[1H10', '1H11:C2]HResonance + [1H10', '1H11:1H8', '1H9]J3HH'] triplet 2 InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/f/h3H 2 integer Tau-1 (SCH2)_3 InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6) InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/i1H2,2H2/f/h3H ['[1H10', '1H11:C2]HResonance + [1H10', '1H11:1H8', '1H9]J3HH'] triplet 2 InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/f/h3H 3 integer Tau-2 (NCH2)_1 InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6) InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/i1H2,2H2/f/h3H ['[1H8', '1H9:C1]HResonance + [1H8', '1H9:1H10', '1H11]J3HH'] triplet 2 InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/f/h3H 1 integer Tau-2 (NCH2)_2 InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6) InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/i1H2,2H2/f/h3H ['[1H8', '1H9:C1]HResonance + [1H8', '1H9:1H10', '1H11]J3HH'] triplet 2 InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/f/h3H 2 integer Tau-2 (NCH2)_3 InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6) InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/i1H2,2H2/f/h3H ['[1H8', '1H9:C1]HResonance + [1H8', '1H9:1H10', '1H11]J3HH'] triplet 2 InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/f/h3H 3 integer Thr_1 InChI=1/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m1/s1/i1H3,2H/f/h5H InChI=1/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m1/s1/i1H3,2H/f/h5H ['[1H9', '1H10', '1H11:C1]HResonance + [1H9', '1H10', '1H11:1H12]J3HH'] d 3 InChI=1/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m1/s1/f/h5H 1 integer Thr_2 InChI=1/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m1/s1/i1H3,2H/f/h5H InChI=1/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m1/s1/i1H3,2H/f/h5H ['[1H9', '1H10', '1H11:C1]HResonance + [1H9', '1H10', '1H11:1H12]J3HH'] d 3 InChI=1/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m1/s1/f/h5H 2 integer Trp-4_1 InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1 InChI=1/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1/i1H,3H/f/h12H [1H18:C3]HResonance + [1H18:1H16]J3HH doublets 1 InChI=1/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1/f/h12H 1 integer Trp-4_2 InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1 InChI=1/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1/i1H,3H/f/h12H [1H18:C3]HResonance + [1H18:1H16]J3HH doublets 1 InChI=1/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1/f/h12H 2 integer Tyr-2,6_1 InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1 InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i1H,2H,3H,4H/f/h10H [1H14:C1+1H15:C2]HResonance + [1H14:1H16]J3HH + [1H15:1H17]J3HH doublets 2 InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/f/h10H 1 integer Tyr-2,6_2 InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1 InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i1H,2H,3H,4H/f/h10H [1H14:C1+1H15:C2]HResonance + [1H14:1H16]J3HH + [1H15:1H17]J3HH doublets 2 InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/f/h10H 2 integer Tyr-3,5_1 InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1 InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i1H,2H,3H,4H/f/h10H [1H16:C3+1H17:C4]HResonance + [1H16:1H14]J3HH + [1H17:1H15]J3HH doublets 2 InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/f/h10H 1 integer Tyr-3,5_2 InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1 InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/i1H,2H,3H,4H/f/h10H [1H16:C3+1H17:C4]HResonance + [1H16:1H14]J3HH + [1H17:1H15]J3HH doublets 2 InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1/f/h10H 2 integer UXP-1'_1 ['InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i7H,8H/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i7H,8H/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i7H,8H/fC9H11N2O15P3/h10H/q-4'] ['[1H29:C8]HResonance + [1H29:1H28]J3HH', ' [1H33:C8]HResonance + [1H33:1H32]J3HH', ' [1H37:C8]HResonance + [1H37:1H36]J3HH'] doublets 1 ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H11N2O15P3/h10H/q-4'] 1 integer UXP-1'_2 ['InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i7H,8H/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i7H,8H/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i7H,8H/fC9H11N2O15P3/h10H/q-4'] ['[1H29:C8]HResonance + [1H29:1H28]J3HH', ' [1H33:C8]HResonance + [1H33:1H32]J3HH', ' [1H37:C8]HResonance + [1H37:1H36]J3HH'] doublets 1 ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H11N2O15P3/h10H/q-4'] 2 integer UXP-5_1 ['InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O15P3/h10H/q-4'] ['[1H22:C1]HResonance + [1H22:1H23]J3HH', ' [1H26:C1]HResonance + [1H26:1H27]J3HH', ' [1H30:C1]HResonance + [1H30:1H31]J3HH'] doublets 1 ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H11N2O15P3/h10H/q-4'] 1 integer UXP-5_2 ['InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O15P3/h10H/q-4'] ['[1H22:C1]HResonance + [1H22:1H23]J3HH', ' [1H26:C1]HResonance + [1H26:1H27]J3HH', ' [1H30:C1]HResonance + [1H30:1H31]J3HH'] doublets 1 ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H11N2O15P3/h10H/q-4'] 2 integer UXP-5_3 ['InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O15P3/h10H/q-4'] ['[1H22:C1]HResonance + [1H22:1H23]J3HH', ' [1H26:C1]HResonance + [1H26:1H27]J3HH', ' [1H30:C1]HResonance + [1H30:1H31]J3HH'] doublets 1 ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H11N2O15P3/h10H/q-4'] 3 integer UXP-5_4 ['InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O15P3/h10H/q-4'] ['[1H22:C1]HResonance + [1H22:1H23]J3HH', ' [1H26:C1]HResonance + [1H26:1H27]J3HH', ' [1H30:C1]HResonance + [1H30:1H31]J3HH'] doublets 1 ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H11N2O15P3/h10H/q-4'] 4 integer UXP-6_1 ['InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O15P3/h10H/q-4'] ['[1H23:C2]HResonance + [1H23:1H22]J3HH', ' [1H27:C2]HResonance + [1H27:1H26]J3HH', ' [1H31:C2]HResonance + [1H31:1H30]J3HH'] doublets 1 ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H11N2O15P3/h10H/q-4'] 1 integer UXP-6_2 ['InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O15P3/h10H/q-4'] ['[1H23:C2]HResonance + [1H23:1H22]J3HH', ' [1H27:C2]HResonance + [1H27:1H26]J3HH', ' [1H31:C2]HResonance + [1H31:1H30]J3HH'] doublets 1 ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H11N2O15P3/h10H/q-4'] 2 integer UXP-6_3 ['InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1', ' InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1'] ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/i1H,2H/fC9H11N2O15P3/h10H/q-4'] ['[1H23:C2]HResonance + [1H23:1H22]J3HH', ' [1H27:C2]HResonance + [1H27:1H26]J3HH', ' [1H31:C2]HResonance + [1H31:1H30]J3HH'] doublets 1 ['InChI=1/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/p-2/t4-,6-,7-,8-/m1/s1/fC9H11N2O9P/h10H/q-2', ' InChI=1/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1/fC9H11N2O12P2/h10H/q-3', ' InChI=1/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-4/t4-,6-,7-,8-/m1/s1/fC9H11N2O15P3/h10H/q-4'] 3 integer Val-B_1 InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1 InChI=1/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1/i1H3,3H/t3-,4-/f/h6H/i/tM ['[1H9', '1H10', '1H11:C1]HResonance + [1H9', '1H10', '1H11:1H15]J3HH'] doublets 3 InChI=1/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1/f/h6H 1 integer Val-B_2 InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1 InChI=1/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1/i1H3,3H/t3-,4-/f/h6H/i/tM ['[1H9', '1H10', '1H11:C1]HResonance + [1H9', '1H10', '1H11:1H15]J3HH'] doublets 3 InChI=1/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1/f/h6H 2 integer aGlc 13C-A_1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1/i5H,6+1H [1H19:C6]HResonance + [1H19:13C6]J1CH + [1H19:1H18]J3HH multiplets 0.175 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1 1 integer aGlc 13C-B_1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1/i5H,6+1H [1H19:C6]HResonance + [1H19:13C6]J1CH + [1H19:1H18]J3HH multiplets 0.175 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1 1 integer aGlc_1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1/i5H,6H [1H19:C6]HResonance + [1H19:1H18]J3HH doublets 0.35 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1 1 integer aGlc_2 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1/i5H,6H [1H19:C6]HResonance + [1H19:1H18]J3HH doublets 0.35 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1 2 integer bGlc 13C-A_1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1/i5H,6+1H [1H19:C6]HResonance + [1H19:13C6]J1CH + [1H19:1H18]J3HH doublets 0.325 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 1 integer bGlc 13C-A_2 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1/i5H,6+1H [1H19:C6]HResonance + [1H19:13C6]J1CH + [1H19:1H18]J3HH doublets 0.325 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 2 integer bGlc 13C-A_3 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1/i5H,6+1H [1H19:C6]HResonance + [1H19:13C6]J1CH + [1H19:1H18]J3HH doublets 0.325 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 3 integer bGlc 13C-A_4 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1/i5H,6+1H [1H19:C6]HResonance + [1H19:13C6]J1CH + [1H19:1H18]J3HH doublets 0.325 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 4 integer bGlc_1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1/i5H,6H [1H19:C6]HResonance + [1H19:1H18]J3HH doublets 0.65 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 1 integer bGlc_2 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1/i5H,6H [1H19:C6]HResonance + [1H19:1H18]J3HH doublets 0.65 InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 2 integer bOH-butyrate_1 InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1 InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1/t3-/m0/s1/i1H3,3H/fC4H7O3/q-1 ['[1H8', '1H9', '1H10:C1]HResonance + [1H8', '1H9', '1H10:1H13]J3HH'] doublets 3 InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1/t3-/m0/s1/fC4H7O3/q-1 1 integer bOH-butyrate_2 InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1 InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1/t3-/m0/s1/i1H3,3H/fC4H7O3/q-1 ['[1H8', '1H9', '1H10:C1]HResonance + [1H8', '1H9', '1H10:1H13]J3HH'] doublets 3 InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1/t3-/m0/s1/fC4H7O3/q-1 2 integer m-Ins-1,3_1 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-/i1H,2H,3H,5H,6H/m0/s1 [1H13:C1+1H17:C5]HResonance + [1H13:1H14]J3HH + [1H13:1H15]J3HH + [1H17:1H15]J3HH + [1H17:1H18]J3HH dd 2 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- 1 integer m-Ins-1,3_2 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-/i1H,2H,3H,5H,6H/m0/s1 [1H13:C1+1H17:C5]HResonance + [1H13:1H14]J3HH + [1H13:1H15]J3HH + [1H17:1H15]J3HH + [1H17:1H18]J3HH dd 2 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- 2 integer m-Ins-1,3_3 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-/i1H,2H,3H,5H,6H/m0/s1 [1H13:C1+1H17:C5]HResonance + [1H13:1H14]J3HH + [1H13:1H15]J3HH + [1H17:1H15]J3HH + [1H17:1H18]J3HH dd 2 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- 3 integer m-Ins-1,3_4 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-/i1H,2H,3H,5H,6H/m0/s1 [1H13:C1+1H17:C5]HResonance + [1H13:1H14]J3HH + [1H13:1H15]J3HH + [1H17:1H15]J3HH + [1H17:1H18]J3HH dd 2 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- 4 integer m-Ins-2?_1 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-/i1H,2H,3H/t1-,2+,3-,4-,5+,6+ [1H15:C3]HResonance + [1H15:1H13]J3HH + [1H15:1H17]J3HH triplet 1 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- 1 integer m-Ins-2?_2 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-/i1H,2H,3H/t1-,2+,3-,4-,5+,6+ [1H15:C3]HResonance + [1H15:1H13]J3HH + [1H15:1H17]J3HH triplet 1 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- 2 integer m-Ins-2?_3 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-/i1H,2H,3H/t1-,2+,3-,4-,5+,6+ [1H15:C3]HResonance + [1H15:1H13]J3HH + [1H15:1H17]J3HH triplet 1 InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6- 3 integer pyruvate-3_1 InChI=1S/C3H4O3/c1-2(4)3(5)6/h1H3,(H,5,6)/p-1 InChI=1/C3H4O3/c1-2(4)3(5)6/h1H3,(H,5,6)/p-1/i1H3/fC3H3O3/q-1 ['[1H7', '1H8', '1H9:C1]HResonance'] singlet 3 InChI=1S/C3H4O3/c1-2(4)3(5)6/h1H3,(H,5,6)/p-1 1 integer METABOLITES_END EXTENDED_NMR_METABOLITE_DATA_START metabolite_name chemical_shift peak_area peak_height peak_width sample_id AXP-1' 13C-A_1 5.991912159156256 49.25289606907639 0.6417136140093113 2.628681697108086 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1' 13C-A_1 5.991728589793714 251.2510552488295 1.209145544753051 6.543781864665877 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1' 13C-A_1 5.991400880649675 523.894712135422 1.717011342759512 10.75498457150988 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1' 13C-A_1 5.992083017491269 449.8759044636008 1.306759066267267 11.83108446659734 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1' 13C-A_1 5.992342421989056 455.1354933765017 2.631713834116395 5.80470414132769 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1' 13C-A_1 5.992471682295041 244.819503485553 0.6599304202095408 14.83452872808212 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1' 13C-A_1 5.992603264850416 1371.470119769382 3.337880621155379 12.94009551469334 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1' 13C-A_1 5.992398420062742 592.0692222203729 1.768013592833349 12.61390904046923 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1' 13C-A_1 5.989163226033074 783.2484784936964 2.137708538158533 13.58545985041771 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1' 13C-A_1 5.993186855174128 1108.400619981541 3.371834073936026 13.6575602045565 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1' 13C-A_1 5.993220586526391 1342.893039239566 4.257402750507391 13.74396447732316 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1' 13C-B_1 6.27336583816664 268.2755625608598 1.034658257524679 11.46445551083585 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1' 13C-B_1 6.27385842325446 396.5318705002778 1.18973325681467 11.62945756714291 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1' 13C-B_1 6.272549286668134 350.7595865745222 1.456792819772446 11.47628947808675 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1' 13C-B_1 6.274384818120183 263.5827089501372 1.005671870020108 11.33766171809525 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1' 13C-B_1 6.273584701150268 777.6669165186543 2.764010148180297 12.04211962441041 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1' 13C-B_1 6.275076315178073 292.1727169467476 1.000185017203195 11.8843872729659 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1' 13C-B_1 6.273970278901055 145.3432106165736 0.4906993337538562 12.56485433572888 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1' 13C-B_1 6.273503232342382 919.3897100644136 3.367892007956997 12.31270918446013 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1' 13C-B_1 6.273172979380465 542.2195843496871 1.699719633419816 11.87923595830893 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1' 13C-B_1 6.273440212471614 453.535029032117 1.695309599219371 11.40364794070396 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1' 13C-B_1 6.271731556986023 530.7361446080988 1.931787362843869 12.31861201005085 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1' 13C-B_1 6.273279393693203 964.4458089863103 3.455194203779188 13.23771567271904 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1' 13C-B_1 6.272633604077241 1129.340644115635 3.999647772432606 12.76493061716233 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_1 6.12854168140791 234.1976092977262 3.332511834062884 2.533622411541417 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_1 6.128096641409898 330.3409838560075 4.820744567949109 2.479791562003 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_1 6.128196760009229 456.7830607329011 6.454862954660482 2.560647755230645 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_1 6.128093954046223 569.6366341668509 7.716473016081622 2.602802262148101 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_1 6.128294193171587 116.6511232216669 1.956877324074113 2.096457087730045 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_1 6.128397654515243 762.2800920384152 9.88735157194111 2.753022443621697 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_1 6.128288465151353 139.6350015153743 2.098296798662584 2.331585402067154 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_1 6.128628899755578 32.44205272848955 0.543963623555941 2.138282400967874 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_1 6.128521480815042 94.11457156419183 1.433931994095823 2.302218493179521 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_1 6.12844631604889 512.0209110779352 6.149088241232031 2.839119085341245 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_1 6.1279935108548 356.2817215227211 4.616742271726077 2.682433511488206 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_1 6.128251225164206 141.1481307627827 2.120479418140444 2.35135773518967 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_1 6.128174424315712 347.8091084793215 3.346209501421076 3.320695259977443 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_1 6.128381585024733 431.3398981959185 3.35668386191949 3.95400147487688 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_1 6.128336248587638 499.5560216930488 4.660382102840925 3.461905315666071 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_2 6.135988889395924 414.0007830318076 6.028261147873194 2.375307783200755 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_2 6.137055610587199 926.4800747808108 10.34808747789247 3.212813384664627 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_2 6.137313914618231 1039.59578223064 12.52978064886408 3.139348168148268 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_2 6.137360915777074 1331.740585473058 13.58829485327886 3.53825836631436 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_2 6.137119006923679 481.8457980090816 4.949750159613872 3.378264732034657 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_2 6.137539366260058 1809.498212988737 18.35581532065497 3.622046567193665 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_2 6.137623661591162 456.9342294834757 5.716536074999631 2.831400818674282 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_2 6.138588237030259 94.24647805502791 1.268860553388801 2.495315023281237 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_2 6.137291014252993 331.712301198239 3.355804161829807 3.385557262651917 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_2 6.137729808875877 1196.447816123885 11.12023988540721 3.83298977591029 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_2 6.137373877038904 801.0851189870527 8.675721581020408 3.375254846940213 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_2 6.131819234983128 32.13842452210093 0.602164152691328 1.947102598091241 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_2 6.138014062012896 462.2408162470398 4.620202962877631 3.385312582863343 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_2 6.138116940456857 485.3979808292668 5.053560042291777 3.379349984924728 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_2 6.137927547089014 702.7208558884516 6.813169471287298 3.593614785544399 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_3 6.138785474361268 287.6194707935863 3.459220363486768 2.901155554095593 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_3 6.145780617216632 382.9980093072868 6.2354854434159 2.400452633968915 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_3 6.145900262553769 462.1008438625494 6.966904573168732 2.568043035932838 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_3 6.145780634726298 415.4191195795779 6.568020432761202 2.547485636250796 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_3 6.146098030890729 218.0322996938986 3.247095670544604 2.475582007928526 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_3 6.146008900428761 611.8670227645359 9.178356311354827 2.635414134667032 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_3 6.146602069971213 253.4169112399 3.313116305043309 2.922600396212724 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_3 6.147397873747037 43.63755896812253 0.5595886094931012 2.825644640370363 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_3 6.146086525205066 143.0722255568269 2.16754497459097 2.457767907799781 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_3 6.146157819755648 455.2526206406953 5.586477011815783 3.053500125904774 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_3 6.145875702830472 336.533703755039 4.443441214677728 2.869803914775571 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_3 6.137627936903087 345.6428130695593 4.084191283679712 3.113284838311874 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_3 6.145929834013562 167.7132037502238 1.554278364458355 3.765038442616058 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_3 6.146529583910929 222.3676233377371 2.177727856313761 3.764605866605342 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-1'_3 6.146246863741387 273.8116000055138 2.851163768265383 3.429154500665015 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-1'_4 6.145353185882994 363.6872346618577 6.16796110013261 2.124251349789982 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A AXP-1'_4 6.146093817901541 187.8151927987216 2.350912049417722 2.914109103035512 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_1 8.248816530513546 288.4472248063486 5.981968885560493 1.686348835327713 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_1 8.248201133564681 434.61892599966 8.517692172109786 1.803906224391504 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_1 8.240204114149192 58.86629658262683 0.6242877579332966 3.577722860308604 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_1 8.247986231323091 701.8925222082868 13.77736855709056 1.7772428875698 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_1 8.248831115998234 205.3782013318314 4.500996552748139 1.600289026614242 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_1 8.248193565212734 1515.402584245933 23.98450481066948 2.540631557242381 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_1 8.248611721930546 216.5607326571361 4.325141329784453 1.780135115727548 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_1 8.2493417729481 59.12757876513452 1.099823141765265 1.776372236193315 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_1 8.249235101541645 154.9809715185004 3.093458790643229 1.845226664509587 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_1 8.248488694255455 1252.687813455748 18.33844238415756 2.595318532897486 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_1 8.24810752674813 506.5330269343524 9.86858654362439 1.776605596644272 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_1 8.24045945211778 45.70641786250669 0.6577241131277027 3.312250381876456 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_1 8.23942991153643 123.8119923014441 1.259581021272231 3.429790279470395 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_1 8.239458762710617 64.54739576834555 0.8863435460606095 2.610978117320136 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_1 8.239232267834405 99.97470558774388 1.370184835214671 2.615998984853932 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_2 8.250450880664719 272.7873370101801 6.142372292677154 1.556889901404475 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_2 8.250141853947419 344.0602482390857 7.170003570621962 1.766121443411071 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_2 8.248130058411501 561.4219529753698 10.54916591153873 1.855522628991137 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_2 8.249961065196631 438.234558373049 8.916432472848093 1.759664472450622 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_2 8.250751424660825 160.1181411303569 3.866946543575632 1.490336914003352 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_2 8.252006503563925 769.3318325676563 13.74369157791316 2.126143056499475 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_2 8.251008513164152 201.6213016069092 3.726113582914052 1.923204015038859 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_2 8.254947008507663 49.88040607497565 0.9464219121280116 1.839626818007975 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_2 8.25106743932702 102.95735237562 2.2043728014983 1.62886695954036 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_2 8.252408192049371 549.6301125089715 9.819637848491753 2.062767793368399 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_2 8.250250308257849 341.8849836191366 6.717206198570083 1.794041805489779 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_2 8.248734755046277 318.0624187411495 5.881073933000814 1.863501537806091 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_2 8.248500464548767 465.0422106333385 7.400720008801134 2.137545881601105 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_2 8.2486304874854 625.1777991540893 7.000143679072147 3.065364712114358 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_2 8.248506869097593 757.6475256712362 10.04414658862466 2.631995414377865 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_3 8.253364623319436 281.6714340157214 5.913867206582286 1.661889706306075 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_3 8.253238922290851 401.941995448543 7.835441861760766 1.831462262756051 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_3 8.250061904228746 433.1952291835622 8.439898339082697 1.87119861693389 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_3 8.252909539741358 415.1078855648339 8.138188056227813 1.784315908918903 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_3 8.253906814727475 208.1135190294845 4.449492613703362 1.632002291035557 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_3 8.258653689227797 148.2959061848379 1.267165333450691 4.402426807010801 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_3 8.253911449131461 269.5116026475259 4.951688628839557 1.914134930824632 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_3 8.254251815791458 122.4102576958222 2.590740788512577 1.679698434241273 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_3 8.253194623789291 291.6952469756449 6.135255225462549 1.675890970849583 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_3 8.25083311214801 176.1135915686373 3.727287747888927 1.653206899956578 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_3 8.250847354414779 131.249057675019 2.23715714290624 2.047060434880069 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_3 8.252741289647165 799.6993488028402 4.19466122919023 5.866208387452231 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-2_3 8.251959326413806 849.2578373867352 5.030655868925047 5.563612277291643 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_4 8.253175630753738 506.2603833038735 8.519446779738544 2.055168575515798 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_4 8.253843192447953 209.8953032747798 3.961343192871843 1.808692669047089 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-2_4 8.253607891437431 73.16448397431098 1.49224072054075 1.757875125551335 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-2_5 8.25778273781477 200.6040123500972 1.435664709920238 4.299463102159272 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_1 8.538140521500532 502.1615829017501 4.504778321164775 3.889564893817194 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_1 8.532214818873033 608.3339777456981 8.118112170585745 2.659898662432609 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A AXP-8_1 8.531345781991082 682.282893697305 9.20929170369261 2.626536158003548 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-8_1 8.530542471220022 618.08342736333 9.019097603409232 2.391194888209339 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_1 8.53333036687448 354.3931243052748 4.759310365308529 2.624386635397676 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-8_1 8.5291072176947 1078.751900711741 15.03743750454644 2.528274830808172 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A AXP-8_1 8.529918830779996 415.1200363419749 6.330497367657691 2.347385688507023 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_1 8.529635135544307 55.02190457065699 1.112760904232691 1.843218196556128 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-8_1 8.534594391702594 197.8285592552303 2.629895069276131 2.74802773665833 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_1 8.529472747680336 861.9604807718258 11.27345387568947 2.667849484754438 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_1 8.53037323538134 507.2246001555946 7.314458652824039 2.419630669071264 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-8_1 8.531879923739853 369.8021043022696 4.801632839644838 2.639610611970657 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-8_1 8.529238348106041 195.7313174699226 2.570328059413842 2.657068332780098 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_1 8.528574959750483 460.6823452167142 5.303579214131063 3.023637544487694 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-8_1 8.528816804200648 493.8345273125439 6.147365264164478 2.803001910247378 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-8_2 8.545711965618974 472.8058445374975 8.882490025509084 1.897189392577442 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_2 8.543081177725325 558.6934009824298 9.455345074580087 2.154587029099412 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A AXP-8_2 8.542372017278852 667.4825944694828 10.73695537203211 2.256242798500131 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A AXP-8_2 8.541387079708613 695.7744979853431 11.64240952102686 2.152508758760539 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_2 8.54419867359092 312.8992823190527 5.729849795302433 1.960855503589573 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-8_2 8.539811793561908 1069.527669086212 16.43804212138038 2.331272131562122 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A AXP-8_2 8.541157207575598 344.1537427666321 4.989143283278688 2.453767464744598 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_2 8.54056705430841 49.83394684599344 0.9406142107150383 1.920688140912602 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A AXP-8_2 8.545430187587039 199.5775241986397 3.659978993668857 1.986248733476478 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_2 8.540142605399632 879.3396016731781 12.88801128269161 2.411914922263675 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_2 8.541494331288376 539.695301498739 8.79167686838717 2.176372805251477 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-8_2 8.543020689431108 362.9564203855303 5.796181299529723 2.218462461189439 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A AXP-8_2 8.539878871109682 327.4509726930173 3.920464951800935 2.914336332100341 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A AXP-8_2 8.539279897864864 547.9233263236778 5.922642105965014 3.228012897574383 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A AXP-8_2 8.539616204781815 658.8157093336924 7.747953263579455 2.899352579294491 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ace-2_1 1.906864986163833 1264.934182979664 30.97238890878792 1.42503058773407 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ace-2_1 1.906709357131901 2643.606640856367 63.57959405254528 1.538487284670165 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ace-2_1 1.906872953604603 2196.76523526675 51.08061079417722 1.58258438783412 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ace-2_1 1.90698396351747 3613.134448165416 91.57229702693793 1.447060972564943 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ace-2_1 1.906643217936826 2778.201068022478 69.46761926033183 1.42503058773407 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ace-2_1 1.908003757808476 2920.855423226818 68.66003296016231 1.532986152613048 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ace-2_1 1.906923585477031 1993.3416312704 45.05019817655351 1.589457194011078 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ace-2_1 1.906749805700666 1100.168807242695 27.79735259398449 1.42503058773407 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ace-2_1 1.906820537711995 1584.279562055024 38.56355987043787 1.558226182682584 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ace-2_1 1.908144550566887 3023.531037177315 72.50448942831501 1.4749097817145 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ace-2_1 1.906864986163833 3454.549384882797 88.7194174405108 1.406921460980281 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ace-2_1 1.906976976184738 3244.563739016643 78.39558616945149 1.478207167006536 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ace-2_1 1.906988440329257 2644.611139920147 61.97843307937788 1.51571213658095 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ace-2_1 1.907670714021667 2243.961844381952 44.33786358958834 1.852949948858974 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ace-2_1 1.907740348204711 959.8966196515507 21.51608967063584 1.5826161373517 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala-3_1 1.458164294529439 632.5517347967275 12.66983356210768 1.693209631375281 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_1 1.457720016459886 632.922545530584 11.69126601911424 1.873021292042565 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala-3_1 1.457676973654804 751.1967255737906 13.00998956426351 1.973119275324097 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala-3_1 1.458214851614689 1914.749866970204 36.37554258276871 1.808692669047089 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_1 1.458963404296014 520.7585192447276 10.64730836291445 1.699074931529083 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala-3_1 1.458837094345091 1405.955495126871 26.15703390224167 1.863501537806092 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala-3_1 1.460020614725237 925.2921773446568 16.59303400550019 1.924133206876715 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_1 1.459738595914724 95.37529683616873 2.104497715961062 1.590619882277705 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala-3_1 1.458773123465011 232.4764309571763 4.752309388477189 1.753883800288086 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_1 1.459856158455504 2449.376296534858 43.21280306384573 1.918310406565094 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_1 1.457958445083867 1826.023525392209 33.08689079621564 1.836163567065427 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala-3_1 1.459182136401954 969.2445250090192 17.22514907075767 1.863501537806091 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala-3_1 1.46066057834846 1972.332481862844 32.74396670913519 1.973119275324097 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_1 1.460672187645115 2024.684253383475 28.1713974098231 2.411590225396118 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala-3_1 1.460359186413246 2217.153517202791 34.27233489964347 2.137545881601105 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala-3_2 1.470239418463842 665.1486793232405 12.88739579659916 1.753883800288086 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_2 1.469804404795681 622.7340535057677 11.66014151142303 1.863501537806091 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala-3_2 1.469737123350293 807.542955511224 13.34262154930103 2.056703634420511 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala-3_2 1.470303451352572 1922.721394710152 36.47611723692817 1.808692669047089 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_2 1.471059164620226 569.6203609486369 10.90443441135337 1.761982557016583 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala-3_2 1.470905960001621 1517.474755613467 26.98707210353685 1.918310406565094 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala-3_2 1.472120005973333 896.0337228017322 16.23578691188781 1.92567048329994 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_2 1.471868267542491 114.7087196935058 2.160367059676039 1.789660922242421 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala-3_2 1.470873587863661 252.4636590108064 4.789797635233312 1.839131015196916 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_2 1.471959151639029 2643.92848120713 44.60927221800401 1.973119275324097 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_2 1.470050311053697 1814.918042065195 33.04665009249867 1.808692669047089 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala-3_2 1.471267822729116 973.7215659401764 17.44010827731817 1.863501537806091 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala-3_2 1.472754607272944 1874.961879783654 31.9345146037037 1.973119275324097 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala-3_2 1.472749645787645 1949.570202579736 27.45658429340763 2.411590225396118 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala-3_2 1.47244190835894 2106.02382925132 33.36222987096666 2.137545881601105 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_1 1.340089854684367 13.8395028462056 0.3763971967148724 1.370520754077229 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_1 1.339752349874139 33.81694860879329 0.780285706790385 1.553843801685344 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_1 1.339632958188288 31.9769876462052 0.7185552468652536 1.642263507548956 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_1 1.34021861391893 38.09888597653455 0.8444641981131177 1.581394157473507 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_1 1.340892417763184 19.35883007340304 0.5002893977499355 1.399373832154522 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_1 1.34078844809448 153.8146893719999 3.040917389376161 1.809990827386383 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_1 1.342317165556606 190.5136123088305 2.15632843663388 3.022412220740763 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_1 1.347918084115185 28.94029144955394 0.5731829988970539 1.808692669047089 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_1 1.341747084859512 49.06849068029548 1.202766830567849 1.512680768646691 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_1 1.339845794909758 27.73758053911633 0.7730976491124962 1.388485326268555 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_1 1.341115951079981 89.4406327292186 1.860698181355615 1.693333497374387 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_1 1.342566090438294 95.9385296778078 2.04716472026457 1.675657642573469 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_1 1.342646353001899 255.6866931097212 4.133612216159071 2.187128476255189 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_1 1.342302207085686 281.5821556457768 5.058381456199204 1.957013412567137 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_2 1.347449709338392 54.52534711961572 1.014068845137408 1.901170365251474 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_2 1.346938979747764 141.8058490656084 2.453123944636018 2.061011309839459 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_2 1.346873048351873 138.8308639507148 2.162380046143833 2.282152723862997 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_2 1.347512725826527 150.2191957410641 2.687964150752967 2.005752347777682 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_2 1.348175154394271 59.18967343751646 1.266279169137109 1.723328411514682 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_2 1.347947652993035 420.765359563063 7.356237048947196 2.037673011503243 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_2 1.349294393506516 87.80689444357402 1.776290608656805 1.772316135688593 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_2 1.360231485176737 29.76378462687293 0.5859456003272842 1.753883800288086 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_2 1.349200265490293 198.0549771322213 3.949417829386795 1.865897650463531 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_2 1.347329960833769 132.6764929762165 2.441575545618303 1.966042466206039 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_2 1.348342322264297 232.0787000011936 4.227271476948257 1.955335953144967 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_2 1.349896199580926 309.6569528725573 5.416473055825445 2.049702555618022 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_2 1.34982364177003 724.0823177672304 10.06995105282434 2.508947327464135 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_2 1.349521027706005 765.77593502217 12.35927760409603 2.192354750360107 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_3 1.353726735580315 36.54254715892981 0.5345603522830686 3.018691238625637 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_3 1.351720768870159 46.36248424618952 0.8985949509882338 1.84191384672183 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_3 1.351758495641805 50.22527617824151 0.9070809732346679 1.912552121688457 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_3 1.352170519262916 46.30815594436263 0.9102527859086237 1.788174348289405 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_3 1.353217063410532 54.19341068125088 0.6532888795489225 2.914048111571181 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_3 1.352888390693256 260.4583154752056 4.140734723404333 2.187927593120208 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_3 1.353995591565334 18.43451024412204 0.5043584089232799 1.332610229152498 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_3 1.372820761601415 16.72449535752939 0.4009309751615561 1.537924369654116 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_3 1.35376667942568 79.56658042113514 1.485954383377466 1.876364494696788 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_3 1.351899085652731 27.20832081020023 0.6709390030723549 1.407840002230961 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_3 1.353218918467803 108.5134480694511 1.967628803057098 1.920461261722923 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_3 1.354578409504785 158.9686259707249 2.529222296734994 2.135854524696418 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_3 1.354638685959643 343.3277373122367 4.991158424884137 2.436451985777521 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_3 1.354283722760662 385.231827846754 6.238829271426956 2.165488147887999 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_4 1.359534554625755 59.88843498635021 1.103356820346241 1.906614776196933 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_4 1.354095000666178 77.24229859678098 1.239353397815522 2.17465810979398 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_4 1.35391152492482 59.41749131484457 0.9226912107811366 2.201698762866164 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_4 1.354516427263962 80.41800922239774 1.170511917345406 2.34966853084989 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_4 1.360330088507304 73.34320119965786 1.407855303371764 1.851128721987004 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_4 1.355172480602392 189.3862178943747 3.244634494457746 2.057465880200317 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_4 1.355868939377058 78.69347910260869 1.159776234909155 2.396432662016371 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_4 1.356242374714315 77.08519872760927 1.307985713710706 2.04252143253224 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_4 1.354242823126724 49.47264136686437 0.8535767345392531 2.049560913405767 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_4 1.355479853738783 93.04803801827569 1.759922293634562 1.864053588963674 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_4 1.356939600592085 132.6297924699187 2.139500829127274 2.151778693329832 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_4 1.356982255692691 322.606145156495 4.433681047407672 2.548011298162562 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_4 1.356631341906514 375.2557123861175 5.856640355442345 2.242766730960646 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_5 1.366468762028198 15.46584919179651 0.3551455839570718 1.479839456493073 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_5 1.359126123083208 132.4605865353376 2.321818472211401 1.999381360719765 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_5 1.35908090133085 124.6129986040606 2.015158122217213 2.175862224475718 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_5 1.359636626844387 177.454504055707 2.88972825751076 2.163410798953842 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_5 1.367291487449843 19.78231694262021 0.4673098338966737 1.479839456493073 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_5 1.360097008315663 446.2652764975188 7.372632832273863 2.112036656526111 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_5 1.361522235832773 101.678566019571 2.184976360793394 1.78304102144677 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_5 1.361361322840338 255.2184680078772 4.350204860387653 2.103434447335566 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_5 1.3595068098568 140.6454258136546 2.575495541037444 1.965850458990423 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_5 1.36045778013024 235.124293143474 4.328780072449104 1.941553500366706 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_5 1.361989179944569 368.7064208674185 5.802479501524181 2.213643246590941 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_5 1.361919360492143 742.6584074377838 10.23277347658967 2.532367336151978 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_5 1.361612494295609 899.8263921028757 13.05347115551274 2.365116366435875 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_6 1.366054022233434 41.00155178875291 0.8651957060179533 1.699074931529083 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_6 1.366104906779547 41.08789611215382 0.7415359338162271 1.945027093721828 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_6 1.366621996564223 35.36953246713226 0.8915042189741458 1.462707482668929 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_6 1.367142172207171 160.866796154861 3.113310129907711 1.822740393484029 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_6 1.368378411463744 18.92615116970098 0.5096153702685904 1.409108994228438 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_6 1.365101492329941 17.61648869045571 0.4001507010510513 1.564209444184042 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_6 1.366380299002173 28.92865063642196 0.6937411716956774 1.454995561755153 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_6 1.36752624631904 88.6444893621418 1.802157561243523 1.721249080910721 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_6 1.368991424271845 122.5567014032508 2.331150080262432 1.843056409329553 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_6 1.368987976009836 307.0078213383233 4.633707848587369 2.319043437002676 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-A_6 1.368654809535332 351.8857829046062 5.854213329567916 2.076883000445757 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-A_7 1.368211349852797 55.09113862529855 1.265667678929752 1.604773061503232 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-A_7 1.557436852233836 129.1391885211268 2.393429654777992 1.887844536466568 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_1 1.563644120747637 68.76039876319027 1.208721688325257 1.992003629854953 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_1 1.556138965060324 54.03432214320573 0.9415562494646417 2.084698777038744 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_1 1.555956200067565 60.56107334670145 0.9525821316309133 2.236228012446271 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_1 1.556622079744522 74.81328059265647 1.246635469258766 2.175865485419792 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_1 1.557278554704739 41.51146196097411 0.8905901546373531 1.671155000551873 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_1 1.55704426993678 204.4936345549233 3.495275706050637 2.035773160056618 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_1 1.558284075381091 47.93538591590632 0.8595121396131764 1.984649451946473 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_1 1.557173156618676 13.48779845276154 0.3043802099701571 1.70753542951203 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_1 1.558197594671388 111.7123250046834 1.917716165322924 2.032580350874775 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_1 1.55647925745293 65.0530838322009 1.0447447780295 2.210153883568207 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_1 1.564570020837684 277.9098569863799 4.710279287096292 2.082737012842102 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_1 1.558734392982911 134.4715892990601 2.492537227462648 1.918310406565094 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_1 1.55883406549296 329.0381805542578 4.857392644691223 2.363600349880626 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_1 1.558541085703961 381.218116117787 6.022969929517511 2.164373999990044 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_2 1.569620980413659 41.78675088595863 0.6405270935633031 2.896295207592899 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_2 1.563211905960436 145.4370305735549 2.443125492361126 2.069814210562242 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_2 1.563152115418754 154.8187218004447 2.39502921223476 2.240375904604811 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_2 1.563765598349196 173.4151202950438 2.885406587578754 2.131197440311074 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_2 1.564394162644313 86.53287120683653 1.584274151600223 1.999933024336169 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_2 1.564198683790068 423.2437929882409 7.498166931443465 2.002418919008106 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_2 1.565442907910056 149.2291711344909 2.420241273865507 2.229688878365637 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_2 1.557173156618676 13.48779845276154 0.3043802099701571 1.70753542951203 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_2 1.565412829151082 339.4603304264503 5.172615828667129 2.301972487878113 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_2 1.563595449421778 177.0028519377931 2.840938930804415 2.165721336987612 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_2 1.569336939990358 141.9728204831383 2.407078001816676 2.05031452191598 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_2 1.566040346224634 412.4897351993021 6.353445383054306 2.287742390466291 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_2 1.56603060622156 787.1186182497868 10.58513358187235 2.583560252989391 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_2 1.565737051913634 937.326534874633 13.50977484728539 2.401960365024686 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_3 1.575718875414221 65.69732421262795 1.237764074956751 1.912445106411291 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_3 1.569227020052351 103.384185991944 1.577009115098613 3.082165484866215 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_3 1.569326278709955 110.0074943565069 1.449506560741092 3.111682652183244 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_3 1.570108641325603 163.3748823943394 1.804495047218314 3.246057341792792 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_3 1.570119170945416 85.93563691909964 1.124872576362283 3.198950717126623 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_3 1.568992606672842 218.0253617215708 3.674996843468222 2.060353388342067 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_3 1.571373985932957 119.0236266338366 1.306703560506817 3.911993629750104 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_3 1.564228559310186 44.9747589944761 0.7925495458738547 2.05881796377944 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_3 1.569977987087474 118.4266051811285 1.958789609040846 2.121765620873445 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_3 1.570071517403959 136.8458979001326 1.551872067510864 3.105258508218313 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_3 1.571672166557784 149.4425338273533 2.319731793829645 2.238481458844019 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_3 1.57074983550188 193.324115819295 3.019859137579456 2.232914075573557 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_3 1.570853832534673 385.9547130237221 5.201487757547663 2.575440631145954 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_3 1.570561172238103 420.1171028038768 6.429796624222395 2.277212450522044 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_4 1.582730715485584 22.02456149815268 0.5039370275663333 1.611322855313523 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_4 1.575290693174678 151.4391209533275 2.562660144762168 2.091992856547638 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_4 1.575265569808779 146.3107416202988 2.376369311464952 2.161304531207208 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_4 1.575919598212271 181.0090319253223 2.892633118159941 2.183422859641002 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_4 1.576559979128929 109.0876678352107 1.736069608835807 2.177153555642792 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_4 1.571327908828953 226.7763849140613 3.749781152714722 2.115849555700136 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_4 1.57771710064764 149.435234923116 2.384741263419732 2.186465885662203 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_4 1.570425104776203 27.08660306265228 0.4265391667623704 3.010609495837398 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_4 1.572452711097548 142.0692848104898 2.013559361569126 2.441097535681857 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_4 1.575731061019883 177.2352990896181 2.878421015570326 2.155474860591932 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_4 1.576700026745652 301.9118582255874 4.928283550221717 2.137545881601105 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_4 1.573221625268146 161.2813602285711 2.541550425538864 2.207306683467742 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_4 1.573190660334065 342.2952748270886 4.644097708122816 2.571760472752594 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_4 1.572918693364952 418.2592208150715 6.144050459016606 2.370895584415575 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_5 1.582730715485584 22.02456149815268 0.5039370275663333 1.611322855313523 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_5 1.582227888705571 66.23949540800317 1.200284758301473 1.946559989762479 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_5 1.582185711985722 61.77777362771501 1.091069756622161 2.021559039892618 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_5 1.582731271506682 58.20048278255854 1.235208355663169 1.676474358001131 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_5 1.583486582917334 37.06982103224623 0.7406149644945043 1.778947224058554 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_5 1.57630230262999 462.7556852713594 7.645066596553775 2.112036656526111 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_5 1.584567000170699 41.29570463952582 0.8669328153077239 1.746006433554661 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_5 1.576418515362007 42.72507203079596 0.7770022856534131 1.948896434501664 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_5 1.577578386021458 380.5822711927822 5.356063039356206 2.4077107973284 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_5 1.582487230290941 50.51296761943146 1.007974739332955 1.748574726272502 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_5 1.583697212959451 133.4393283664783 2.330705873713147 1.997686515644939 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_5 1.57826414686886 477.1579099641878 6.461738449420014 2.470630207419453 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_5 1.578193716652445 879.7142171775486 10.96029335399457 2.712688170160367 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_5 1.577862761116174 931.7800744593561 13.53271672189526 2.365116366435875 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_6 1.58334487527222 200.9346131547798 3.580313488609654 1.962436467464376 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ala13C-B_6 1.584403554899818 86.82867797204376 1.709797542390384 1.807549455343816 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_6 1.585194999293597 133.6697819753359 2.504189216218877 1.880366283783704 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ala13C-B_6 1.585220879412637 276.3744802810999 4.491434017704643 2.206172713152609 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ala13C-B_6 1.584913907298305 328.9460992990696 5.790602895175876 2.012407615602088 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_1 2.634499786350483 291.0144044103557 5.84051315019342 1.693209631375281 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_1 2.634258043589587 312.9290210690345 4.816046055633551 2.083337528502377 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_1 2.63421009639054 518.8955772702785 7.080129195079294 2.339887993733288 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_1 2.63522818731035 785.660552566185 13.38671212650496 1.931919554797981 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_1 2.635648593094327 208.447690368475 4.064099380965773 1.770832224710195 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_1 2.63625861928463 820.0014246229392 11.8858583213561 2.281883895440368 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_1 2.637810045699112 563.3887780055409 4.549635052120317 3.810300844368115 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_1 2.636264036212582 25.27788824322529 0.5566844233440552 1.590619882277705 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_1 2.635183368358451 150.1642946293324 2.268274414252744 2.130172216767593 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_1 2.637699952802119 838.953581303064 14.46976557051503 1.977813903693027 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_1 2.6346673952072 594.414409411136 11.61509803251774 1.753883800288086 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_1 2.636152390526223 284.2931976734166 4.039681125703676 2.230506385593348 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_1 2.638601863402826 809.5722892637748 11.15878798856043 2.358978740972613 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_1 2.638852067068743 919.0129643286717 10.0505131951135 3.046326612156633 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_1 2.638602232024632 843.1371069783305 10.95794763070476 2.625541788525923 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_2 2.649497314471355 291.1696046630801 5.815979643652427 1.694883172628892 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_2 2.649183132974402 233.7229360949733 4.720437792992256 1.753883800288086 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_2 2.649143113953047 338.9860184918973 6.336986439863468 1.860860787912527 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_2 2.650155223354303 613.8008278826313 12.60508849437657 1.699074931529083 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_2 2.650642691326126 172.8002443512761 3.677151138238215 1.632002291035557 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_2 2.651125367157831 553.1455895462525 10.50419212985181 1.808692669047089 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_2 2.652330280408444 180.4736549524406 3.437681192991343 1.843903491810104 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_2 2.651328490348402 26.23045545248386 0.5084305443485915 1.694763455466502 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_2 2.650121333036229 93.39606665938948 1.875758899748794 1.744586872345324 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_2 2.652515775740941 823.7629658294156 14.01617333710564 1.95321462861152 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_2 2.649619184475696 534.5841454004798 11.40885506132454 1.64426606277008 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_2 2.651095621025168 176.0683670340013 3.392549278994621 1.753883800288086 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_2 2.6534975864773 593.5550438111669 9.81672196673073 2.005412783180554 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_2 2.653719141730186 752.4977526065264 8.828622470936857 2.79783473217463 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_2 2.653508280251598 469.4581189155176 8.272108804409209 1.973119275324097 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_3 2.66363321819868 447.8411852240143 8.671813858427607 1.753883800288086 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_3 2.66331703218414 442.5976052737668 7.533608784131106 1.998137254434752 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_3 2.663293380872256 564.4966851058964 9.90355536756759 1.973119275324097 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_3 2.664294573988413 1137.994916906667 20.34250787053193 1.867027623544345 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_3 2.664765524510251 334.3553411548431 6.121348329874651 1.839711436663341 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_3 2.665304876061605 899.8295467620475 15.90696583999101 1.918310406565094 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_3 2.666569928784451 262.3075211712102 4.813106836377358 1.901587014105859 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_3 2.665515783991685 74.54845406162919 0.9714745491274254 2.361211286574572 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_3 2.664266697871582 193.5852919009602 3.222947006225362 2.029270414100856 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_3 2.666738191730959 1328.628670510494 21.38301641672473 2.069922205412337 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_3 2.663787084014062 822.1516050502767 16.88854446645439 1.699074931529083 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_3 2.66521681772277 421.2187151331979 6.2527754063518 2.188991407401669 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_3 2.667667703985707 905.609163099944 13.94352555837678 2.082737012842102 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_3 2.667830753306363 766.1157818754854 10.91351822030069 2.422749598633972 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_3 2.667611619386702 922.0838845989805 13.73670291084757 2.25549862891787 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_4 2.678692537024685 437.6653981227045 8.840846147541422 1.693209631375281 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_4 2.678331887194178 496.8890003302094 8.504576501715684 2.023502251717125 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_4 2.678261785645543 693.1298146816116 11.24200299040986 2.112936311889836 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_4 2.679290054538232 1079.285615711878 20.71149438351328 1.809567225829981 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_4 2.679795073926422 363.7803414468116 6.515796212244321 1.887211672053639 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_4 2.680219573863547 1201.802571131788 17.95479293508196 2.186773534909329 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_4 2.68153044403015 452.0238969724543 6.036583317971332 2.418369789118946 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_4 2.680416931001094 38.86179030700028 0.8154187770811101 1.63495920418199 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_4 2.679298184933487 188.8283719894774 3.462600787116176 1.902811584637146 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_4 2.681733252533603 1265.645428116531 20.85440775604655 1.975491836619343 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_4 2.678786622891305 969.0039317175294 18.25329853540315 1.808692669047089 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_4 2.680196955410339 413.8677379358241 6.397213567759524 2.174031223558281 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3a_4 2.682721604122182 1167.292690402397 15.69608591664816 2.331904634052045 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3a_4 2.683062802232226 1441.182465731842 13.73537025402196 3.306674565021328 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3a_4 2.682754370480135 1342.256062233548 16.65211316419437 2.712002125418248 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_1 2.787682270011298 543.7058350894958 9.365590187146479 1.886076732283199 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_1 2.787228038133419 571.5878018846812 8.247432588964546 2.289187155971626 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_1 2.787036100508952 800.0909962575564 11.47847671706735 2.293365573165582 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_1 2.787181688429098 1156.713820151313 20.82937581312314 1.899979818190226 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_1 2.788112892405584 554.949199792062 6.956391426136173 2.454691136451274 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_1 2.787453585776293 1262.616732221198 20.32896001318766 2.119382730352782 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_1 2.788678031599456 436.2736219596749 6.351603370277346 2.27475680553591 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_1 2.788999917411601 73.72896749281666 0.9567139831822395 2.37128452187215 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_1 2.788204372690948 364.2503553461218 3.892468288634337 2.930124163553723 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_1 2.788183058321561 1568.60606020453 23.39988877042981 2.130143156314118 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_1 2.787095996228961 1002.350587459682 18.2890535430558 1.862411601282466 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_1 2.788278666378338 351.6012705778119 6.300224964647531 1.920461261722923 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_1 2.788962755270479 986.7456318263986 17.14265624079616 1.958889177912275 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_1 2.788907146723852 1220.216926822946 14.70016398439735 2.730379208612505 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_1 2.788523481452988 1662.170733090028 19.51921999380805 2.630873822612098 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_2 2.793593212782021 490.1825030838338 9.060755830130098 1.812617147756666 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_2 2.793040675288709 555.0998167008999 7.936373943994838 2.246920200623257 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_2 2.792972017255245 743.8366087859399 10.66210718279504 2.198605757271612 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_2 2.793084938285201 1304.182418656191 22.09430331353725 1.954439149766328 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_2 2.794114617670899 355.4318298579245 6.322907325983582 1.885657338034879 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_2 2.793288193805575 1226.869022867956 18.2310297538016 2.250026764954117 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_2 2.794588827740582 408.8978256976201 6.145752944366591 2.216871007612441 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_2 2.794997325075764 35.33016629756993 0.7728730511554022 1.603440898320499 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_2 2.794306059023695 175.4014618663992 3.066454142534688 1.991755408209531 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_2 2.794262462174661 1245.791787375132 20.28111592864753 1.999952255055107 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_2 2.793092436049667 951.196948550172 17.99006905036159 1.808692669047089 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_2 2.794056252287251 373.7880036705486 6.067693873634591 2.093384227732563 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_2 2.79476699991842 1142.907762637163 16.67638108298321 2.318470522408421 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_2 2.794623283258399 1394.623050270313 15.53293837403041 3.032516259302629 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_2 2.794363634450084 1296.546932123385 17.07659855903898 2.558662107406039 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_3 2.816834582760265 312.739591422256 6.168731333437723 1.693209631375281 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_3 2.816293140829166 337.2566721838664 5.685349518883596 2.015814810695443 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_3 2.816197652535859 452.4518710678916 7.50784630912524 2.039991252709922 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_3 2.816303590129993 755.5522311432783 14.36390458758536 1.789528468201031 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_3 2.817303025693842 203.1477766485495 4.303745739363279 1.632002291035557 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_3 2.81660460213099 697.1781821261822 12.6119477192813 1.892801181490101 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_3 2.817866811091688 260.5350769111485 4.022592241627075 2.139990477473545 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_3 2.818070693480723 41.44088560496976 0.6669256442852131 1.958328285999891 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_3 2.817441510062527 135.3206631924593 2.368175542539602 1.941768610850683 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_3 2.817385745639508 879.4342166488408 14.80475049460373 1.973443972191654 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_3 2.81625432812217 685.4200511169213 12.46889250462563 1.808692669047089 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_3 2.817370755756714 224.8740872717681 4.257073276010889 1.810843524204918 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_3 2.818137733088407 720.914840557301 11.7472795803907 2.06850691543028 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_3 2.81810572186225 993.6656703416888 10.04094618294279 3.078691161679964 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_3 2.817558593408594 1121.890479830684 13.02883185110146 2.778136393581195 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_4 2.822798799690441 358.1577129804745 6.109007978549119 1.869923796172124 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_4 2.822264913535076 363.4875478414081 5.329518005005069 2.245144819463602 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_4 2.822131848857208 550.9301724251934 7.323768385795345 2.429486384309347 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_4 2.822304854515821 910.994995491739 14.23455803467542 2.016902293700163 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_4 2.823271693280488 390.9910874655487 4.751173729748072 2.532174220339092 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_4 2.822506491584924 878.9737520419073 12.3546215150734 2.327806735029926 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_4 2.823672137590875 337.091649724817 4.243104364974648 2.650199414776401 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_4 2.824119319269571 25.98560071780079 0.5356375917675045 1.70023761979571 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_4 2.823405146433771 166.9144008954846 2.29360833618131 2.352090315201897 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_4 2.823451197057775 839.3444769046074 13.8682932191643 1.989534308678246 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_4 2.822273427828263 665.6449084446326 11.95490738595923 1.862411601282466 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_4 2.823370909381856 288.6559067905886 4.367206288368399 2.157459177770883 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Asp-3b_4 2.824065283453924 682.8548319744149 10.75055068791751 2.142742960040559 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Asp-3b_4 2.823829759483463 816.7727216077899 9.684976049835395 2.94100782563397 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Asp-3b_4 2.823641202751168 802.1101676432653 10.94255465568592 2.445294239765845 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A CXP-6_1 8.144634189010507 69.9678464716748 1.450944177655709 1.785395651105065 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A CXP-6_1 8.147912640760055 116.0652210258286 1.874402954952774 2.160578767869104 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A CXP-6_1 8.144915861423213 78.26336471583339 1.452548797485391 1.906887717264189 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A CXP-6_1 8.144908336499645 63.60838866890042 1.368748838463405 1.673738626157418 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A CXP-6_1 8.14524516859688 49.66262780877499 1.048764485101673 1.724793584174255 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A CXP-6_1 8.146008143829595 371.2892507355968 5.634587473413382 2.411590225396118 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A CXP-6_1 8.148473801101632 88.80378257814651 1.544565756028878 1.988462501149811 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A CXP-6_1 8.147023550393161 43.13141365237813 0.3089906478653872 4.829772273245138 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A CXP-6_1 8.145286957187006 29.60270634292188 0.6811594371572244 1.61523369397442 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A CXP-6_1 8.146174845559681 231.1549958564741 3.429035861966735 2.352134859575016 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A CXP-6_1 8.14509101787049 70.06983206649656 1.452569158882998 1.710826937129946 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A CXP-6_1 8.145576643914001 47.26291565652964 0.8011702261236802 2.058385291898967 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A CXP-6_1 8.1475138750209 295.4124820499816 1.649566136372916 5.775381488933138 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A CXP-6_1 8.147060816111976 314.8405909703023 2.169430677266457 4.920964662635166 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A CXP-6_1 8.14682895941561 184.6705734761547 2.51175304075993 2.596588823855582 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A CXP-6_2 8.14910138860165 66.69984187384462 1.511787478861911 1.679712132633462 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A CXP-6_2 8.14808348759098 137.5627337094402 2.332793365777264 2.089312613196423 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A CXP-6_2 8.14756907764898 147.7926475328777 2.529717946298169 2.045655164415904 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A CXP-6_2 8.14911193133309 40.06627969249417 0.9354624409746185 1.522384553517552 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A CXP-6_2 8.149800625732459 23.38730729083238 0.461447866542987 1.696072028203115 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A CXP-6_2 8.147966817225422 91.06336557967964 1.603019896194983 2.022745915654647 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A CXP-6_2 8.148655018851192 80.32401421532572 1.409939832331627 1.920461261722923 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Creat_1 3.023448931559919 933.1206026563727 17.58612177210328 1.802827368893286 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Creat_1 3.023086357044388 1201.672879469285 22.35408216255298 1.91013909217337 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Creat_1 3.023193561932584 1186.672403865845 20.41514049810917 2.027928144083099 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Creat_1 3.023212823571052 1522.034938580132 29.4923743065995 1.809567225829981 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Creat_1 3.023284944428963 757.8451063177156 15.13852507712792 1.741620028553562 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Creat_1 3.023778941872146 2268.89652257757 40.12289965913693 1.973119275324097 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Creat_1 3.02325325081082 1559.596842120937 25.42575891123979 2.119454867686752 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Creat_1 3.023634438299578 189.975597240271 3.9429429628914 1.674711129285865 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Creat_1 3.023559287250808 399.1220662233824 7.210544594945302 1.922578865361259 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Creat_1 3.023951486484619 2260.240769740411 36.86548439256972 2.082737012842102 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Creat_1 3.023163579641468 1065.605817105032 20.55714341572655 1.808692669047089 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Creat_1 3.023450882940698 1097.06907682683 18.89417288532601 1.973119275324097 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Creat_1 3.023373139510184 1556.724969181339 27.45966156690479 1.973119275324097 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Creat_1 3.02372220067166 1890.668415121781 24.82227325850402 2.588338469797924 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Creat_1 3.023709053158611 2437.822000604532 37.70797137729691 2.213475045609611 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_1 2.927182671011043 184.7631068389522 2.661276097592054 2.422458158308908 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_1 2.926967793245248 213.6604715711617 3.207948982993454 2.400079533547433 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_1 2.926987632635512 377.4662487597541 5.374985306826868 2.507261658019067 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_1 2.927226414222435 606.4431399129313 9.033814246732229 2.3726844713511 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_1 2.927424705727145 325.5255011191334 4.358300299597923 2.549112154666445 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_1 2.927908482758016 794.2663610782505 11.51275075826835 2.451222717108915 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_1 2.928130523436207 180.7188999222656 2.588058494221084 2.485845406119053 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_1 2.927865582110107 40.10395977746126 0.5283507989296129 2.59546300474174 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_1 2.927499551590917 150.8629063678489 2.13752581409624 2.538581548220854 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_1 2.928354740381706 965.8933659067349 13.02449662957559 2.606299305191104 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_1 2.927014192399133 606.8638180844506 9.285941463147966 2.329439988730956 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_1 2.927756228967892 419.0353018251287 5.561042232387575 2.629210633094551 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_1 2.928363639501292 523.0483246379054 6.805786461943404 2.681602848013422 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_1 2.928661322140627 1028.050357279923 10.07804892191436 3.38828290325999 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_1 2.928455866839862 976.765366163873 12.86182508958946 2.662030402757653 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_2 2.943347491350491 130.3203737270846 2.376124731102228 2.022062843929297 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_2 2.943051112607994 176.231050343275 2.803848069803489 2.22410874670478 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_2 2.943056815033398 340.3894068353451 5.034633289565239 2.413561617708557 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_2 2.943301524320682 599.8496417326327 8.989846932351496 2.337562869754351 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_2 2.943499411269209 272.7580434737797 4.23419484916946 2.263846352174691 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_2 2.944053918673847 704.3109334490334 10.70845225026538 2.345187625703343 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_2 2.944072356171469 164.1276498288059 2.511512205334693 2.353941595257889 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_2 2.943753771567934 32.83639778036938 0.5569225967356957 2.095685430719842 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_2 2.943579983845433 125.6919285266829 1.896651850069655 2.341585555715352 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_2 2.944540097104583 845.5236490792282 12.4281281731883 2.411914922263675 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_2 2.943111988130059 616.1492330512003 9.320967078421878 2.306512962073368 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_2 2.943782172579029 351.3688799641548 5.226750744208844 2.35483211315611 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_2 2.944512360864231 503.8939017734638 6.638290902014491 2.655475552629394 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_2 2.944753141505171 692.1262907279925 8.59686189647278 2.851371037288538 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_2 2.944579226179378 889.3894406235704 11.46149701689219 2.714823853057128 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_3 2.95101648215554 194.0521758614036 2.991619248965668 2.291510495325655 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_3 2.950699595204722 228.000533708377 3.36373407691978 2.413110523678077 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_3 2.950765143742375 412.8491953411312 5.891219022391261 2.512539321102026 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_3 2.950998515807227 686.3837337115817 10.06667480381203 2.396868890904661 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_3 2.951185720787912 305.9957662923164 4.738684915289033 2.299390477894097 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_3 2.951762139223245 816.891555188148 11.83666053330258 2.424893998168303 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_3 2.951688835764535 181.0613228241101 2.719472389975909 2.355171481036135 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_3 2.951539464779172 34.3763597781952 0.562535984312848 2.210074074508252 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_3 2.95131186411501 140.434799445385 2.187185668999105 2.301933489484042 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_3 2.952236882626036 974.3406396400096 13.72667635640739 2.487935691825051 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_3 2.950797223496733 713.377360755706 10.53573507514572 2.382061686279116 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_3 2.951472919845739 373.172680811406 5.684719413238334 2.333589886053103 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_3 2.952038669270685 544.5401803906188 7.440003523139498 2.566291773148125 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_3 2.952375882522795 735.5261643180604 9.311401970814863 2.810604072282702 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_3 2.952240426359284 837.7161160062152 11.54712689910362 2.576016831673126 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_4 2.967375567546434 190.6739692591167 2.742342167853563 2.42605547348894 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_4 2.967072157015345 225.5106814973283 3.002827148417992 2.620400931683553 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_4 2.96709099111824 615.0375483888016 6.22342643773109 3.27289036912682 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_4 2.967291540696929 736.5285863131674 9.843165745264292 2.592718022043301 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_4 2.967450239141251 313.3169499681202 4.531989159591801 2.410045897436635 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_4 2.968097064064005 1059.217030297255 12.62593936615946 2.867645453331674 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_4 2.96807650612573 181.1984255967702 2.573393697324396 2.491427030046111 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_4 2.967891115517538 33.34238528128432 0.5219797625633513 2.247388641446588 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_4 2.967550331759095 183.7845047851779 2.226103017135012 2.8389484547648 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_4 2.968512518495559 968.7831228910852 13.38266608492483 2.544198426029941 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_4 2.967084709155733 736.9603456748312 10.20788041933879 2.519065775589477 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_4 2.967740526639268 390.3953414380693 5.624453469254602 2.461436624964722 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Cys-3-GSH_4 2.968312339579031 547.4987831766047 7.053184961610038 2.708500043085607 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Cys-3-GSH_4 2.968740220675397 828.6433128482631 9.393068972373907 3.078159218287535 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Cys-3-GSH_4 2.968607876553238 890.116615756763 11.34671704886832 2.752880404885672 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A DSS_1 -0.000110037989108261 29750.22416616378 574.9004234716842 1.793277181328256 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A DSS_1 -0.0004060779533427199 30191.6086630239 539.784146806185 1.951628221706242 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A DSS_1 -0.0003676122255957544 29679.47468331361 428.145715023313 2.418775546811409 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A DSS_1 -0.0003790957672091364 29023.78436591278 440.0112019548218 2.288602090305313 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A DSS_1 -0.0002599066262223844 29078.53951531613 631.2101152343137 1.626598080578004 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A DSS_1 0.0001960627837693836 30581.72946782045 360.7544839389853 2.932350308027232 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A DSS_1 -0.0001698911072455573 29848.22650217998 589.2470641358391 1.798521069923602 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A DSS_1 1e-05 27814.250028 653.340753 1.534648 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A DSS_1 5.229371470452425e-06 29757.16707764186 621.8158662134102 1.744847053794775 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A DSS_1 0.0003788277765887336 30539.13883523631 338.1062044925544 3.118057584930295 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A DSS_1 -0.0004380706398013336 29922.79231775239 448.3892337521805 2.323270752385424 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A DSS_1 -0.0001016278464872783 29540.07732725337 479.1459660039689 2.134880983666542 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A DSS_1 -0.0004384072305918867 31038.20048465769 302.4094315492429 3.608882934271424 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A DSS_1 8.840078405102928e-05 29910.61596052679 270.1285462390665 3.841373651645925 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A DSS_1 -3.621519003688508e-05 29788.18208375984 274.3517240546302 3.793637217143649 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A For_1 8.442629264837251 115.400593862374 2.762400655946398 1.42503058773407 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A For_1 8.442478198293834 167.6242991144888 3.583314259823613 1.699074931529083 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A For_1 8.442644634505248 153.2145258107752 3.353904306946243 1.653893992634481 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A For_1 8.442783427663336 204.0930379311149 4.782848680571794 1.504686369167523 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A For_1 8.44235912697767 124.5640511180301 2.926078203189162 1.479839456493073 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A For_1 8.443829848573126 170.6790613053978 3.802738012608911 1.589457194011078 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A For_1 8.44266892714173 123.4312791532489 2.148199095693948 2.055291014877563 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A For_1 8.442379315281478 84.38930286445876 2.120546026656123 1.402095912725433 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A For_1 8.442482409902505 119.0589874192459 2.780789411774458 1.579627067948544 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A For_1 8.44390589437685 219.702851530805 4.545549313893229 1.634364590984763 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A For_1 8.442632509703197 181.646137852348 4.251063443927165 1.479839456493073 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A For_1 8.442723892199577 166.6585836302148 3.581500545538335 1.589457194011078 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A For_1 8.442600376995799 200.6266541077179 3.793308601146058 1.727923033540723 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A For_1 8.44331509058601 207.462379752822 3.262276263237736 2.192354750360107 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A For_1 8.443391337643353 230.8489759739389 3.908950248014907 2.006850679727858 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Fum_1 6.508075765577398 31.15132176977269 0.6592708289188624 1.580684016893347 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Fum_1 6.509340232086394 57.14155874195701 1.216574876160935 1.562883733901917 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Fum_1 6.507855764261742 41.69461611423871 0.8982094471622083 1.53420270177497 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Fum_1 6.507968481184307 26.2117414810905 0.6727404804154069 1.35205583429991 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Fum_1 6.508890973310353 33.82873137599506 0.3675149723558161 2.832293859769864 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Fum_1 6.508839453161619 18.02326771823373 0.4407788002619515 1.433462721389301 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_1 2.139464145934968 599.905197696086 6.393500984248412 3.030375187779299 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_1 2.138525320770916 393.3814838831536 5.476996432882186 2.483180819825381 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_1 2.137907720874299 689.8356309608943 8.991721047387195 2.688212305578996 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_1 2.138681761213015 1135.563565993723 15.88116020198056 2.494940452352382 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_1 2.142029629595925 560.4306786761625 5.742041409098346 3.499308041601256 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_1 2.137843812874277 1524.994489760536 17.5368291132313 3.034227679322572 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_1 2.1448321899999 177.5554797280149 2.457132840714351 2.505458882664449 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_1 2.155774870330668 31.67780605045703 0.4975364291681715 2.194169997680273 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_1 2.141594547614814 297.0727718222308 3.364142606698908 3.176093919517872 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_1 2.140563111094801 2159.10713316532 21.27830698501351 3.296845350792864 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_1 2.138430795372326 1122.687268620437 13.25187812488381 2.829164764900934 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_1 2.141747293401093 782.6500651197529 7.607511860759137 3.62004964905129 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_1 2.146329448691732 737.5691775703 8.940316178443947 2.974065107606179 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_1 2.144880981106559 656.6843507337612 7.503589175762132 3.037686375026991 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_1 2.142782853988202 1699.314527512839 13.04913150788776 4.659894526456119 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_2 2.150649377512208 617.9024886110474 5.802807754035139 3.701070531350485 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_2 2.149028601568809 759.958757066976 6.61543913721458 4.080900327609657 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_2 2.148554106950114 1108.525964474223 10.792896254166 3.65533572619153 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_2 2.148999789806689 1464.68698789912 15.23832361146918 3.295329679859702 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_2 2.153421168993383 722.4942449313395 6.331415416597749 3.87970122747497 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_2 2.148213613236013 1586.62003722282 18.43515465314236 2.940612517283599 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_2 2.15586902089634 268.4702606636696 3.031508030587949 3.142437823602113 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_2 2.164542478842125 26.62321191085748 0.6277356706068136 1.479839456493073 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_2 2.152923924195424 373.807385197927 3.587904752964493 3.623622194009715 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_2 2.151381437746223 1180.137980286496 14.80944587932108 2.707953664316579 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_2 2.148741973295409 1111.003281362082 12.49533896866883 3.079299885177873 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_2 2.152673446839245 457.1708217205418 6.440453802628219 2.476811733465441 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_2 2.157007769575446 611.3641843609084 7.60651223624483 2.753419501758733 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_2 2.155744525743645 1717.329136868438 11.71443919627537 4.819821716849809 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_2 2.154582714282036 1469.339556421674 13.23049123557601 4.006356560444392 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_3 2.163407750793885 242.8851693845122 2.666395002818282 3.395940428736103 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_3 2.161514017247432 219.0752259270836 2.555463284824155 2.991262895998732 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_3 2.161039326480791 263.6602162742789 3.495308485941155 2.629485795694375 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_3 2.161934901430932 377.2897144666039 5.47654265154069 2.441953036713828 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_3 2.165327516867576 312.5609968825319 3.244243136380544 3.4876321033523 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_3 2.161089809609571 486.2187130404063 7.131846969711065 2.400067447869315 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_3 2.164761472161205 22.95400437110014 0.5702929086573636 1.443068950823662 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_3 2.177341139472572 22.2235525824616 0.5430834749142109 1.427834456856143 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_3 2.164897084183749 123.0899268105983 1.998389750349322 2.192233470860059 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_3 2.164349634937768 544.1813854944459 7.172173561977745 2.697067988391127 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_3 2.161601537958558 326.1662264432422 4.636468962437145 2.475382219073617 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_3 2.165152052156595 359.8002193218781 4.337978361777648 2.781605757786614 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_3 2.169871281277209 341.7882967486764 3.788215420365622 3.116568166379586 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_3 2.168056475559149 431.8201448360846 3.929743294863738 3.721614416213784 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_3 2.166764409212246 384.8484392248384 4.479134350259218 3.036717778658773 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_4 2.163407750793885 242.8851693845122 2.666395002818282 3.395940428736103 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_4 2.161514017247432 219.0752259270836 2.555463284824155 2.991262895998732 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_4 2.161039326480791 263.6602162742789 3.495308485941155 2.629485795694375 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_4 2.161934901430932 377.2897144666039 5.47654265154069 2.441953036713828 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_4 2.165327516867576 312.5609968825319 3.244243136380544 3.4876321033523 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_4 2.161089809609571 486.2187130404063 7.131846969711065 2.400067447869315 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_4 2.164761472161205 22.95400437110014 0.5702929086573636 1.443068950823662 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_4 2.177341139472572 22.2235525824616 0.5430834749142109 1.427834456856143 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_4 2.164897084183749 123.0899268105983 1.998389750349322 2.192233470860059 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_4 2.164349634937768 544.1813854944459 7.172173561977745 2.697067988391127 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_4 2.161601537958558 326.1662264432422 4.636468962437145 2.475382219073617 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_4 2.165152052156595 359.8002193218781 4.337978361777648 2.781605757786614 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-3_4 2.169871281277209 341.7882967486764 3.788215420365622 3.116568166379586 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-3_4 2.168056475559149 431.8201448360846 3.929743294863738 3.721614416213784 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-3_4 2.166764409212246 384.8484392248384 4.479134350259218 3.036717778658773 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_1 2.476061067845594 36.81550998968741 0.5866575068320911 2.249949562312449 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_1 2.475446878635442 46.19450002768722 0.629193668686989 2.561750847603851 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_1 2.47493881679439 69.62366793958087 1.060195279444199 2.299864420011146 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_1 2.475229485657308 123.5733962906831 1.988033148825555 2.22212514278383 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_1 2.477365911059406 40.47322323434726 0.683690470051982 2.150827402684667 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_1 2.475149519326899 121.1902467197646 1.64616025444313 2.639502950141117 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_1 2.479118214516393 35.09683198222572 0.6092280266505933 2.00155937880994 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_1 2.504830590335147 18.68119723480579 0.3368748302765427 1.934788589289345 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_1 2.477333839200174 28.35944865761648 0.3805945551272918 2.599957051225213 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_1 2.476648427333978 188.7762130908235 3.160651382321649 2.117648107039045 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_1 2.475068446987295 107.8184632776519 1.64399798980141 2.288351933156616 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_1 2.477210065893224 49.64827304470176 0.8069694913078908 2.205838053768453 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_1 2.480132193803023 72.97361986298267 1.029137676250692 2.542254390398088 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_1 2.479145078915562 95.33237673071045 1.223121493372303 2.794456904908396 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_1 2.478164108127957 104.8710508873872 1.514599947632039 2.40892055764404 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_10 2.554246131901581 87.71348249769413 1.402627805658475 2.071015256397196 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_10 2.560240581889916 76.19491185880726 1.098990420234502 2.419151269645381 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_10 2.547566483079547 361.2542896170654 4.143570942711553 2.960302316202799 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_10 2.554519962333356 149.9182257741271 2.655901395203189 2.014433404551691 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_10 2.562627125762951 61.01282337608158 1.197544431641311 1.839594500245032 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_10 2.555296715187409 181.8747757443028 2.529146301595341 2.511022671988601 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_10 2.555250662399223 273.0911764216988 3.391472230150398 2.785074031004265 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_10 2.554626922789692 153.3732264459179 2.63841665418947 2.060043012390371 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_10 2.562562142176183 83.65070863420739 1.443859625826365 2.030078999240929 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_10 2.552261432007777 267.3507764295838 3.320350364991651 2.777061021629798 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_10 2.54431729603909 243.8398916839503 2.129083177120799 3.877799852236492 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_10 2.544032775575606 53.52562559853071 0.82225302537548 2.211535396950887 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_11 2.561131888981254 49.04419740529791 0.9533960520073189 1.802827368893286 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_11 2.57325642535876 38.11438743590048 0.6611846868011628 2.017602049751496 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_11 2.55450146616293 108.602393254054 1.618724542126214 2.351671905990198 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_11 2.560669553693546 194.0660519422406 3.264735069271279 2.094373637730064 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_11 2.575260721848974 24.44605098044579 0.4474808005315881 1.922005956742223 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_11 2.560642229687396 271.0656250852832 4.426427221194941 2.163847346425548 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_11 2.562358505478564 213.6798768142583 3.595769101304567 2.082737012842102 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_11 2.56047365603596 180.0707792914047 2.750505159200612 2.253576941990695 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_11 2.575327947177947 39.13561243258488 0.691577076948538 1.974524406062711 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_11 2.564582568056852 80.58895872488506 1.331525681509227 2.137888109738425 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_11 2.551550143209126 489.8983537103057 4.383924891727454 3.8620897720912 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_11 2.550962263286685 1070.059343916553 6.614927053243533 4.977490507189687 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_12 2.573874872309272 28.26221051505267 0.4972923059327745 1.973119275324097 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_12 2.560151321221904 127.9693472266793 2.000779040058529 2.239711766156314 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_12 2.57376848197684 94.2279414064458 1.560657216236327 2.10670215643276 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_12 2.573613711339707 146.9722335126766 1.75477621143473 2.917178637810257 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_12 2.57526342911295 110.3199492612567 1.519273626842303 2.533663971709572 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_12 2.569424466587165 26.72622184755449 0.5259179169323327 1.773170771497706 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_12 2.566313151925305 110.7570636732298 0.3942474134614558 13.39036199281941 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_12 2.556059520139419 1058.396004400401 3.211435966800594 11.19943658703402 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_12 2.563417518945278 216.4174248968372 3.234481484731198 2.365116366435875 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_13 2.573123934533241 68.66253190747499 1.154246370075327 2.082737012842102 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_13 2.57346971174461 75.27432018475047 1.332450735106793 1.994514927359284 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_13 2.573309230219067 49.24071910653497 0.8814371681654963 1.958889177912275 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_13 2.564048353778024 223.9833375237476 2.595302519606976 2.957456235117139 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_13 2.567601521841874 23.60352032558325 0.4767125507008464 1.791681685312394 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_14 2.577636251945829 97.26502334304647 1.379023265145209 2.396803071860631 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_14 2.568014518339573 68.59783813159281 0.8897436829223614 2.574884297077073 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_14 2.576698117839803 193.4282631987053 1.684315697566351 3.803258321275852 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_15 2.573290066949383 67.51893933968842 0.9132939088032765 2.579562243130537 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_16 2.577484484506928 153.1341915360589 1.738132080365694 3.06381576362825 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_2 2.488674134137126 55.21239094285894 1.045036595855228 1.869356222313044 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_2 2.487901455058848 66.55061100277288 1.176260327126686 2.013130914122386 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_2 2.487618949715657 117.1590225921791 1.965143208682177 2.211285426371036 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_2 2.488022795881847 207.1789661041581 3.459932233831395 2.146864637509252 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_2 2.49024317764076 68.50783558768585 1.171784948922137 2.117468180286101 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_2 2.487718997552449 231.0976147784295 3.880520205644407 2.130007287045602 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_2 2.49181927457322 22.56072511677424 0.4163013114427772 1.890933415176548 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_2 2.517259004129169 59.2977104138422 0.6605571930073115 3.050526128144897 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_2 2.49002678354761 34.52881673428125 0.608615602817433 2.120640426799023 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_2 2.489455264984233 257.0046603885929 3.990591424243745 2.24716361911911 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_2 2.487853097214844 154.2506054501269 2.74329130167958 2.031600270157883 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_2 2.490156571691604 87.38062091512845 1.426218397366411 2.16204524597648 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_2 2.492318413143635 104.1478387623468 1.435390013248831 2.518782398722076 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_2 2.491673396475226 167.4799940620115 2.270845905208828 2.623110165057445 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_2 2.491051272332819 179.8686653438373 2.574254376296667 2.503336487634915 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_3 2.501555903949754 150.4322447800409 2.292721589910154 2.301209904130239 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_3 2.500812971002763 173.6344743583049 2.65670887103169 2.299002575655159 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_3 2.500487673512029 299.2660510017878 4.380660184993618 2.448608309338318 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_3 2.500886392111121 485.5340056392666 7.248941594338474 2.33709309921116 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_3 2.503162802644331 173.2027126492339 2.55304701023486 2.351792183250038 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_3 2.500589064219704 674.2342057828506 8.337705826327094 2.745436603698225 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_3 2.504453337337699 76.80050662429181 1.248752500867814 2.159929404119973 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_3 2.532473917078863 114.9680173824424 0.4712155476015176 7.823415297589482 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_3 2.503070409812401 97.02866940523903 1.471273085715793 2.310778363121138 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_3 2.502372570161941 529.377525181266 8.04853366094498 2.30229718474567 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_3 2.500748308853375 388.291112022813 5.773674285365396 2.345792540669296 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_3 2.502983447781987 222.3191947185501 3.135183564801326 2.477255507356861 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_3 2.505222096414112 206.0283569714458 3.058580973216017 2.397360127984296 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_3 2.495954252411968 103.0612151249471 1.018137586932805 3.531992309616172 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_3 2.495765588142495 61.22092248172745 0.7184308667582112 3.141712593476722 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_4 2.514436766220959 235.1412486589493 3.737694755998661 2.181391147693346 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_4 2.513637912410314 266.9429172667061 4.05280011619012 2.299383806654367 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_4 2.513333284814926 482.1508532733374 6.87270110472913 2.46337947703846 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_4 2.513663016565464 820.621799679713 11.61960144098837 2.42310800644403 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_4 2.515907804054506 306.7672572560267 4.338890886902817 2.406609095893038 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_4 2.513377891082496 968.099014925755 13.25716732398319 2.512987880148204 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_4 2.517237125292573 123.9807495869447 1.998844648789903 2.223831152522144 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_4 2.538523307526295 22.25678731225675 0.416850401832078 1.902765297189193 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_4 2.515853927428254 166.7744243736346 2.385518223176986 2.439369970720382 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_4 2.515139124598583 1012.711366123264 13.67254077587314 2.517002850719924 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_4 2.513538354987528 708.9206628539798 9.58202468837446 2.466420600060426 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_4 2.515795924483981 375.057993632698 5.212450569787395 2.460822400411497 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_4 2.518074313447803 407.0927051920586 5.392075045257311 2.570449152326816 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_4 2.504460129065991 431.7485738341668 4.227665004168109 3.437526721564532 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_4 2.503693216414217 402.3731952363634 5.067710021692958 2.783958500434282 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_5 2.522620028399886 115.6642182571605 1.697007825585045 2.343675579561272 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_5 2.521784669973733 93.76020166537266 1.458329219057324 2.290960641680934 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_5 2.521522074132293 298.8948630134495 3.699661073575698 2.796384806924016 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_5 2.522000830734134 346.5345537896055 4.889477583470152 2.465611722613737 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_5 2.524027835039566 155.648983580784 2.023501254945799 2.622812230022164 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_5 2.52198743370609 567.4280262576091 7.261446301417695 2.726582317383714 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_5 2.530657942482876 270.1035087732308 1.911525315618783 4.648235000784751 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_5 2.551643844579517 20.86611409973377 0.3496865214680386 2.029090832349727 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_5 2.52392396925371 68.7085077975689 1.04392875722482 2.345625058145371 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_5 2.523705012018219 511.2040422411766 6.715735634363265 2.6224269848091 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_5 2.52186687806087 379.8142226486128 4.743918348078578 2.716585904882472 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_5 2.524007217771889 186.9385370642565 2.471573387022327 2.639102699013207 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_5 2.526153590979148 196.6210323761715 2.124930752160465 2.984431230559323 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_5 2.517359292805712 856.1642241187458 7.445412870666553 3.789874935600927 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_5 2.516464337864918 742.1885822090235 8.805406512967153 2.892958424456328 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_6 2.527717666564365 261.2944682134966 2.168011172410429 4.040653578154443 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_6 2.526531104557559 518.1713435521084 2.704529047024517 6.226771537630307 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_6 2.525901594850936 258.0217432644213 3.275018107991641 2.768288386995936 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_6 2.526531095704939 766.8238987178095 6.564138675448698 3.73266370235266 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_6 2.529255619352897 281.5412378044516 2.733446035275129 3.487436535868263 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_6 2.5263946866721 743.9500827475482 7.498332239549969 3.220750066762115 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_6 2.538367819119804 139.7039183146437 2.14396704513639 2.300070173280343 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_6 2.559311738071577 19.75437697992828 0.3407689336952174 2.058571208633825 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_6 2.529078062987149 131.598312352596 1.26316977446926 3.544338427747252 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_6 2.528330221238673 746.1905931780922 8.5647498098746 2.992986340169371 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_6 2.526214198413431 321.5867181224963 4.288688636587702 2.608503315531975 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_6 2.528922303730585 295.7999520203299 2.929852159951988 3.430833508717169 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_6 2.530914651578605 635.1083020407849 4.348645822284143 4.602635767657241 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_6 2.525552825618991 474.8340871833426 4.369256288381732 3.791973815731683 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_6 2.524865461158299 459.2699314813842 5.188583713217517 3.074651276366638 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_7 2.535536081840988 236.6500317843029 3.293248040863096 2.507339176190154 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_7 2.534780764149417 260.7138230542775 3.615565720871044 2.525648945211008 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_7 2.52914647796795 82.09898770616029 1.179232221351336 2.369832069911838 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_7 2.535079921682897 839.5785081397196 10.59889789058681 2.70443123739382 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_7 2.536990615896806 286.5764559066248 4.107368762731983 2.434488755549042 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_7 2.535018215768174 1225.902843579853 13.52695578013634 3.079663263670034 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_7 2.551480201871665 76.9231167913079 1.172851838066874 2.286689836422962 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_7 2.536783357325378 130.1356465796451 1.965789005095952 2.35787889187919 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_7 2.536695842686382 1080.640536353417 12.62789827712069 2.908020274580756 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_7 2.529348540572028 149.9217502433122 1.876418653947622 2.672249659795528 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_7 2.536914274545951 380.8292291711779 5.062731605766529 2.561339582076881 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_7 2.539137198693298 417.8533458453979 5.489306535296174 2.602233093252651 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_7 2.529861271624973 502.5906195758837 4.56569395592006 3.65851559356527 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_7 2.529334904350222 515.3933540662058 5.722106978461971 3.087460161994686 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_8 2.54341111494669 28.76436949185747 0.5960170730236071 1.730305356764634 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_8 2.547888222845061 160.3932903031796 2.220287933375452 2.576128013060004 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_8 2.534552493162024 578.8201582021485 7.008865590969642 2.824313799815916 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_8 2.543229777101673 47.49624123605872 0.8625660199237052 1.913832991542876 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_8 2.549947273799224 168.3312238739718 2.543337893492055 2.299764657645246 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_8 2.543945804628263 100.1636496274921 1.658889530804585 2.149379256368761 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_8 2.55711398286225 118.2437942687351 1.220751792732449 3.100749753672204 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_8 2.549825495479576 64.86657862672891 1.134238978818111 2.076926303679408 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_8 2.544485768625842 81.80529558544416 1.545657101352369 2.000786622011896 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_8 2.534841077001015 668.4560981513032 8.688984426993105 2.624412477224588 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_8 2.549924938291152 200.0585274083335 2.950451591713905 2.365917167569213 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_8 2.54391691781107 55.44068421742529 1.110327652960199 1.758059746337271 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_8 2.533517664288405 384.2379419872046 3.110652905848547 3.995967081800178 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_8 2.533422997417648 122.5958247863836 1.999746237794422 2.18428705187488 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_9 2.548550760815959 145.8954113437296 1.991598303937019 2.474719841165725 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_9 2.554472159857145 87.5924211902638 1.455883846267703 2.21777851666224 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_9 2.542982767314311 44.34936807772808 0.7557408373158989 2.047601820598172 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_9 2.548031040615824 526.6177099205847 6.418819693413516 2.797145666004361 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_9 2.55543863250637 102.4176865116543 1.486274655724493 2.353579592645638 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_9 2.547936185079657 617.4903536067101 7.961332712486705 2.691435495972445 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_9 2.562552418205539 22.22900487084043 0.448640302338247 1.769125474439768 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_9 2.5496304561499 531.8927455769511 7.063140174602208 2.596360713210895 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_9 2.54779093857274 511.3849095278648 5.546003746444296 2.986010837288823 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_9 2.555544566352995 43.66364628993169 0.7396033579555417 2.064973806175061 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSH+GSSG-4_9 2.548155557307567 14.28526362765098 0.4084790512847988 1.326915511957446 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSH+GSSG-4_9 2.53871574150166 728.3310146731993 7.700163234472301 3.241667584805733 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSH+GSSG-4_9 2.538014945253146 851.9141424017099 9.514514394701804 3.037332096961092 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_1 4.745660845532181 154.059308172634 2.390885919689786 2.252021896916613 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_1 4.745431771917732 155.6386653147935 2.56798975953091 2.205247842130935 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_1 4.745609012643076 292.8081580266581 4.395626327629385 2.381221887525374 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_1 4.745607080090758 570.4595580725362 7.917158195958374 2.466180122106547 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_1 4.74531588370171 281.4008370798713 3.7614376597663 2.549112154666445 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_1 4.746511543807628 688.0727283206669 9.561345045087664 2.503269286816422 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_1 4.745586890092101 181.4577573529874 2.210877383641146 2.863794452370997 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_1 4.745386435574704 21.88955413652176 0.3633270840315862 2.166580727011111 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_1 4.745574740690023 133.92966090183 1.788561474517766 2.611117140833875 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_1 4.746604346377246 929.2171054389096 10.95403246770555 2.85006117546814 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_1 4.745541020836198 638.9334172268959 8.059427121257142 2.636306587308029 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_1 4.745567753500379 423.4723113126409 4.590970963565601 2.993921565313951 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_1 4.7453641728393 436.0926488893341 5.173043703777278 2.85006117546814 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_1 4.746100990956132 688.9800357731039 6.611594035568094 3.577083654544385 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_1 4.746167171110933 799.411872273686 8.303580440794793 3.206318822401657 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_2 4.752440714767866 276.4263832643381 4.052321124442562 2.50027976979204 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_2 4.752132006921979 328.8272288914422 4.205351493413334 2.85084709628355 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_2 4.75250108854222 467.8561363492926 5.730559594594632 2.962317461942985 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_2 4.752716281824984 756.99451219272 8.94910171954001 2.951509925425316 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_2 4.752586439219513 356.8780970596646 4.737844168646276 2.549112154666445 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_2 4.753900211354352 651.52377580396 9.194776508857682 2.489820532390453 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_2 4.752585370118484 236.9637619621245 3.058707109099378 2.702265981856131 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_2 4.753008723682697 40.70858528871454 0.6037119207345928 2.35281196450783 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_2 4.752873393468281 163.3676413642239 2.513074663555492 2.319974465375636 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_2 4.75375413942972 1009.775433944949 11.44570172879634 2.992986340169371 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_2 4.752709543249453 682.0228386893416 8.564375791208752 2.706141199214021 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_2 4.752864655333777 416.860316740053 4.969902291475477 2.822230653149347 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_2 4.752566703353062 608.9714895979739 5.950173549815486 3.442807049001014 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_2 4.753301280122838 883.8442699757518 6.956172446745461 4.178063966104451 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_2 4.753411104502144 906.0073531240531 8.265086850607087 3.611134596645892 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_3 4.761077973558475 449.7007519619664 6.001476781103983 2.644905464341601 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_3 4.760629935762315 524.1846065357371 6.475605867489445 2.930647268920369 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_3 4.760975138825479 801.9975139380672 8.228403986262002 3.46620742532395 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_3 4.761424334561489 1010.411544834059 10.956690080646 3.45236843907741 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_3 4.76128682355341 419.453034413926 5.939147204247099 2.460981573959401 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_3 4.762696322348526 868.8835479369978 11.02350454723606 2.745647653483945 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_3 4.760938505708321 387.7339259585188 4.804999427426671 2.844526997879205 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_3 4.7617067826003 51.73413511619741 0.8212704328716814 2.172771309623443 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_3 4.761567048488289 227.4480279703358 3.328297495399657 2.422549398362579 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_3 4.762698361250541 879.1221647286599 11.54079570777172 2.655126095287182 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_3 4.761422596928607 998.9807258786394 9.974267815817548 3.429326069734462 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_3 4.761461092702515 509.8742382968918 6.142539221176614 2.896316995728109 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_3 4.761305688889931 640.3334516480293 6.733985294566239 3.267040388223123 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_3 4.761964717657997 825.9024974782146 7.865677116401242 3.74110667021106 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_3 4.762046568197278 942.0568528534984 9.525715360995552 3.463844139394707 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_4 4.769415087830366 404.3796324158309 4.728082100881748 2.759051481723387 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_4 4.769072372872765 479.5818559470879 5.551396903896264 2.894915245106792 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_4 4.769100303361887 552.0827833673652 7.017319569362695 2.707754044418713 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_4 4.769093823694705 792.1501224846265 10.23924166116475 2.639075244746989 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_4 4.76927211272579 393.5112709129109 4.896406339778834 2.804210981612867 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_4 4.76988334898854 1172.445776845255 12.8267097897682 3.189165480496841 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_4 4.769477819419446 369.3824887254434 4.186336589817628 3.058757506612302 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_4 4.770000459770208 63.50744236110803 0.6538376328239707 3.433282023939328 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_4 4.769572377612572 208.4487208912842 2.531504630573475 2.89612325838069 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_4 4.770142683599959 1255.351949301576 13.22185596492835 3.266529277151897 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_4 4.769064943124834 717.03051525616 9.044856527689737 2.67642539728989 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_4 4.769294063731181 454.1728728534225 5.527022632706023 2.86786729775393 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A GSSG-12_4 4.768887233669918 620.8959127279622 7.112531001812124 3.018900705228387 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A GSSG-12_4 4.769672053207421 843.0674482178299 8.083925181506245 3.577083654544385 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A GSSG-12_4 4.769700283761914 858.1065804068337 9.434726980709495 3.166300921545088 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_1 3.725669427749447 379.8723347662336 7.920432860592515 1.685420141345904 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_1 3.720706600980765 88.69680005194716 0.3564138182874235 7.657395073573968 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_1 3.720298519098559 285.5179209645805 3.326941186923727 2.681956201435228 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_1 3.725394095644182 751.0732201212236 15.70560708919461 1.666623499869582 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_1 3.724090112288784 110.7274608902911 2.200586691055935 1.916638857288125 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_1 3.718997263085277 320.8851652511112 5.419752664471617 2.038148861655573 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_1 3.719544220574964 192.7139167468628 2.988381293372046 2.31533783849772 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_1 3.719961537035736 60.08954098688088 1.122325554462156 1.907953046631844 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_1 3.720142668192959 135.9988326163794 2.243814280107181 2.168786284231104 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_1 3.722753436529662 338.8820600861167 3.503230725609098 3.566411109982759 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_1 3.720203039222231 16.40660311961872 0.6457561332902089 0.9367025435650753 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_1 3.720606851756657 21.64352868133941 0.6473104699588421 1.256078484610194 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_1 3.731355575146887 1734.801315693561 20.7844112570419 2.823423161394624 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_1 3.719373358891392 192.9755922839186 3.199818708012302 2.129656753514405 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_1 3.719174042653091 218.3593136833898 3.738709966233917 2.084775604914991 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_10 3.759252325207218 397.4648798640019 6.740700920530173 2.08692289306153 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_10 3.76058579004328 3116.41332884122 49.88710449605196 2.192354750360107 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_10 3.7594261594159 1189.807163583464 18.43153698419452 2.211433770164572 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_10 3.760188066463496 2142.218386679033 32.11224304236014 2.301972487878113 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_2 3.730309002265621 513.65994705305 8.899553691814257 2.12360233999093 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_2 3.72459187755253 331.6924581963249 6.358949032657285 1.870151744265542 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_2 3.724330595609658 251.8624227650152 5.668384053664737 1.58391767047344 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_2 3.730402701411495 1326.219375928275 21.91095568365475 2.177174838325124 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_2 3.728140775577403 311.9658822792591 5.311598190848752 1.979099919572817 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_2 3.721366211839046 152.2518448359801 2.692875577244084 2.023616731563731 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_2 3.730751882836387 930.2838103820017 11.7109509768833 2.699420554436254 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_2 3.728741780244204 134.8494731266128 1.830056636785729 2.781040696590075 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_2 3.722943083288991 35.33649283826743 0.7038147603455305 1.751846437089529 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_2 3.727791872128537 783.7260861081502 14.47070086493171 1.863501537806092 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_2 3.724784615288136 728.6344611593252 14.11717359264467 1.868075833409029 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_2 3.724220546483991 176.7813512761207 2.972423047420963 2.182933920104706 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_2 3.735762809330172 257.6909207972067 5.141418475542388 1.703191236730667 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_2 3.731151488233227 2095.419940494451 26.58615283499455 2.693666446657743 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_2 3.725838012099685 200.4620757475585 4.167465490121478 1.724593737405419 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_3 3.7335756778517 290.7716145455405 6.945628100946113 1.484698953867012 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_3 3.729333944640673 313.0711873322456 4.792093493907505 2.805866517437974 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_3 3.731141486202585 1872.954485309975 23.06224360643574 3.081766540802927 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_3 3.733251665242494 588.6870172361256 13.62820986952503 1.518399727104215 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_3 3.730667366804233 332.2224237214664 5.349838385620204 2.184239544165607 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_3 3.725192331927465 405.9654990051051 9.190880565916277 1.58063823019676 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_3 3.738549289373578 167.0175510448033 3.842721819234532 1.523567162674868 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_3 3.742423080107327 37.23647506966847 0.8648237251577221 1.585305564712317 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_3 3.727792189072438 171.3792087572935 3.208817098635092 1.924661058106743 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_3 3.731734970552263 1463.629540895271 28.28412384861677 1.855303782506633 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_3 3.7285844789496 283.4284655379229 5.342434251111927 1.851122846573578 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_3 3.728242127198921 424.52521337072 6.52091754885176 2.211593522692986 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_3 3.739986208475027 950.2203688707827 18.2678100961708 1.850743098420327 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_3 3.734522903645875 430.7969185938124 7.286579276302373 2.068940033504539 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_3 3.730614715554803 2252.89623195901 29.12975486879168 2.836207260586422 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_4 3.737815624487144 921.6681057853465 14.38021248922933 2.220426169455175 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_4 3.732603267516477 863.6374091497962 10.69210049225516 2.580612393448523 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_4 3.73587502755295 773.8786054942469 12.35455954433409 2.199641681732774 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_4 3.737270883342849 967.2703238105627 20.32900824393504 1.705918447139237 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_4 3.735877392017651 234.7350497785425 6.064957738380127 1.426926913953067 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_4 3.728785703787168 195.2637016378152 5.096851519155896 1.381090353334474 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_4 3.742347578217295 239.0587439566232 4.864837477345608 1.749576324487178 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_4 3.730705368605496 308.9804053077885 4.526986997183951 2.372349198389243 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_4 3.735723331538314 504.0080415844028 14.15617349334703 1.327192329661505 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_4 3.730319297357262 315.6480073119012 6.512399661731162 1.725311273053309 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_4 3.731060245614402 405.7080851560424 6.672987003759493 2.122786530280801 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_4 3.744093818327328 1188.449663428149 19.0450770758024 2.124372035685928 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_4 3.7388095510645 470.0078760915883 9.05804814274224 1.83139832367241 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_4 3.733626850354374 873.3331686167934 10.09846120857976 2.70843056403881 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_5 3.740864649299977 232.9016098422969 4.464160042374711 1.86355040147414 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_5 3.736571956837254 742.439655140038 13.4428360037958 1.960759295555008 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_5 3.74050325566514 227.0763730366708 6.011513503112994 1.487075151486523 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_5 3.74112385320274 814.0356613890526 14.80010352586812 1.971992557317494 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_5 3.740117383075998 129.7347425280891 3.682194894793622 1.310413585839322 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_5 3.73229966353315 2948.185047167594 35.41433591306008 3.006970994039255 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_5 3.745145496775987 178.0287823787838 3.598497769613159 1.738498302669384 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_5 3.735302899440561 126.1622962037943 2.999323545591559 1.515794325672195 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_5 3.740094911157272 1077.145465660867 19.00577387450735 1.918310406565094 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_5 3.732877585443433 573.6906159374912 11.89867303592507 1.681798439015205 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_5 3.73576185976215 295.5569111129522 6.999371870553034 1.570554453352799 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_5 3.747482839427987 304.2034431037224 6.084490347490089 1.774503284828956 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_5 3.742790175232071 1230.031908385054 15.12098891003731 2.809124344833013 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_5 3.737802888874334 890.624426688502 16.67674251216275 1.870676617967572 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_6 3.745512974825051 244.4774424101091 5.31008623379542 1.632419831463956 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_6 3.740587651602815 141.3135473239172 3.601680103881411 1.452606461223582 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_6 3.745186194416722 946.3397132030636 13.38255051420708 2.773161189453193 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_6 3.74523577869188 812.3424419710237 14.31080353931764 1.924928217258754 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_6 3.743933889344995 195.6653346587492 4.223835527394007 1.67486555819296 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_6 3.737146434917392 582.9329602475839 12.34358601818247 1.648904604364567 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_6 3.75002623229608 152.2985467625781 2.805291063097566 1.913937162430344 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_6 3.739544570278603 63.85012599452168 1.927380351472791 1.245305876587443 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_6 3.743405880718256 191.9678366313169 3.645426594449535 1.852310640187986 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_6 3.736922050110051 1077.364383092224 18.79421834381462 1.98333040909447 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_6 3.740059251092039 128.5521705456926 3.783253056194592 1.289254995212808 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_6 3.751736108118866 1158.162713723273 19.46487379929821 2.06850691543028 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_6 3.74612082320387 935.1569780672098 10.84157244334019 3.019914656489332 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_6 3.741686458019546 1292.572286444186 22.75870419707927 2.036263153881859 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_7 3.749342596664149 221.2689042594307 4.916869936142308 1.61022004593012 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_7 3.744568609785301 298.9040628799606 6.091168168432456 1.744250056935888 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_7 3.747535756202941 669.2730749719916 13.06880527945354 1.824725654031375 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_7 3.748086707496927 143.624501346101 3.132618087690625 1.615813147847547 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_7 3.741201271545063 625.4450109414443 12.62602280511525 1.83304799613129 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_7 3.75134532932024 2859.376049301775 7.303576352063982 18.66059290170231 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_7 3.7434383261123 281.3403788433566 4.550411616043041 2.216705395692216 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_7 3.74781527540647 454.4854385558654 10.20190085557028 1.589457194011078 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_7 3.740743335624484 183.5746059020014 3.765596917321488 1.761748422927621 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_7 3.743732429893845 373.3455145621445 6.741172422987138 1.985285303720985 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_7 3.759325175472709 1666.236769945441 23.24003183172362 2.506977865502302 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_7 3.750945690801151 578.3966978006134 8.932727624918792 2.228649939845689 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_7 3.74551046701604 1240.426983162794 19.87112815632948 2.145880891399865 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_8 3.753363838713687 52.7053198642086 1.518008687849874 1.194729003262525 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_8 3.747376768969676 274.9600089878061 5.537779401389666 1.765005540470807 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_8 3.745171877713628 1667.603966937063 31.32955680221575 1.875933608127144 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_8 3.747015301672933 481.8267323233742 7.355620708476811 2.34765113076355 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_8 3.750833548940584 853.1129335576521 14.86813947215468 1.973443972191654 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_8 3.744904824428418 497.7464207550127 9.8877261626957 1.710797493466406 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_8 3.748187732103754 186.9069567550355 3.601434357107206 1.810843524204918 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_8 3.761494617764948 418.3347864742345 8.149429919269146 1.833149151105409 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_8 3.759838232825441 3547.41003504906 35.8516101879645 3.452499989447993 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_8 3.750144314059338 737.0703442096946 11.02906298506324 2.331853608454801 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_9 3.752713515384624 104.3129391784997 2.417469942850927 1.516971173647139 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_9 3.753800623628357 155.6264933516944 2.960650556081615 1.827669501976796 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_9 3.755576859599377 438.2721960537099 7.242029617420705 2.085540802025916 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_9 3.747028763759269 459.4991088265004 10.12443763206357 1.634861380671401 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln+Glu-2_9 3.754284233926096 846.7733494303855 11.95843321288326 2.544080513688025 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln+Glu-2_9 3.763789384878128 231.779083939327 1.614201559106279 4.680947905375592 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln+Glu-2_9 3.755874553253592 790.010909044129 10.98604215996337 2.50463904127301 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_1 2.411306263797409 129.6819125634522 1.790048481675559 2.527816677096532 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_1 2.410215211820616 175.8815696583689 1.925487628162341 3.13952944637973 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_1 2.409828781025453 130.1824377830508 2.191065073675455 2.077408391244834 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_1 2.411230958122335 279.4775084838878 3.800362873460025 2.636625147781213 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_1 2.413839299728912 60.93236216293984 1.241232198783843 1.760036099105454 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_1 2.410700024018421 244.2923802662547 3.829719702086434 2.264075839986513 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_1 2.408412089278144 20.84916162912282 0.4788344663160168 1.535901756109208 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_1 2.415899932337459 15.9137916685001 0.3550989402463844 1.627560711227764 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_1 2.412948340851898 55.43202796315586 1.030593984511893 1.876740065549983 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_1 2.409521720259324 104.4568268912425 1.812334885794106 2.103530288217579 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_1 2.410656688702563 323.4045307220798 4.521104240598792 2.330942645750168 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_1 2.413628313712268 86.67269744073384 1.450891735086597 2.084386576226414 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_1 2.418196689846813 113.5565588171867 2.562655222235509 1.64321480443506 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_1 2.413029320540486 53.95837228628312 0.7364627716811162 2.42642811916929 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_1 2.415449350883165 152.0585837651028 2.228178642650934 2.330163244124987 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_10 2.457865552243813 26.83810962308283 0.5314442146787887 1.778568495751772 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_10 2.468489933823678 48.05544326358042 0.7148490913350367 2.361707181994191 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_10 2.450543111986405 410.7398606441677 3.599687671428565 3.877477453346592 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_10 2.457573365925068 132.3976494025655 1.758846278860274 2.493803528534622 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_11 2.46213189855773 52.05098625718941 0.8639221275508273 2.131985768908254 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_11 2.453932644990225 472.023804940181 5.455290719747677 3.007071419450758 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_11 2.464803950647846 113.884587071412 1.533478033192269 2.528215885245791 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_12 2.464325078471563 26.89012086727033 0.6742899574865788 1.470271806774736 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_12 2.457822902376231 221.0213001095974 2.562015750101027 2.998656113376525 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_13 2.461168074776494 48.65970175347304 0.7662670015738593 2.13529818061338 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_14 2.465625940805659 141.0468037331404 1.463207224822053 3.312406199289887 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_2 2.420956638075185 53.15018425410899 1.13209243478216 1.660089675143918 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_2 2.42025160412403 78.73594978380797 1.44378444832574 1.909166589158133 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_2 2.412484338630148 45.72525330175463 0.899056574207832 1.769654497751073 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_2 2.420963570122921 131.2631380895629 2.41749428222421 1.923791293440994 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_2 2.425986971448935 258.7904553073784 2.510156681367181 3.695729253183496 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_2 2.413720667221678 54.09470744507915 1.381561115670659 1.403819493629546 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_2 2.416475842119394 90.74871048495292 1.787474263274039 1.808106297153035 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_2 2.428210461134705 78.43759465727159 0.7551760847921608 3.444213490730794 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_2 2.422995772752392 46.88517722596573 0.8988518975918129 1.863501537806091 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_2 2.413614244849605 507.8599855429651 8.416976818280217 2.050383580220082 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_2 2.420534237976673 197.0706434119596 3.590662555189005 1.916912942613598 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_2 2.423682104746673 131.5663952502055 1.807328723360232 2.51537929170935 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_2 2.4223916287593 30.93436405918701 0.5563672429180897 1.985708276728833 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_2 2.416694829641379 78.6048082612615 1.427727760617001 1.929231048990384 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_2 2.423020190094375 529.4187040475604 2.664600151310755 6.26152456081031 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_3 2.423604832829817 155.7883346398715 2.443811803809774 2.341326599097933 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_3 2.4230362584831 218.6479060586736 3.059382737923257 2.455183003385062 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_3 2.419906218747928 105.8341417758393 1.838977293078141 2.071537096315389 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_3 2.423638478945369 422.5216479404741 5.898210760132085 2.519779031390471 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_3 2.4386905792088 377.9461156644288 2.677023017880974 4.677829427623496 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_3 2.421088731252674 187.0967302741114 3.413963269166786 2.075892218746947 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_3 2.428727525873288 469.6431422926673 4.597482936019914 3.564337506570058 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_3 2.440655954040817 58.58340051528078 0.6543241511885252 3.424515514394858 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_3 2.425882601159024 73.3156496507752 1.033190006404977 2.44702259686731 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_3 2.423939686889002 597.5864850331815 7.939150599003036 2.613544115877649 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_3 2.423315150131589 481.4963131869104 7.050660568314241 2.411804617646617 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_3 2.426779623105621 176.3373657526053 2.469760577066648 2.504836025732399 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_3 2.430665524473126 682.5602154051064 7.033693238997478 3.48845404346085 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_3 2.422475521184304 487.4995262330406 2.890034957267968 5.885753417438327 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_3 2.428161436240105 1183.556780175063 9.62527482250237 4.016255577930671 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_4 2.435695492710474 381.7864663661384 2.68954969705909 5.180146582678443 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_4 2.432004101470211 137.8694699618995 2.064959717603394 2.4516129987882 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_4 2.422785063443536 269.973122199373 3.785734180273639 2.494826630938827 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_4 2.431517890976759 102.8344747481733 2.024060820888553 1.780883389858054 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_4 2.450520026187428 59.29618270455023 1.101951902046064 1.894241397976181 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_4 2.423937789878601 401.4743589216612 6.031436368069334 2.356720917455267 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_4 2.441307488135923 514.2273440878215 4.801709507186951 3.824158067676029 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_4 2.452493836024577 19.08664468708529 0.3327970553717578 2.016543795162625 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_4 2.437964437634979 396.270144269944 1.812075019275874 6.728880501792489 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_4 2.426403195256027 858.6284707667168 10.84208165228935 2.768403734637165 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_4 2.432888657161028 306.4537996467054 4.292158915043062 2.467800606979168 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_4 2.43198929305802 59.44771366342224 1.04927468199049 2.053335079019772 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_4 2.432711942174311 1027.400814629257 2.916526247054867 15.26124681588441 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_4 2.428811666299585 917.5311336271977 7.761971083282084 3.991062699016006 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_4 2.432652921047791 340.0558345624348 4.825519744429124 2.43953828886984 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_5 2.447057734092626 133.8609121160057 1.243948653840454 3.719981560131493 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_5 2.435301760956841 270.1597934885627 2.758393825110858 3.417396773935952 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_5 2.4318619239137 183.4364111703242 2.880960104158555 2.216495853397832 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_5 2.433663272456271 182.9534049000005 3.035709520891611 2.102864285587682 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_5 2.42719961183417 20.83068927614067 0.6162448038100269 1.307817407283288 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_5 2.453425544566239 112.3851861960473 1.905048731289423 2.082764922212628 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_5 2.449774180751356 44.33493047855765 0.6778625920569471 2.159439992531587 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_5 2.432520024721745 109.6741932201521 2.083190465482144 1.836988470641635 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_5 2.435942229252794 465.4409981848145 5.827977151762394 2.74995744084381 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_5 2.436471543954816 136.645743754045 1.577619129923534 2.806318291220414 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_5 2.442965402564282 985.6850227946057 9.365389490960908 3.668533714688987 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_5 2.432811723528878 429.6853097140706 4.204908705389358 3.394459480869686 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_5 2.43575317004818 376.200311873633 4.395252157939952 2.860108069398814 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_6 2.445178948082266 442.2952466660983 2.199624930253953 7.233056952384223 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_6 2.434982149753508 348.1232827048844 3.511079453019379 3.437226765648846 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_6 2.436494288438258 405.0095793105443 5.00991362145407 2.775751503118824 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_6 2.432779269997398 431.5522030960522 5.220681419153642 2.946063357161409 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_6 2.436219772438776 534.521022327098 7.341711832074235 2.367171798394938 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_6 2.443345575200419 46.82387946030363 0.8570192696655298 1.906372513223224 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_6 2.439034612481172 223.9428733817028 2.472997326047541 2.917586215965986 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_6 2.44716714790848 113.7443063724553 1.844131847147468 2.042664714371242 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_6 2.435935276265155 536.8517361315616 4.465017721567529 3.857177790266568 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_6 2.438858673349034 308.812954717871 4.433210882741894 2.341406346427434 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_7 2.445151944797619 455.8873983097744 2.861906159819488 5.720295162711996 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_7 2.44345429809613 167.0786582825633 1.926006042903488 2.872914635247239 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_7 2.43632833012991 652.4435694992409 5.895795219817857 3.707337750183836 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_7 2.438881252144371 732.4658071032516 10.86458927063059 2.367197003204573 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_7 2.44701535664659 253.0328644643471 3.56691758023134 2.405943700345494 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_7 2.444102167499166 206.1848939487074 1.191253575383277 5.88031819782188 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_7 2.450892808938074 97.33772372868299 1.274947792749142 2.624008187570162 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_7 2.43970665682788 514.4451545703016 5.888594597881992 2.990205588501476 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_7 2.441259646383487 1171.321050959973 10.03292153128579 4.083795504082774 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_8 2.447523912408555 238.9066682063605 2.722272145540698 2.842065157849431 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_8 2.44503107893047 460.1785468256502 3.051564092417047 4.640144534387867 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_8 2.444242720950394 218.1786081017339 2.152269539623963 3.537092919568485 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_8 2.458555037847768 21.60125747505783 0.4355957785307548 1.752793863764461 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_8 2.450487923018631 73.01700093002556 1.263794659077475 2.015943873863102 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_8 2.455026496913 346.1603738928574 4.418863196539412 2.727776761740307 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_8 2.44264827212525 901.5413496772378 8.950098377933406 3.524898309110655 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_8 2.446144042362406 1007.103148770173 6.789347450216741 5.189612753551629 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_9 2.44970387904601 513.9002318672187 2.317207506695287 10.35731147928873 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gln-4_9 2.450379730353097 472.9065338458446 6.261684806107029 2.501171663159823 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_9 2.458013266742654 33.16770788166917 0.707142765539548 1.636587834510522 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gln-4_9 2.44676064580079 621.8225441358509 5.684544733703014 3.714036775134164 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gln-4_9 2.452864218599531 853.1997733806102 7.06143602497953 4.029091782231892 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_1 2.0113151795253 38.47748519128363 1.045100673568855 1.357375852231597 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_1 2.010858267043404 53.85138874800585 1.26890548943259 1.549440683086508 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_1 2.010760612664242 55.24539849206101 1.261318245117854 1.595988620431724 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_1 2.011222254319281 104.1451208194277 2.701953779765574 1.419028992457933 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_1 2.024204800366764 68.58035582651436 1.397466844309018 1.764669693891776 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_1 2.01173697657752 79.00857516542062 2.028145646814459 1.49178684191427 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_1 2.015265187379431 206.3810988861013 1.975708214963584 4.028623334108488 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_1 2.02636138137851 35.82378408980098 0.4252278450532176 3.536163098019261 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_1 2.011766973698148 28.99405877225656 0.5602035440093268 2.028747396035769 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_1 2.012860391237621 118.9514903774486 2.759540936559996 1.585313418998741 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_1 2.011041032036162 101.8711969894939 2.409563641103741 1.523816093578035 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_1 2.01191070927344 44.92983573418888 0.8714436728777278 2.077283824554898 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_1 2.015474417492645 418.4396420905093 4.628257329513984 3.15461443164826 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_1 2.016300801827433 554.4392407325893 5.240374552442335 3.778275302350226 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_1 2.013885270199621 40.54709187137096 0.870722336975963 1.624841439896736 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_10 2.058968971691303 213.3546089842597 2.723282915275517 2.461970089058293 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_10 2.058339724732175 223.3427516426541 2.826206642044707 2.675828552435705 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_10 2.058050760284403 266.5262759197573 3.378117950955945 2.646628858798789 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_10 2.058664889928842 559.636311333857 6.823111097790683 2.749153410059701 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_10 2.076782912749248 104.2797981112086 1.820751343182518 2.01684475535183 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_10 2.055197770052471 351.6583727165309 5.305749405761004 2.306780313277767 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_10 2.058071589079244 199.0391552987151 3.055226976658131 2.157518001283244 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_10 2.058142612979037 509.2705981782679 5.562894957203919 3.171656650803049 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_10 2.057021273905736 64.04780409472085 1.206632070533819 1.867265958417578 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_10 2.071988483097619 130.9443828493659 2.362188242211136 1.932904515811041 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_10 2.056971479213347 660.5992760851892 4.719119786771256 4.725390068081555 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_11 2.061816390851872 276.0572591176106 4.319398397163392 2.240260199967107 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_11 2.061243398347592 229.6949995556953 3.693477982436148 2.181606412886332 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_11 2.060986051390374 308.2823509434918 4.679942403961721 2.298070974115512 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_11 2.061680180360724 598.9970476496158 9.655116109684727 2.175269444221666 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_11 2.058820484354123 478.7566283123973 6.545628317918508 2.552080799577151 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_11 2.060630589373731 351.993062545411 5.232676374451875 2.227766230233265 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_11 2.06142767062812 436.9211098141031 7.01899729170488 2.149763192013802 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_11 2.060373531838136 77.72686021422966 1.295321678854162 2.033373185565512 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_11 2.076868501154905 419.1945872738016 7.33276520467463 1.99368915369825 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_11 2.061810135175624 110.0741748873607 2.353848725232298 1.663017101452842 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_12 2.072767829301207 261.5202318271535 4.016326422034457 2.50263517579536 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_12 2.072214495663329 280.5028518270972 4.545063071310462 2.22969199177443 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_12 2.072282205396563 292.5842388878432 4.882940971785769 2.124848639276985 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_12 2.066677869351208 18.14787328544773 0.6253339977212828 1.169267899868915 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_12 2.061899121751697 479.8587042131808 7.505736620325512 2.230750595441342 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_12 2.063492866594148 589.7966209518095 9.498201122925305 2.166665559608155 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_12 2.072470144265787 510.4246847356068 7.862599594587341 2.336762973599988 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_12 2.063139039077652 167.3437118103624 2.671004633181426 2.199157944053538 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_12 2.06442556656818 542.7581477005458 7.543431765222008 2.51046220802624 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_13 2.07726051244178 142.0284288338678 2.487331475775676 2.048796629206828 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_13 2.076985576232332 176.2066665092494 2.949162060091966 2.138097308899815 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_13 2.077107812802833 237.1080043716063 3.542140932234576 2.346581637807455 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_13 2.072834030009589 519.2188386839928 7.997158337515867 2.327776827157233 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_13 2.067348073178467 59.25270050819644 1.284665049925349 1.683057202375666 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_13 2.07304603590969 294.0330962737528 5.686832032299249 1.831148811779338 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_13 2.076837162218716 220.1756291564822 3.714619463850735 2.157811189872122 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_13 2.067055606960722 36.57930586290364 0.5768888200075969 2.106690815409376 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_13 2.072579564152068 158.7339354088286 2.744922940087563 1.957151592891774 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_14 2.077178408413188 274.1508334556692 4.438423730059188 2.214559753723823 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_14 2.073179446007456 467.1514750706768 8.231819921944332 2.002418919008106 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_14 2.075021002673113 347.7368028260078 5.996344357505696 2.011792737843533 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_14 2.072125180550098 112.9516215634672 2.06226070318215 1.904123913562098 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_14 2.076555411059273 428.7970321428051 5.412550392975509 2.88845040942117 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_15 2.078054666145658 465.2911570171221 6.725361469328524 2.452246597230092 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_15 2.077925361549394 284.9204137146717 4.686043583846585 2.15012455158885 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_15 2.074723429050512 119.7894625472094 1.818473901230887 2.173398003663513 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_16 2.077208506688618 117.1987042120931 1.943419386081282 2.147718106202173 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_2 2.016224284983464 83.48644783247806 0.9846660130858541 3.106765791171233 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_2 2.015639753942252 68.30335429945117 1.057302678422326 2.345601674693901 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_2 2.015760049521428 73.47292791978741 1.121578538937966 2.415178439780052 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_2 2.015871813841654 191.6258303261351 2.575922322758005 2.64546034068428 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_2 2.026615242660409 295.5902845275592 2.523065512269281 3.660310181718415 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_2 2.016667815414225 351.1309048831093 4.103396558923285 2.830265543678242 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_2 2.026089624407888 682.8676772269907 4.808514660866622 4.999458818855537 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_2 2.038550378736044 60.55448705543986 0.638416014532813 3.05710179181254 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_2 2.016671499885301 17.2702648637596 0.339739090651701 2.106366810926476 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_2 2.016878612772514 382.1041835814343 3.831986521893177 3.173419284683506 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_2 2.015741294722065 251.7542341613013 2.310440469255673 3.513957061738726 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_2 2.016176535038855 168.208934941444 1.953519392345042 2.888523762976708 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_2 2.026508534686314 803.1607084357653 7.472292882012757 3.467591719016314 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_2 2.026749148846059 2553.774149345644 10.73668773555725 7.318798665913249 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_2 2.016763079116304 337.8160475647381 4.050831579043026 2.78428383605981 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_3 2.022847479401787 98.19959958535388 1.938659204812731 1.784076637445454 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_3 2.022322800550423 42.47474543390172 1.154182711898205 1.390188369668057 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_3 2.022143153748886 75.47154055145086 1.468946606519189 1.817889166909322 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_3 2.022695314629287 205.049649674449 3.96013222557035 1.831381629838648 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_3 2.037514765947573 436.3794418397426 4.136805563997518 3.595234882696161 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_3 2.023074282168153 364.4096927168367 5.131473604043672 2.380276314925908 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_3 2.039136432131312 964.0903421603726 5.925125502002617 5.305991436136199 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_3 2.053698205530031 93.42272026638993 1.987579773511697 1.59725843654862 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_3 2.024828532539932 441.4566560972913 1.972097524350299 7.054602329838056 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_3 2.024531521954625 409.3793121593391 5.597172905937335 2.404454366990196 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_3 2.022350617933019 129.1123036551868 2.434343858646605 1.850617513001282 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_3 2.024369450297298 150.3720121056051 2.118337341977808 2.484537965272923 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_3 2.028771233856843 180.465282838876 2.476515312175117 2.242230651069427 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_3 2.039314464018178 2728.282521283517 13.52137343098181 6.516599736269461 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_3 2.025506330712143 553.5892373802947 6.78004439746809 2.816884728559145 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_4 2.025433234449101 317.141077815295 3.034763122611383 3.479151390804434 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_4 2.02462374802926 680.7189074516916 4.20819604652961 5.40665913452317 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_4 2.024750312447766 690.830587583126 4.578761909058469 5.264467616465917 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_4 2.025437063827318 970.9814916157363 7.598699247861026 4.258314001444846 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_4 2.048983365260116 257.2122146384485 3.159373143118649 2.834118272213259 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_4 2.025539546941347 419.8958539907136 5.21446895114267 2.718712462289365 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_4 2.050331433001224 287.2209695981314 3.247090753996484 3.008897158713117 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_4 2.064039314318526 20.04885976134631 0.3862666314365977 1.870891626221078 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_4 2.037310503717556 229.7339621403158 2.428037413592591 3.304146510172904 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_4 2.027341819361645 1371.875640980635 10.02238277342033 4.494128203508223 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_4 2.025048958601522 1003.453909931629 7.465843561393234 4.681861346423655 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_4 2.027173562628746 547.8021958756925 3.705390341768426 4.83562273921249 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_4 2.039832608254841 2423.879053742587 15.12368237363069 5.051362198046871 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_4 2.051953800638572 2353.599412347319 12.52324673582102 6.534197927082114 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_4 2.028047938386116 447.2793569495044 5.487251427229102 2.740590543469046 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_5 2.036293139712513 662.842522437549 6.199219973526105 3.620001236984021 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_5 2.03566198732953 719.9746140290408 6.45000057273089 3.783896994989283 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_5 2.035501809018736 806.7433478175608 7.658111245372762 3.675739146944682 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_5 2.036151708935269 1470.48243152068 14.53528922049977 3.529938377068337 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_5 2.053168362866991 392.990077519441 3.158101119660035 4.151883810384729 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_5 2.028357337200281 338.3754958056212 3.869216138750186 3.051454340875954 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_5 2.053515203121504 468.626387223097 4.233076440294451 3.406420550364895 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_5 2.072097541824172 16.24698874977015 0.3528323615605617 1.590619882277705 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_5 2.049286300390049 410.8387262574019 2.897604673263585 4.636394863381014 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_5 2.037974106597716 2001.382449956501 16.31632710275739 4.048002879371524 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_5 2.035943955493503 1576.884089162332 12.01893627008748 4.237929134784093 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_5 2.037516378335376 601.2433079269534 4.926803751887074 4.041516722915032 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_5 2.051138711999889 914.7053637542276 10.37729640284253 2.974065107606179 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_5 2.06488098574486 1290.685098629494 8.270938547792563 4.977135448430761 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_5 2.031473731994588 226.7865579685561 2.426213257054724 3.240007210003667 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_6 2.042179973819447 47.95900463960074 0.8293759668345273 2.020348748696932 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_6 2.041761540030148 112.1132712659882 1.531275683062475 2.595511541323288 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_6 2.041863292542674 131.251050324557 2.055076772571732 2.382323271111203 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_6 2.042150531676428 171.2926564813016 2.529826179530216 2.362539201997925 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_6 2.060296197584571 35.70777180728511 0.8453782956339814 1.504708568120907 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_6 2.036270598284363 1496.82076295088 13.86561152857253 3.766706068521597 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_6 2.064268037794585 261.0301535866609 3.380332107385053 2.721344862004928 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_6 2.053939740345705 86.0343920306644 1.678089576800603 1.746369201802004 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_6 2.043425595934716 345.7985978026148 3.659674627670652 3.276016903148861 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_6 2.042017929296338 129.7017468975232 1.892020886922263 2.404612921417636 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_6 2.042932232773463 243.0712892291803 1.907961377979916 4.264136703636698 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_6 2.053679571412961 497.1433421815022 7.408938581480245 2.280818042017133 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_6 2.07263349178152 63.06907819302732 1.528197025504962 1.608215494922068 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_6 2.038636713308523 1711.602946477223 13.90705037852463 4.182300635682059 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_7 2.047624137381375 425.8524508416883 5.253099598089637 2.833858577001204 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_7 2.046877468112503 415.9014741427477 4.985692254666657 2.910689996145603 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_7 2.046717248053101 510.2895819928073 6.141477997740704 2.899177216317245 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_7 2.047502648091478 1146.542060044639 13.06944666068838 2.968599749461275 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_7 2.06302765518412 195.5849824641721 2.859167243437754 2.369153527261433 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_7 2.042726344627613 521.3016390157704 4.874836160776657 3.587718802130673 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_7 2.072047722847173 110.5744474131395 2.12813350800906 1.863616886034256 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_7 2.062276894474375 200.8223029259597 2.118682742175571 3.283176137371488 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_7 2.049283140110916 1167.121744140456 12.73530556235763 3.120436170152342 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_7 2.047136236378627 884.7308410952584 9.618099797008384 3.08395771860585 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_7 2.048929570584558 320.6711128410209 3.983604091997619 2.815075316824679 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_7 2.057191396091684 185.2571757281202 2.420653589930602 2.567542194728186 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_7 2.076962765706011 403.5734350138924 5.376351651002901 2.658253680320786 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_7 2.043465861700606 531.0807594672223 4.191291124627623 4.196950417265077 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_8 2.050037680930068 179.0848756399178 2.847356812647408 2.129160297584526 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_8 2.04937238904588 235.5005462102074 3.155663089761843 2.558966923362336 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_8 2.049152341554897 269.5252214518461 3.715086685157184 2.518612987892338 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_8 2.04988996185828 370.5256344100973 6.011033592051282 2.106933044316998 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_8 2.071840359764588 106.0309563953329 1.958775245133155 1.889210227395368 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_8 2.04764986193574 996.4841716202988 11.50103819500874 3.030653771030759 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_8 2.076486935402348 199.0032062926115 3.251072598450622 2.193167236784483 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_8 2.073377336895963 84.40109239933047 1.197468724866377 3.359492109112884 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_8 2.051677563141693 489.8581219314501 6.778833954307821 2.386924841807077 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_8 2.04956612433248 329.7968461800334 5.049587986298764 2.20834330049686 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_8 2.051395945490683 93.563938549503 1.676034726748844 1.910887874422207 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_8 2.062625072898916 204.4865301158102 3.727129278436531 1.877049074434464 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_8 2.050118581978136 991.0648711836604 10.38890893888408 3.211483482429893 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_9 2.054035677069754 106.1992289472298 2.279087785426064 1.583591893857275 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_9 2.053832656715897 162.6823174870766 2.990955474416884 1.896905876214839 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_9 2.054021615996235 193.2977661012448 3.261026282597809 2.093697840902711 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_9 2.0542159804502 210.2846707247721 4.037987121717052 1.841646816274503 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_9 2.0745786604788 107.0683604818373 1.68314428266527 2.106683017619028 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_9 2.050187997452323 359.9200753952862 5.447631119835347 2.290417368075832 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_9 2.077397830522912 59.58664935524907 1.044117696566568 1.99420726695886 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_9 2.055344539186041 167.2273235331452 3.100420202731705 1.832879573235926 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_9 2.053994328988765 154.5868173416722 3.321104435533031 1.643176126246455 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-3-a_9 2.054068612948492 146.1641930203767 2.597357701727707 1.87191781460282 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-3-a_9 2.065332319383853 639.2512413494428 9.005757195449315 2.48920056956548 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-3-a_9 2.052758509042868 402.6135255156442 5.002162835135685 2.797937575155659 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_1 2.322806025048714 600.8630204038805 8.51496024208329 2.290454854790694 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_1 2.318447633603506 49.80922067593275 1.130565863245559 1.616656833987026 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_1 2.318316129568958 33.18316763576597 0.9812301040379292 1.283133304829827 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_1 2.318721741091442 84.81460557751547 2.154902545746777 1.482308391600202 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_1 2.323321006826222 347.5112846230303 5.642695061301248 2.121602978346224 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_1 2.318929889888389 56.22346628288336 1.488807125166155 1.363925273573339 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_1 2.323951416234563 538.3366729823636 6.338959748022477 2.707821885501914 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_1 2.323958049488875 49.61849886211998 0.8628856472701978 1.990974313980102 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_1 2.323438609272952 259.6600368208573 3.443327340378426 2.497388982817379 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_1 2.323668731667499 1675.329651087282 20.29390006309936 2.636158781605067 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_1 2.318560631652311 54.7811160579083 1.442423566131161 1.37984632673463 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_1 2.31932374504601 27.88372372948084 0.6310716363113665 1.601372802787562 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_1 2.324296471510387 1888.41765194054 20.37773350280422 2.909306569393227 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_1 2.320556959893444 64.27326540111068 1.471127623843738 1.643097420864774 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_1 2.32023266353966 96.04293527630418 2.10883106852037 1.632523721140808 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_10 2.354502696909168 316.5891431536647 5.788880385262103 1.91013909217337 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_10 2.354423822970228 384.420444320279 6.798045993239459 1.973119275324097 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_10 2.354697460527535 672.4093604716467 13.4864400311231 1.753883800288086 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_10 2.355033741322353 605.0187659797704 11.44739950982656 1.863501537806092 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_10 2.35456902639325 515.5951922721916 10.31776703870138 1.753883800288086 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_10 2.355826197679913 236.8509890441875 4.434824197951388 1.863501537806091 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_10 2.359994025971658 127.9213439981244 2.495053056132698 1.80772217320507 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_10 2.360203391573115 128.4150057265947 1.81280054188955 2.353725039460668 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_10 2.356411431311973 741.5483002463493 12.42327131848415 2.082737012842102 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_11 2.358052813938325 71.35478795697966 1.590990360906859 1.577642504290186 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_11 2.359971830277857 223.2532416025352 3.218310307609561 2.490943146599035 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_2 2.328789573654855 466.1091803385297 7.761810249110152 2.060677277770987 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_2 2.322339924237828 498.03436745102 7.584744107354263 2.280048940374512 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_2 2.322289814703841 781.9834206641672 9.996002652473111 2.656877487819596 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_2 2.322434772190159 1189.000323918914 18.84346367011109 2.159220831452808 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_2 2.329401304105432 303.394898789273 5.149016805067698 2.056746673207172 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_2 2.322935677838658 1404.098652872729 17.21814232203227 2.772954357989513 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_2 2.330173190206358 414.1515539481933 5.532552541939901 2.470838762577932 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_2 2.330192175881494 31.97698679572043 0.6343732536889007 1.710312176803361 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_2 2.329476960107874 218.5212027641001 3.245455666125098 2.291371682212691 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_2 2.329778300913894 1095.951035511897 17.66780444852172 2.137935274369964 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_2 2.322356744563251 971.8868569715781 14.14235503229217 2.278829161723925 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_2 2.323518714306903 523.5839067482461 6.882131235244338 2.519548527579442 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_2 2.33058819327363 1440.837510290606 18.6251674047363 2.546555931285957 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_2 2.324328124982319 1191.503539007079 14.30340892236674 2.85006117546814 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_2 2.324030562108127 1410.648821778939 18.13012384015649 2.636306587308029 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_3 2.333763629181761 452.6845773296698 7.292918048112695 2.106195073139265 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_3 2.328259442493949 875.9250201974031 8.861393993727102 3.04840143681305 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_3 2.32815960889315 750.1523008177752 9.828707424024037 2.565250985645305 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_3 2.328465182164837 1612.086852459737 19.78182253972248 2.613500203860018 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_3 2.334205490901557 395.1886264846198 5.55979238037292 2.39850599037411 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_3 2.32876884779513 1344.857072775129 17.33002430382797 2.568146404221014 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_3 2.334817046483479 340.6926680033826 5.26271248325669 2.268732000855002 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_3 2.335849128018824 107.2000088739937 0.9816704309523334 3.67160413766906 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_3 2.334295222079076 236.8628261003893 3.356219097614539 2.462787533918099 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_3 2.334631903374456 1070.110204747487 16.90442288826893 2.159546576482214 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_3 2.328326672792135 813.5816495172002 12.98174897080088 2.1368370759266 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_3 2.32947302849113 412.4911030490716 5.925170394248102 2.345043555189263 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_3 2.33513266594991 1182.120051138195 17.27734019995522 2.3546972696181 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_3 2.330222702580889 1890.709018121475 15.45138007864441 4.167196537056279 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_3 2.330122514134213 2280.907040928637 20.34960693887166 3.532355596487815 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_4 2.336423360612717 521.3944284332231 8.459786171000554 2.052347196143529 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_4 2.333176169370777 432.3883801438586 6.940042215204417 2.172161988693267 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_4 2.333021513612296 645.3742028828034 8.833341395528441 2.451728520681581 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_4 2.333368721372631 811.6718363726234 15.53895522356585 1.844584926871154 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_4 2.336992794529777 331.2826184877799 5.840659527987706 1.979099919572817 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_4 2.333684848830896 1121.599270357127 15.41640277380339 2.455755667526802 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_4 2.337626310166319 475.9975711312887 6.691608917168476 2.43888768711428 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_4 2.343528970865598 185.7328751050028 1.107436514918395 5.739171740311147 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_4 2.337106899819062 205.2085435383635 3.346248505906259 2.120600985134371 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_4 2.337385163494236 1158.8121773013 19.27666988238236 2.091181696484517 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_4 2.333254985435903 727.8399744309808 12.06577492574864 2.045733514746234 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_4 2.3343257587941 417.005671042994 5.924197005148502 2.390789938422746 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_4 2.338034915049921 1523.126051705332 21.50557444464542 2.400820341441555 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_4 2.335278494295393 1165.151673990608 13.67756095064911 2.936332873504829 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_4 2.334874437214941 1121.618564412368 16.00195405513179 2.441442136819588 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_5 2.340865228955431 446.8102439380311 7.596147895322057 2.001419449695726 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_5 2.335987239679708 596.9631796010261 9.3903570454657 2.198174702278568 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_5 2.335888471022428 763.4779093632505 11.11377432726426 2.356761209961707 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_5 2.336113217667676 1307.591457361331 21.56303015667661 2.067431276032161 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_5 2.341375226749363 355.61198981942 5.308116206082015 2.341581746821651 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_5 2.336528749485243 1144.793003129493 17.81982515830287 2.175635418390317 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_5 2.342166832172766 361.7973112040524 5.338446991130084 2.360199868770991 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_5 2.356458874369053 28.77475078680633 0.6067762080244782 1.70023761979571 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_5 2.341494009548334 238.4366713085967 3.377645296255504 2.468614082060469 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_5 2.341767472057106 1091.13543817368 17.82923299991775 2.135388807068261 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_5 2.335991269133204 834.527699404264 14.62289975731366 1.952069806548887 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_5 2.337143220084182 505.6041915064281 6.991791924620095 2.425880452229562 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_5 2.34249436798154 1367.222561477087 18.68095818492218 2.546555931285957 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_5 2.338276730633171 1338.059604354815 16.24968981903877 2.877732548083732 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_5 2.337810904429984 1617.344565876033 21.03290325815662 2.631257149566594 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_6 2.343130612367612 432.6940287030732 7.350818791456566 2.003053019508452 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_6 2.340204461184858 522.6922273561554 7.796072121835745 2.339382060876646 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_6 2.340058559128697 600.0080507869117 9.181350185719797 2.280244868098492 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_6 2.340403637127272 985.7401174479807 16.72127479067593 2.067431276032161 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_6 2.343750626596482 317.3075090201377 5.289702050817201 2.070397219435943 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_6 2.340666986739915 1297.316985199902 17.18970126598989 2.623785879572481 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_6 2.344501259410787 375.4843209044079 5.642535501488895 2.278702337510095 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_6 2.343848593719475 187.563011540058 2.954331304710083 2.169880733800387 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_6 2.344098437108328 966.2690487812122 15.94400446430091 2.067583976258108 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_6 2.340370516236454 744.0563781043235 12.58561136380342 2.039640169385072 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_6 2.341517256938379 410.2127689970563 6.041841991906066 2.302597909282902 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_6 2.344951197879696 1092.304958393127 17.44964199654499 2.169949252012395 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_6 2.342368018271171 974.269410092709 12.86443501694699 2.700254081531205 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_6 2.342058451146272 1554.327900684359 18.74731748593783 2.888480870547923 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_7 2.347580535159083 320.4778818348187 5.955029257930843 1.872359437930307 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_7 2.342682290710358 566.2919022348725 7.986192522424179 2.41303711493054 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_7 2.342562233157671 661.7005746374481 9.487823971775983 2.430520671170266 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_7 2.342783184784674 1188.874692197694 17.73380169479028 2.291563790759636 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_7 2.347998435730203 224.736688155791 4.171334187694516 1.900862752478381 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_7 2.343247377957525 1012.62768132786 14.60864784703556 2.331811337045588 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_7 2.348695487454915 262.7756117244271 4.271351275617599 2.137545881601105 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_7 2.348045682505152 134.6724403109956 2.383613960383391 2.028227609940086 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_7 2.348418225458445 1128.087023544458 15.47167116001279 2.414708803344076 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_7 2.34270588238071 747.1109912600249 12.03303581517137 2.136128964120392 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_7 2.343951423851749 343.3528954596132 5.647090074316387 2.102852646900114 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_7 2.349024070437688 1094.180322895338 16.122909040322 2.331531735445623 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_7 2.344954432464408 1125.974797607093 14.05320900518924 2.774959714643601 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_7 2.344683271821465 1145.522525019489 15.7590093306548 2.497151401106076 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_8 2.351075301063301 24.53602216793517 0.721814994172148 1.315101089627774 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_8 2.347047654052113 371.7202970298574 5.936382441496668 2.177127621082828 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_8 2.346972536714918 477.0388788903255 7.237456403815826 2.288340588681303 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_8 2.347220038404516 809.3071785519768 13.76867019777753 2.033410200911808 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_8 2.351473239091267 23.65682630932588 0.7113051755996196 1.29977268645598 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_8 2.347542021249798 846.2875394696791 12.95866819046547 2.278707270903934 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_8 2.356389911184022 226.7881398479847 3.889129416761428 2.021989747357861 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_8 2.351728513608032 13.90490788306352 0.4314541049223854 1.259506475575642 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_8 2.356036820226059 750.3727453705305 14.05006253966542 1.863501537806092 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_8 2.347114106163178 600.9975936719198 10.29303625676609 2.015101155337726 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_8 2.348177352790842 303.3425259752391 4.893229197459223 2.126518237707582 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_8 2.352751515767943 199.5226760628548 3.758105461350266 1.903969650015396 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_8 2.349107786502866 1101.735294191579 13.06050812839988 2.921312704854843 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_8 2.348703652107471 1207.049819902203 15.68319707339241 2.634820693748201 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_9 2.355027656180912 309.655397126323 6.160398388467273 1.753883800288086 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_9 2.350522061487883 46.88643260032327 1.222666426778027 1.438628322239603 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_9 2.350406006933893 51.86778746291424 1.375630581379075 1.412340441777265 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_9 2.350666162051398 76.89917691933063 2.061352245636265 1.375374751253793 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_9 2.355634833256894 196.2648763061906 3.985044701105659 1.72254813828748 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_9 2.35107223636681 151.3837774840995 3.37612079459192 1.640428267686702 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_9 2.355664096236008 129.0099842794696 2.336527529224096 1.918040292666712 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_9 2.350560872402742 23.42304478086486 0.9693940647728112 1.151682398434231 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_9 2.351618703797878 26.75686480409012 0.7231101624122019 1.37910921123461 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glu-4_9 2.356772112438092 779.9303539791764 14.12263322688651 1.918310406565094 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glu-4_9 2.356644344727616 932.3260442102876 10.50303499825561 2.859771985314447 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glu-4_9 2.352368271174818 295.1725928819331 4.32825181052245 2.348116515890658 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gly_1 3.536123514109238 1302.86976895434 32.32076232243018 1.435502764307443 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Gly_1 3.535494414441168 1596.839260118958 38.03731825499191 1.554359506984056 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Gly_1 3.535247817406042 1804.584325835407 39.11465969868235 1.665903670037288 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Gly_1 3.536311315286814 3046.571229379187 73.2861554414225 1.507222978931886 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gly_1 3.538000306855749 1553.426239633616 34.63365085471064 1.520678420955974 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gly_1 3.536678667442688 4464.463851149434 98.02434419290752 1.612937159599651 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Gly_1 3.540024765705451 2146.894771934167 45.12574626018005 1.693023574450573 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gly_1 3.539469649120629 287.1757252549868 6.675187540981481 1.54499403644909 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Gly_1 3.53740574976204 784.7614631321451 17.51658167374085 1.589662386368904 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Gly_1 3.538617706264099 7594.249280846992 147.6551084985907 1.753883800288086 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gly_1 3.535849366620101 3855.40019330025 87.87984037877673 1.560806441482697 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gly_1 3.538171071053851 2194.738993033862 46.68045922586014 1.614693412052873 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Gly_1 3.541267241284026 3115.050713730445 64.22597802121204 1.699074931529083 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Gly_1 3.540722587258664 4411.461706169071 68.37839997732372 2.192354750360107 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Gly_1 3.540100159997718 4636.556285723279 84.33495449104664 1.918310406565094 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glycogen_1 5.415364046334168 61.69091246733249 0.7527831230452257 2.86894077062433 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glycogen_1 5.415394673471957 49.72650878887978 0.6708418757435284 2.566150646020472 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glycogen_1 5.415353570529571 81.57618587098658 0.7034014824874953 3.900768856777401 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glycogen_1 5.410273151819112 243.2258858336528 0.85783448105847 13.03718304473431 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glycogen_1 5.408382066072685 137.1385516490255 0.5294026685985103 12.34704893564613 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glycogen_1 5.416176590720826 112.7628594976525 1.291217142853116 2.925882381034629 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glycogen_1 5.415397915858533 109.8707043940333 1.316721691002742 2.937457555297708 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glycogen_1 5.409928284322178 91.78137753266478 0.3625653545268075 10.92400349090454 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Glycogen_1 5.407661400022037 118.598149493125 0.4393578068404217 11.96006531748901 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glycogen_1 5.416261674764035 237.5408085703278 2.002228600297268 3.770504285673351 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glycogen_1 5.409660875926146 273.0312456567872 0.9944239935990207 13.08671043662783 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Glycogen_1 5.414814662424098 89.09683603155634 0.3994136108044842 10.30478830808206 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glycogen_1 5.405278041173466 72.91756623607215 0.3359136600113732 7.574177199691112 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glycogen_1 5.41614 28.231754 0.396021 2.873569 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Glycogen_2 5.421896822460963 43.51765267279232 0.6148421146209668 2.501849639137394 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Glycogen_2 5.421612659088362 44.04221711069431 0.6455709784276309 2.506964724670701 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Glycogen_2 5.421901107505098 38.35939266403067 0.5266560986470495 2.616693362077493 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Glycogen_2 5.422933647736133 79.5132749025463 1.057734045772706 2.713474511074527 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Glycogen_2 5.422032675988673 74.32107166954461 1.099979629781178 2.417259864309317 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Glycogen_2 5.422990998323202 133.7123990998401 1.541522568857086 2.922831168058852 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Glycogen_2 5.42249 17.089852 0.293806 2.090327 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ile_1 0.9948360828356678 120.1954415099529 2.391527864797341 1.802827368893286 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ile_1 0.994450694734844 158.9402393196556 2.635138693795996 2.104560165225011 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ile_1 0.994502142313537 184.1682201965291 3.098227928965879 2.082887726475933 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ile_1 0.994776289802675 267.7482740181147 4.956991449090566 1.918310406565094 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ile_1 0.9952111733725503 111.8854376965568 2.090246099507507 1.875312724737031 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ile_1 0.9953514486854969 452.4925540975011 7.7903569338498 2.027928144083099 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ile_1 0.9957862210382677 319.8470708138948 5.418836648625307 2.068290011468548 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ile_1 0.9722206084821841 47.49554724942781 0.9796816556350555 1.733286072931773 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ile_1 0.9952011921994987 70.2694984684241 1.280893653587396 1.92387353101284 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ile_1 0.9959911261603646 520.249792433393 8.718308554481384 2.082737012842102 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ile_1 0.9946247475633198 304.5085666102159 5.28789944374631 1.996529008513917 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ile_1 0.9953734047734386 208.2261370140629 3.562063301728288 2.025508741975241 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ile_1 0.9960877161172811 276.9766362893081 4.806311244043543 2.027928144083099 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ile_1 0.996242851054017 611.9334129935155 7.388918595039229 2.814300940595226 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ile_1 0.9961047971562079 551.5420542447946 7.757793812516158 2.432047432671854 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ile_2 1.006564631835596 120.7064457697704 2.328609394825789 1.808692669047089 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ile_2 1.00618366738152 160.6851754242271 2.727625080753417 2.063062981715055 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ile_2 1.00619910185008 203.4926308761969 3.423790298596868 2.113334015013278 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ile_2 1.00648880573196 281.1680336844899 5.162479029332607 1.935415701563785 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ile_2 1.006888343684751 115.2555296717115 2.163984029682925 1.874536652927994 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ile_2 1.007108063714076 496.4904006948202 8.478634505176274 2.05414555409844 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ile_2 1.007494492579809 310.5448574972265 5.557027781198416 1.992800265052468 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ile_2 0.9839458887021529 38.47209829523228 0.8118203529961568 1.699074931529083 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ile_2 1.00698565326409 75.76141279545537 1.393677936884748 1.949001771050488 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ile_2 1.007715480903741 585.4745396587892 9.24791945018021 2.182662294996412 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ile_2 1.006367958475743 288.282741209686 5.198618543197578 1.941488814124213 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ile_2 1.007112926813872 172.9775238914468 3.328024497037285 1.863501537806091 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ile_2 1.007809161929165 264.6938663507018 4.805974265365634 1.973119275324097 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ile_2 1.008068016046326 463.8272211723454 6.689904638744093 2.447166500479202 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ile_2 1.007870850693627 486.3663912904097 7.362447059594404 2.279533264013916 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Itaconate-5a_1 5.36973 11.772677 0.253055 1.725327 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Itaconate-5a_1 5.37003 13.558388 0.300579 1.871285 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Itaconate-5a_1 5.369992972150627 30.56279902663152 0.519899912931337 2.051182687669676 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Itaconate-5a_1 5.370525366418499 40.32490159728324 0.5800698171599308 2.380287019643251 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Itaconate-5a_1 5.37055 14.118555 0.262006 2.569837 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Itaconate-5a_1 5.370797891694252 44.53578386426446 0.6493004708139838 2.30229718474567 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Itaconate-5a_1 5.37003 10.956153 0.311899 1.675212 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Itaconate-5a_1 5.37027 13.149592 0.18551 2.530942 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Itaconate-5a_1 5.370877825049639 44.87012186676682 0.4969067802451488 2.943394597307627 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Itaconate-5a_1 5.370670030793666 30.86133823170088 0.3875933209689115 2.78947119536528 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Itaconate-5a_1 5.3702 26.620186 0.446386 2.843983 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_1 4.195330335220453 90.13739858953141 1.137646512189919 2.831936987126099 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_1 4.201797760679054 165.989661070991 1.643524803788685 3.523998677911516 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_1 4.202245714568346 172.1642255697279 2.29029300620562 2.622906611813944 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_1 4.195413053072529 75.94822930099095 1.323279145316382 2.093363258668568 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_1 4.201644487072891 24.60759524580591 0.5295061315379046 1.713364435724321 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_1 4.193236298156584 19.47063768267071 0.4671411276522484 1.454330231418079 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_1 4.19584344973186 37.16940344761215 0.7603003256184123 1.749812927335315 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_1 4.207269756423544 22.45542868930146 0.504821862213729 1.552080195341036 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_1 4.197661883626155 66.57971943758749 0.9984768015563402 2.379725441323492 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_1 4.193993067937502 42.41554211726574 0.7959944892161095 1.877643688703287 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_1 4.195813755470946 45.41485228050353 0.8601812295111932 1.793596074435893 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_1 4.195887149712254 58.53233865876282 1.046207320691902 1.852838260440125 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_1 4.196595446805401 75.10153870079492 1.242360465099962 2.093896386079957 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_1 4.196847338197113 104.519077077325 2.015118281997879 1.809780833250311 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_10 4.242493214058626 105.3188029957704 1.582487606304934 2.27229022329081 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_10 4.231694183323592 270.7507036011532 4.790819390323878 1.963924952857457 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_10 4.23765393970695 358.2934205909599 2.676556413199728 4.20605319658718 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_10 4.230423216609782 156.4705463097519 2.22091248282147 2.278632022893799 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_10 4.246172170296641 34.13194022775389 0.6435402997603715 1.854078641324179 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_10 4.249921318819396 88.77818399773703 1.180110484199254 2.697181562248467 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_10 4.247263922449512 124.5111346249754 1.656212798603067 2.454052906106515 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_11 4.253578443980851 38.13850081588244 0.810640545842627 1.64426606277008 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_11 4.234525790601601 98.81552300965856 1.506032841054113 2.221654394044117 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_11 4.241130652747291 62.93272183362555 1.409179028407113 1.568242415099786 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_11 4.235351309084253 148.7020286525757 1.674844658377052 3.213555592857167 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_11 4.253497321552987 35.34120541344326 0.6848398230679155 1.823083113420928 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_12 4.237545612414356 113.8316454979127 1.983172259451295 2.006633337379976 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_12 4.243343312011459 124.4097564364689 2.153642156359374 2.000857837582807 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_12 4.242175589144307 60.63554569207406 0.9875602031647885 2.172931191062835 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_13 4.243085371086543 200.3598949334217 3.359406633154308 2.133727401517855 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_13 4.254025124586298 51.70388053630465 0.8361651679292038 2.21695899815732 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_13 4.253337292069816 18.99642585083787 0.4680239552467865 1.455225874722381 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_14 4.247310988849729 23.89247780897405 0.6045924001581371 1.416854002730549 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_2 4.206171168125282 97.93082121882932 1.340200188258885 2.57262265890395 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_2 4.206740316807917 168.0323878817564 2.082357491981158 2.672373136556708 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_2 4.207305287065029 104.7484134928118 2.016011646356378 1.825696833397649 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_2 4.202306216787478 123.5967325216471 1.865413197551537 2.434009881786729 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_2 4.20709113790499 46.79715652662046 1.102101745950669 1.522384553517552 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_2 4.197438828977108 34.20158923560533 0.7873483830580491 1.515689731069151 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_2 4.20191329192452 107.4674909277873 1.591129366533563 2.423404044221424 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_2 4.212588224712777 129.5763656801511 1.073229032907604 4.089135751602956 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_2 4.203362990941518 231.353668458406 2.660461668618671 2.955062254211092 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_2 4.195821535973671 28.47376956356901 0.6316242169417268 1.629556347028678 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_2 4.201589473047741 143.8102351284476 2.421206020979356 2.119311973882114 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_2 4.201810743833886 132.1020445254178 2.139466417961173 2.162660768480716 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_2 4.202533336391024 198.0470464011642 2.978868170005163 2.404372225678539 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_2 4.202667444372929 314.6189978622384 4.421040717864896 2.472748280959868 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_3 4.21469921176988 422.3458385756387 3.000478555571489 5.349125472721174 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_3 4.213269906288375 566.3555741271035 5.096931955901437 4.119385287878462 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_3 4.213355172936692 403.4709571311128 4.960767924779965 2.877473800856038 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_3 4.20639594811343 312.4389471110216 3.881868258335933 3.053860352553208 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_3 4.212790233498839 195.4767606577142 2.835376221918081 2.321436404354423 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_3 4.203973662623188 417.4417471217774 5.438386012320029 2.608393441639291 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_3 4.207405382823599 175.9567102186485 3.02078904267796 2.058912157128212 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_3 4.218614059256765 59.56898736733226 1.095018477019866 1.788831286909128 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_3 4.208645951111362 334.6865756345869 4.773532054956647 2.321976595207737 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_3 4.201871562397356 123.5089255486038 1.945817805924589 2.243098426344333 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_3 4.207430595101314 209.7411587036529 3.618977257539177 2.007428301976064 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_3 4.20748201545717 214.7713955691562 4.124502591305222 1.808692669047089 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_3 4.208295142812117 432.1500373894262 6.727452192894074 2.243946092630853 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_3 4.208367737261629 515.7790913030829 8.66810135083257 2.027928144083099 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_4 4.224819072844146 122.4596876140312 2.214928984981503 1.922837634205776 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_4 4.218408260510773 102.750757156255 1.963524155052198 1.805491136498163 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_4 4.218778843650299 107.2992122523498 2.135417756414306 1.75852305110997 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_4 4.213978464261482 372.9565197008165 5.531858856865984 2.352437393578975 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_4 4.218408258250992 82.5128868164509 1.554496918957497 1.714290542188622 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_4 4.208661629902819 218.2185990620562 4.370290562215263 1.771604316701375 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_4 4.212939796174039 447.2251533463428 4.627837290177432 3.172420472443027 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_4 4.224487680168495 46.71984817113856 0.850721486160686 1.914908826199336 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_4 4.211208169702966 280.2793726816825 3.668555907876004 2.665796271468576 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_4 4.204804147583712 184.9228631810872 2.805630915069771 2.182827712308926 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_4 4.212929363695612 457.5635508477071 6.678429265046263 2.334324503645918 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_4 4.213200498472568 503.3058067713903 7.422627306348423 2.336818152427257 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_4 4.214068608080105 787.3957622212416 9.501786504548216 2.80082745856337 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_4 4.214249193396332 1090.241463752052 14.57645606680351 2.565677379360789 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_5 4.230447721598677 32.65380260771858 0.6746708578349899 1.693209631375281 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_5 4.224350855845854 218.1557206141316 3.477153455681251 2.307821578350187 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_5 4.224657035112806 138.7933614707447 2.495104991412104 1.957877979414443 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_5 4.216821039542936 240.3948339064275 3.385744098302867 2.366070445855789 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_5 4.224204361092427 109.1546281542372 2.245191310023672 1.727121826547681 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_5 4.212562966148887 221.6908546471165 3.868687279475512 1.999471018388548 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_5 4.218810703656613 218.8179067168267 3.793627368597042 2.067944677502458 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_5 4.230104753602705 69.81910075779267 1.170137712686285 2.07879410662679 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_5 4.214808736992237 508.1381651713172 6.765968767428582 2.56547716384915 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_5 4.207452025351544 94.2901842165422 1.967181831617485 1.698961011960673 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_5 4.219124156927892 338.939933382901 4.798545773908919 2.394236203518455 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_5 4.218975193390759 402.4351876481559 6.39580502907449 2.06850691543028 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_5 4.219635491805905 769.9068259522227 11.44672370241169 2.313131861115967 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_5 4.219756049654977 756.52009411175 11.98014586358157 2.145880891399865 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_6 4.230501120380928 178.3074412784059 2.427790186812999 2.524429628445627 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_6 4.230646707618229 282.5182049054292 2.714390910859051 3.303408915794526 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_6 4.218957398399482 38.41255911606063 1.214557527272539 1.19314961427546 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_6 4.230944643309318 390.4011106106716 2.187078831831699 5.806883533814549 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_6 4.214918595288554 792.0059372842353 11.3203869467845 2.425533500058604 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_6 4.224846154102075 128.872769774547 2.507869317303963 1.865981385012422 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_6 4.220003604531792 871.2327547066658 9.061581683475946 3.397485331077976 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_6 4.213138029010457 369.8245260965992 5.514797142366896 2.314282877226856 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_6 4.224423339808159 331.9332693893563 5.295733639233946 2.252425065492347 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_6 4.224600080018476 471.0570202195253 7.177474815581128 2.306185280962455 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_6 4.225830115581958 745.8273798611912 9.162557949113912 2.866416397612589 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_6 4.225802440253037 1162.377163300151 15.51832989088033 2.582162343287944 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_7 4.225058366548154 226.1591952821447 4.26363093042224 1.850826066973463 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_7 4.220111714770167 298.848817396721 5.68558445723984 1.822244100584264 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_7 4.227947570846177 54.86992569703202 1.259335021708584 1.562241511668875 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_7 4.226287481511651 265.1936348423634 4.840080397709364 1.964432515865913 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_7 4.215826719431869 217.302516450041 3.362635485711592 2.25050915166377 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_7 4.230909219970684 413.3207136778147 4.803286531530431 3.027556861983404 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_7 4.230713802366054 522.818165757093 6.136608451294039 2.821510321685815 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_7 4.230940544203462 951.4107849994715 10.37719936834204 3.039389121891059 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_7 4.231335640430213 584.9917812445177 9.529059539995027 2.145880891399865 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_8 4.230687101465173 297.9187412506618 2.706661404512058 3.407418743362275 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_8 4.223695369042611 92.28216556100556 2.140958199172529 1.501581680635419 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_8 4.230404839171436 137.6080453583448 2.576304296097348 1.864148417359942 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_8 4.229815305021593 230.0337571990306 4.371942592886187 1.814448285478717 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_8 4.218826451929313 72.45670789831492 1.956405381870804 1.377771990850889 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_8 4.236052633613157 124.3991512058739 1.644741394809982 2.63906906315352 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_8 4.235822358229502 350.1224659713987 3.684319869540689 3.503597575351806 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_8 4.238183506312911 594.804299956934 6.143508162461536 3.449925827314305 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_8 4.236880854493351 869.2743617218018 8.540938417358403 3.446933138124891 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_9 4.23599136324206 78.904553770579 1.149460796575733 2.209934334805568 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_9 4.226031059975109 320.102768762211 5.828519851054836 1.91629387771663 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_9 4.24142156301206 101.5223280622468 1.359727138250289 2.500928681473293 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_9 4.231985183306173 346.8735037741779 5.004743346076418 2.34492336886761 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_9 4.224507859334025 332.5004798774375 4.830238262521831 2.408388276853769 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_9 4.242444748563987 123.0854192749217 1.669776977245347 2.47977940711526 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2 13C-B_9 4.24256425370522 296.4731384999926 3.720867311043873 2.67356826823516 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2 13C-B_9 4.242735877420572 379.1949817163206 3.554597593158181 3.485487821163594 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2 13C-B_9 4.242974369530396 375.1394897397075 3.979858343474163 2.915177769929604 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_1 4.083382011883758 174.904955758672 3.082653180940608 1.941277461810346 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_1 4.083215040438751 152.8764921372358 2.814100754492574 1.918416970804959 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_1 4.083235011062587 147.9483351278157 2.79441758828324 1.863501537806091 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_1 4.083640335222264 335.4856746924317 6.571468655619916 1.794272877909177 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_1 4.082972307652269 62.43459527469463 1.449381581564058 1.501770887237585 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_1 4.084554976538469 254.4337008259453 4.959117374058101 1.808692669047089 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_1 4.08328729335423 126.7513354410994 2.502411763984983 1.769704748446296 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_1 4.082940336151069 23.16215548838693 0.5068120703491529 1.590619882277705 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_1 4.083231276408778 51.71846173719481 0.8599181855418419 2.041104905740248 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_1 4.084825095620089 405.5513674879334 7.566360086094226 1.863501537806092 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_1 4.083371538501184 384.0003591136217 7.274094525180314 1.783140515672086 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_1 4.083368189399217 73.5865472185604 1.581903635828116 1.580758958995383 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_1 4.083445237437306 179.1091447023602 3.47253384061615 1.731416371035663 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_1 4.089098634887681 63.05637945387642 1.121340904542243 1.958035127662915 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_1 4.096016036020913 536.0814849682155 9.68601183486581 1.946409827087877 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_2 4.09464930343039 383.4518789826365 7.853967927559107 1.640471716065354 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_2 4.09442278908235 275.2244896109385 5.132083149647479 1.87121785257945 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_2 4.094763654718199 227.2276542076382 4.291806719362985 1.846857816351303 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_2 4.094942673670939 903.4261115127663 18.41557772629544 1.699074931529083 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_2 4.094653331979131 373.7438657851504 6.549451400946185 1.933762292910834 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_2 4.096102563397823 520.5014019538932 9.667314871464667 1.845827046846332 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_2 4.094929699352036 604.8249530304643 9.25659477072488 2.132253746762503 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_2 4.094624784599389 88.48251427405623 1.712611738505109 1.707474554178112 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_2 4.094683293941546 166.2681751430046 3.156370412803383 1.878678572920554 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_2 4.096277730752242 1441.491001112657 25.92638760670539 1.841320185137374 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_2 4.094832451677127 979.6606810689475 19.45506308975226 1.699074931529083 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_2 4.094992927711234 451.9890829219902 7.476673900001797 2.008068303351595 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_2 4.095051209509032 700.9781851821496 12.28645053957838 1.863501537806092 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_2 4.095860230731484 429.9154405899826 6.210849942914829 2.366598863375592 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_2 4.096453316312642 542.1439744719935 9.529441938177973 2.347022981921194 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_3 4.106322322541498 321.6584627331918 6.95929394618703 1.572848251050484 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_3 4.106227813429213 233.1704380679512 4.801086131072497 1.697768074218704 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_3 4.106389413691484 260.6966331810778 4.829439511827147 1.85763592913434 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_3 4.106574459014087 971.6129122941264 17.93644507547431 1.806078690397371 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_3 4.106068234954179 347.8870817488033 6.68361886585645 1.763308555263861 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_3 4.107692216917944 659.3078330195558 11.65613809637552 1.892801181490101 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_3 4.106435545612547 701.9501800151768 10.88774211441473 2.146119060502266 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_3 4.106238715259626 88.26809508884483 1.832777922914162 1.629598595531707 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_3 4.106176735893993 125.6194634546745 2.681341997672848 1.679698434241273 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_3 4.107839276400174 1334.58306201286 24.09897448287844 1.822684982674728 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_3 4.106441674012053 959.8096118774898 18.952458032353 1.689920749877517 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_3 4.106433261212221 474.0487155421668 8.174793877095958 1.920461261722923 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_3 4.10669058663022 1251.24343450111 17.36526111685395 2.32664772819522 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_3 4.107276449452679 1183.219720308516 13.41960819202703 2.992339112310868 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_3 4.107285972903041 1223.726511511905 15.54626075546852 2.596625835967313 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_4 4.117793430984734 133.9385198334929 2.392259189607986 1.902586952066784 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_4 4.117560106108285 96.59981396684175 1.653638223926261 2.038293638181389 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_4 4.117900001772042 152.8052341178559 1.7771822216578 2.669434600285395 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_4 4.117993963195484 406.2583237401323 6.77664113060457 2.028822157593504 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_4 4.117526174214771 87.82134602337737 1.908125282046192 1.631928827836535 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_4 4.118654943156334 531.4255099845611 5.775665485392058 3.209506489470771 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_4 4.117880522358469 156.1987851816949 2.900292421083318 1.860609266678515 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_4 4.117492901254008 35.78658838986823 0.6511435156052806 1.862131493947494 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_4 4.117631880267488 55.2911752409842 1.014541029548945 1.961849330681375 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_4 4.109575543831958 1181.954073478857 5.864187890122982 8.7560348553778 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_4 4.117941337112904 446.6681947088522 6.943572974844728 2.067848118106141 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_4 4.117805538896556 140.2597037306254 2.526032217276493 1.898451575246547 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_4 4.117808946242494 507.989335818755 6.870338187065103 2.40569883361775 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_4 4.11853513667299 477.6113571597033 4.962873708737348 3.077295748448676 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-2_4 4.118695498747459 291.2024662744157 4.685004830172239 2.145880891399865 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-2_5 4.119337836572043 513.3475666206708 8.457411112693238 2.01017308499777 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-2_5 4.118695498747459 291.2024662744157 4.685004830172239 2.145880891399865 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-3_1 1.312015012118173 2576.341084316994 52.1948500105557 1.677347152032218 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_1 1.311750044686697 2442.471316631741 43.81418156098465 1.846180488393836 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-3_1 1.311784386773464 2227.59609165691 38.94929523240417 1.973119275324097 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-3_1 1.312132991762019 6363.778291795908 126.1550758344591 1.725797716405587 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_1 1.311699946833629 1600.378780558935 35.1755634552134 1.589457194011078 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-3_1 1.312935597921839 5383.331789966618 91.63662585011778 1.961105182542978 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-3_1 1.31198210788798 3193.403351949932 56.47090056333759 1.903825026813274 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_1 1.311827320790552 403.2124277132467 9.748234416364733 1.460434185639506 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-3_1 1.311865438430857 901.4250337941517 16.76976222658853 1.832231645230378 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_1 1.3132600464597 10911.11157619191 161.8505871931945 2.243515600465876 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_1 1.311972373152864 6634.539026535585 137.3813492600737 1.660618570879118 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-3_1 1.31205835708459 1926.351071099164 38.18889078073154 1.74239308900628 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-3_1 1.312055463136756 4802.287595024855 86.63770312174378 1.830919080694306 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_1 1.312738894547567 2387.756346015615 36.15745253652766 2.260027961986523 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-3_1 1.312814241212825 3090.501665960639 55.91635787014373 1.87818062737655 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-3_2 1.323537002630016 2237.069609606952 45.1147646024482 1.644676939084325 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_2 1.323370531466182 1673.752031727639 32.3252369380989 1.806676359191963 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac-3_2 1.323528809086422 1702.604110271343 30.69060070831998 1.869066954787618 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac-3_2 1.323674557446615 5114.847643673911 105.4938405686716 1.647604042629943 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_2 1.323294952716446 1554.789037561264 35.5662776788764 1.534648325252075 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-3_2 1.324689255123745 3381.267455899114 67.86257216397782 1.738521914475285 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac-3_2 1.323550405242361 3316.833977338113 57.04023697974539 1.940628490300478 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_2 1.323463093447354 520.0721286007634 10.78924096980737 1.649329621745587 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac-3_2 1.323496644925868 905.1051330824313 16.70877480991268 1.865698278425705 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_2 1.32482866002615 7115.045270564056 144.6725972292007 1.696795191857324 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_2 1.323536846167612 5540.202964186339 115.0989093682788 1.637920002559462 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-3_2 1.323650373712435 1678.15037783167 37.33136812378024 1.589457194011078 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac-3_2 1.323640593412951 4656.53017407311 84.43998779044598 1.806760725920742 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac-3_2 1.324349670517095 2497.571053806216 36.79013485636061 2.256216309538484 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac-3_2 1.324399227053528 3088.613719318545 56.44663984031299 1.85939968168574 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_1 1.192071099485446 52.26975063309693 1.241354150184849 1.47397415633927 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_1 1.195369809903393 445.3842194267206 6.705467905846826 2.19970846058817 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_1 1.195516563519107 495.9843161389648 7.229426817055385 2.290257044476265 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_1 1.19560070882991 353.0631913443894 6.445541670636154 1.880203505883113 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_1 1.19522 321.795313 5.805569 1.883636 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_1 1.196651901653786 1882.531756783045 19.68277889792041 2.942954402255079 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_1 1.195423603203408 453.5545297775431 8.224506058754024 1.889001574658764 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_1 1.195343120336013 41.83773494564589 0.90586442863717 1.62511563290818 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_1 1.195423634532256 138.8902667379499 2.624155570870026 1.860703446554063 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_1 1.196692461873762 1157.832499291576 19.07609952411462 2.047938027136755 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_1 1.19546655413998 427.3053407786132 7.978762581385238 1.834000000809387 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_1 1.195635016844236 697.4954356957078 11.31718320598445 2.029079253469011 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_1 1.195585081733214 1383.081422653756 17.71316912344755 2.40258695552994 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_1 1.196317594102187 2113.115252752962 22.23883290518734 2.923740537051354 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_1 1.196385973391963 2037.256065537119 31.11040857329563 2.156803245330393 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_2 1.195463332223185 149.3406359850671 3.06818919988666 1.693209631375281 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_2 1.202445946469018 984.2845493262306 13.9584417980223 2.420204922427583 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_2 1.2025956793027 1127.245452567083 15.11986228738096 2.551184741696919 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_2 1.199290529324071 147.4743705421602 2.823931045170967 1.858945461000683 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_2 1.19888 61.40985 1.472266 1.506351 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_2 1.203779653606885 2074.14759015962 34.67933812335767 2.088940136043159 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_2 1.198808543714746 807.1330259321948 4.337086135159112 5.726308039579701 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_2 1.20316319439633 211.1908790734443 2.517251078991473 2.89149472516907 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_2 1.199161820418137 39.22262598157715 0.8320470778222808 1.737962228824691 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_2 1.20046671667406 329.640652705949 6.949281481052938 1.725955697850953 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_2 1.199177057329642 171.8565232891141 3.581729934107174 1.708619787800171 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_2 1.202732868105805 1285.795674771633 22.20379129076846 2.027928144083099 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_2 1.202720811445913 2162.908065430784 34.66613048099368 2.137545881601105 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_2 1.203430297600519 2724.473267548683 41.36059972237545 2.313131861115967 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_2 1.203481797275503 4166.074030878811 62.62804055927725 2.25549862891787 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_3 1.199250449079328 117.0988149492769 1.67340927075977 2.336544480585865 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_3 1.206827512405797 356.9197698168226 6.663996479885249 1.875596352216519 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_3 1.20699687991913 375.8762629819863 6.823464363733206 1.915636208800335 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_3 1.202856860273338 904.6795394283214 13.9472514247495 2.259782660643542 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_3 1.2025 737.002435 11.495156 2.23121 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_3 1.208111496017535 972.1805942888665 18.33070691532621 1.85745268281336 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_3 1.202786637791752 1115.410951155454 17.80296963985212 2.210477537655407 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_3 1.206853412336022 34.21780890158889 0.8241734222355152 1.478805541482805 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_3 1.202680158919832 344.2402225876889 5.558078037673469 2.222203584339171 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_3 1.204066281963904 2089.731525951826 33.04467096614155 2.21858756166408 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_3 1.202818879518042 1065.088270974116 17.26174538423757 2.166792493777625 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_3 1.207073052807453 632.6534827747282 12.06367636760809 1.823121374835915 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_3 1.207089179711781 1016.725107111926 18.90585234608277 1.867671067400624 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_3 1.207805674761929 1470.659839739375 22.65928764156792 2.258892783501813 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_3 1.207919836941361 1652.621166300175 31.79432735187216 1.859030800163206 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_4 1.202787956280452 411.6931658198133 6.980423179123167 2.100029357867982 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_4 1.209673374901379 453.2593354261551 7.378126662330299 2.1951796020473 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_4 1.209832192799692 502.7871008463586 7.980570470526329 2.257444014266845 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_4 1.207066930002722 346.439435247837 6.884730831582305 1.760774896148657 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_4 1.20668 301.701691 5.943701 1.776548 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_4 1.2109347849229 1182.144751472253 19.47961827678499 2.127318298334201 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_4 1.206928014456919 530.0820992719999 9.867236348497068 1.901246553533182 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_4 1.2098715064446 49.06754149678837 0.9014495458582872 1.989666065991029 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_4 1.206896916336237 164.0301299527615 2.787679364144682 2.029795188806353 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_4 1.208192901003336 1048.926075459552 19.09216925504263 1.91670226285754 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_4 1.206893388023169 471.0794996307448 9.152732963927534 1.799266243073408 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_4 1.209890686279397 670.5108171728108 11.87014709447787 1.983695684966471 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_4 1.209920749078345 922.9417346589045 17.12593431693673 1.932175649943337 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_4 1.210523448283209 1207.338685873997 20.37485150788 2.174068732761154 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_4 1.210617124307913 1695.497464762972 30.81213844219702 1.972885577743952 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_5 1.206844293249514 169.0005613796113 3.338794010984773 1.761296938919174 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_5 1.214048668225385 843.9198860548321 13.35183105086283 2.181003806093551 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_5 1.214199557885511 925.8743071113404 14.17361801735902 2.251061328084614 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_5 1.210049047697114 485.5493911861784 7.860279664133951 2.223131985240733 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_5 1.20963 355.335057 6.086959 2.089979 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_5 1.215346769179728 2243.01112662083 34.99844853101555 2.171244428154861 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_5 1.209899942412376 672.4526146555335 10.30757494244667 2.294340837091243 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_5 1.214227617010113 121.2080455611771 1.877410181053132 2.181109216209328 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_5 1.209842829306694 176.5674362398076 2.815864804963142 2.187911610016914 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_5 1.211285397544883 1027.71611326593 17.63663213576653 2.155381698189186 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_5 1.209968828680231 561.6796941764946 9.313628596769961 2.17698832806036 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_5 1.214306633058677 1301.08236674247 21.86334145867156 2.027928144083099 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_5 1.214309117543665 2155.18425670303 34.12539098076638 2.137545881601105 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_5 1.214993104459057 3230.616025159671 43.34888823922577 2.517298621505509 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_5 1.215055404079146 4135.857915854049 62.4761370357875 2.192354750360107 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_6 1.2098671938115 308.7264880588316 4.277757379291591 2.45247728633001 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_6 1.221083237132803 546.5286580795736 7.069885319232746 2.433604507150514 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_6 1.221293446588199 639.7192760976943 7.634014085470154 2.614306141693716 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_6 1.214370501356721 895.2675748724441 13.68909081901718 2.222267065243757 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_6 1.21402 659.747424 11.167193 2.056851 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_6 1.22241332712153 1345.525021587457 18.77259169884192 2.268437373087433 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_6 1.214315043771188 1193.437632316174 18.54939102663676 2.235428868647822 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_6 1.221134554455233 35.92568889185005 0.7694231796285279 1.652033564804846 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_6 1.214143513449149 310.297471674807 5.224576483096636 2.081206759433559 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_6 1.215613671237539 2205.20365403862 33.14623156162803 2.276652094676233 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_6 1.214339404020649 1065.985070456617 16.83765620098833 2.186385805665971 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_6 1.221336715175106 675.8530280921233 11.1949016903568 1.982091896524718 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_6 1.21830399317456 101.7558567532029 2.450536650530218 1.448869180344303 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_6 1.222060734752563 1375.170782559236 21.15809378630437 2.26783294540206 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_6 1.222107539133715 1807.86506325958 30.999178702119 2.003737417206627 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-A_7 1.214231851227551 415.5035589822995 6.71922947001693 2.097857554848015 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_7 1.218206493449908 34.80162801464136 0.9944878522757802 1.229436198200013 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_7 1.21784 50.918692 1.348307 1.366891 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_7 1.218184278111295 86.41805012022853 1.990101832832594 1.515165680382214 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_7 1.218017458185996 18.03496371531264 0.424772223517364 1.522249208373126 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_7 1.219411263351216 230.9545409088967 5.311073687186991 1.52427184098763 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_7 1.218111399444511 86.32786741948783 2.221814175818609 1.387151506259694 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_7 1.221345569767213 938.6836357805065 16.48569144176415 1.927972050410602 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_8 1.218059530792137 24.3576043428574 0.6062318347727786 1.365347135461898 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_8 1.221493577160297 518.6633520067144 6.82070907841486 2.405116141473746 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_8 1.22103 319.821478 5.288634 1.978889 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_8 1.221301382246202 572.4590710395802 8.775436708176361 2.173113650546323 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_8 1.221221096449323 163.7028113305715 2.570012417721428 2.135700064082891 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_8 1.222570302969546 941.8199398598787 14.64429630112594 2.086425792563344 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-A_8 1.221307048158329 602.0332904432681 8.096461641643756 2.315359097948619 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-A_9 1.221390157828306 231.6324861053921 3.508901220739509 2.168920071261313 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_1 1.408647615904236 136.1998025719061 2.783728352343619 1.693209631375281 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_1 1.408481693210721 325.9341995388019 6.038845210906372 1.897641388358067 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_1 1.408673249966937 377.1022922803346 6.575020881107237 2.001211534317629 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_1 1.408738998400616 262.7645323263956 5.453740729329227 1.699074931529083 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_1 1.408331357745771 264.7211438897295 5.022785588497992 1.825179285505666 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_1 1.409806753318996 909.2320176090421 16.49499679753596 1.904486964142688 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_1 1.408648991909591 418.7206066991398 7.825675397620278 1.895234440688277 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_1 1.408488747086183 24.6657907059612 0.6018215216900179 1.455895474756245 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_1 1.415745450315513 222.5158709210485 4.327576227588315 1.865780099255211 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_1 1.409891349852257 684.7227552003285 13.20933468334959 1.808692669047089 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_1 1.408637057619529 299.4949313456088 6.241217142955422 1.68427255297537 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_1 1.408738998400616 479.9384970967628 9.860846043818349 1.699074931529083 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_1 1.408737838142809 822.9983349821839 15.20836584139204 1.84521556449655 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_1 1.409421575765158 1383.71674886158 20.78048493868717 2.323391953998649 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_1 1.409497734527244 1574.19239980081 28.51717148102758 1.918310406565094 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_2 1.412041234915187 17.36838144029437 0.4800109564304599 1.282318946095197 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_2 1.41558098578778 730.283459303154 12.36835177370454 2.060205758864364 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_2 1.415715551679143 761.9121605631727 12.8693061017982 2.074404152506083 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_2 1.412178874652372 65.72248140085661 1.403934350550236 1.633420919564128 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_2 1.411959264556846 34.8267102732209 1.00767648230213 1.289862913415148 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_2 1.416868505783259 1859.982870300132 32.42750757907021 2.002418919008106 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_2 1.412296475540975 115.7806941780148 2.352739636983705 1.780505115418268 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_2 1.415711371735144 77.73101048382796 1.525884969551593 1.79400664547944 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_2 1.41999366632426 129.3133128662324 2.469825972899734 1.856303613828798 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_2 1.413570261659575 267.0771434769374 5.469423120004021 1.710458811208708 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_2 1.412211889611199 73.22576299814627 1.891667526889854 1.387860101748046 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_2 1.415839496737036 1243.518480784796 20.91535491953855 2.027928144083099 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_2 1.415828422212944 1887.521478376787 32.03818167038482 2.027928144083099 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_2 1.416527594193626 2745.258802450639 40.31768869106149 2.375847861674291 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_2 1.416601806931254 3847.910569922078 58.95793162930133 2.213035802825584 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_3 1.415805690198914 343.8857816203632 6.217328104781895 1.931639056718656 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_3 1.419942110413315 366.4237947250919 6.467504797346021 1.964435144271629 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_3 1.420073467331788 434.2619382864118 6.925643337812915 2.109181640767678 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_3 1.415917637866747 696.0535542989585 12.23928823070921 2.002359890855307 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_3 1.415549508685431 559.0121500583608 10.19030568868639 1.938541247280081 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_3 1.421239854731974 865.7501852740625 16.80142779577367 1.810135841800348 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_3 1.415842459615891 954.2145027239584 16.81287270637975 2.03484194769591 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_3 1.420977793267746 106.4089810858782 0.954375261503416 4.492203696191996 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_3 1.422815044195978 174.6248532591229 2.773965212479266 2.183607964513655 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_3 1.417173052112712 1788.406370861796 30.50702204773743 2.083061709709659 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_3 1.415882772824588 847.4359725459383 14.61371933110906 2.023378330603416 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_3 1.420197618162794 516.8151718751436 10.85886403605251 1.701225786686913 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_3 1.420188171118296 841.5049641084053 16.79582467322084 1.763993185416641 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_3 1.42093042936718 1307.429432656231 21.14199976055435 2.159797161516493 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_3 1.421023665455634 1532.720787593552 29.8472075351976 1.830183511683553 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_4 1.420079623207226 196.6592142135106 3.494666667850087 1.909041273200388 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_4 1.422692899253073 396.7310631733935 6.462545345550771 2.142020210071812 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_4 1.422821632514385 418.8335397004132 6.829364634417939 2.160695433333779 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_4 1.420174053758713 352.2650123118454 6.795005645460727 1.80937212949551 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_4 1.419802455540719 311.6365489916708 5.929794062930299 1.817524372723735 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_4 1.424017455902268 1140.987663968726 18.41568084597138 2.138379000307558 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_4 1.420006008148095 569.4716115245943 9.883633934623115 1.989750687989096 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_4 1.427372066644282 89.72814573920866 1.637642441534884 1.909677441444668 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_4 1.427311340091548 268.42918249619 4.878142528706497 1.969108865113901 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_4 1.42128917586354 943.5944837418284 17.64696322455129 1.865719600579324 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_4 1.419995931866288 396.8362839125949 8.02914618027862 1.727282638093991 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_4 1.422993539567927 656.4194064971458 11.34821359908026 2.017912727475781 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_4 1.423011679592931 971.7561797079073 17.08447530007185 1.995600638277547 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_4 1.423610630867513 1254.262897675009 20.23742856423409 2.222080768439041 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_4 1.423724317980843 1774.125657319783 30.68178053812245 2.035518590934214 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_5 1.422900747668001 206.0421907323377 3.485778517523324 2.058669462014458 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_5 1.427198262669221 707.595359774602 12.08088857647452 2.046491539785529 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_5 1.427343178204768 812.8239627017779 13.27478986595782 2.127195238504582 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_5 1.423004853191443 395.0407994931046 6.717908486917533 2.067431276032161 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_5 1.422703592464132 307.5266764479933 5.532909623525238 1.979099919572817 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_5 1.428484768769239 1730.994450102704 31.67873618025781 1.918310406565094 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_5 1.422933147645332 583.816828550215 9.24232905940617 2.204073860043215 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_5 1.434157264959297 25.9109759680411 0.6144403067890529 1.482368898421961 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_5 1.430980338146574 27.69421561151196 0.6333197859200264 1.631243800672568 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_5 1.424387051636982 976.3275836811645 16.45488046814158 2.137469978681581 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_5 1.422994667835777 473.4543311972938 7.793087367741887 2.119599408827438 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_5 1.427455582184978 1113.988488307203 20.15041566197222 1.918310406565094 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_5 1.42743399239253 1847.870239938239 31.54883995359064 2.027928144083099 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_5 1.428123415623783 2944.384222644751 41.26322045276768 2.411590225396118 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_5 1.428200311486798 3683.790062014837 58.94299198703996 2.137545881601105 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_6 1.42738102766198 333.086287572204 6.176081825555195 1.912445106411291 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_6 1.434153673369062 334.1181123508196 5.897195465915469 1.976903442090216 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_6 1.434326097386802 368.2149690791289 6.429490204724456 1.984026518175265 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_6 1.42749758945575 750.5253317370974 12.67211078235723 2.066556843189258 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_6 1.427152674684292 570.3477001870392 10.35584991841775 1.924967187132268 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_6 1.435485409457236 836.5395154061088 15.85933293620632 1.840485945802208 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_6 1.42741559058367 1185.683879870022 17.91951228893436 2.272641169615604 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_6 1.434240667322732 134.6144891449247 2.41104198697311 1.948130274131085 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_6 1.428750646119306 1777.158306421824 29.87074653482859 2.082737012842102 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_6 1.427472410158359 888.174066764053 15.15682808572509 2.052629262720449 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_6 1.434445569255353 487.2367189819791 10.01738399825793 1.707003599698383 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_6 1.431413891671865 117.4448837498568 2.794919178002098 1.519095362593783 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_6 1.435172315923518 1181.880234065167 19.48159636862599 2.153621338572154 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_6 1.435239419592753 1577.64365184168 29.09168950000092 1.899938733022271 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Lac13C-B_7 1.431218423537474 50.39650366705097 0.853410903072111 2.00244624445188 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_7 1.431372614226659 60.27493040492159 1.465729303732857 1.474380372693602 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_7 1.431033741509589 50.05713024659147 1.360512396268404 1.371229784717781 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_7 1.431322761158504 79.89750264755251 2.031247972426362 1.450179717601017 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_7 1.434240667322732 134.6144891449247 2.41104198697311 1.948130274131085 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_7 1.432525311509543 239.3977784697676 5.472220982851457 1.563055656797887 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_7 1.431219092509908 105.9181795787626 2.523582204544716 1.481019167889293 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_7 1.434453380369866 772.9906321680713 15.52678656779475 1.737095154914209 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_8 1.434374858764301 126.7878396710168 2.741043684264122 1.611259926715206 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_8 1.434473578985431 293.6723646070878 5.434667601693827 1.827280220175141 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_8 1.434110769860248 224.7057024831387 4.735940508051009 1.667680281601646 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Lac13C-B_8 1.434340195175027 525.0851987810618 8.72244346977405 2.066294352214401 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_8 1.435631753080613 645.3789361587782 12.82645062109484 1.755655311247875 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Lac13C-B_8 1.434360300462359 331.7945699834324 6.410870357694715 1.763137324291244 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Me-His A_1 7.020069573899908 74.74018015151464 0.763089641155879 3.608637127988751 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Me-His A_1 7.019258746100212 94.70558663178278 0.8518573872365989 3.985981681455455 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Me-His A_1 7.019114058896011 103.7294881217091 1.207648192541694 3.253741304011907 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Me-His A_1 7.020192903136802 128.49214227751 1.462995374089418 3.432420688010077 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Me-His A_1 7.022739428887285 64.55171410002372 0.7911695170879359 3.343133053429514 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Me-His A_1 7.020240412515904 184.4999553544544 2.133277927164106 3.414625930114016 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Me-His A_1 7.025977025410421 108.4783148993018 1.053380184167114 4.100437425406326 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Me-His A_1 7.023452147969466 9.272699194192422 0.2136444373843899 1.749510345645483 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Me-His A_1 7.021343327711819 44.65496199547994 0.4405018512918984 4.081031644736382 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Me-His A_1 7.022801066214347 159.8079540174686 2.07679948017805 3.112425648598019 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Me-His A_1 7.019597044266275 117.5446059059187 1.319113930960742 3.36873623086838 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Me-His A_1 7.022848621502903 116.0368465964997 1.154277605802175 3.706271369274616 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Me-His A_1 7.02921227537809 154.8907559730055 1.882916336312336 3.209319622005594 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Me-His A_1 7.026475347627727 174.1002421085099 1.983866473959109 3.492300667427502 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Me-His A_1 7.025246938707218 191.5022527275654 2.305708444414754 3.253294222210278 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Me-His B_1 7.716610628377138 137.2509268877818 0.8992557366066333 5.422379660857883 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Me-His B_1 7.716287038271339 194.0299270063765 1.34336082990749 5.448539414901977 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Me-His B_1 7.715511766415427 140.3537055365916 1.455038211516315 3.489861675645903 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Me-His B_1 7.71639013567762 176.524943568216 1.861995685472609 3.577752025940725 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Me-His B_1 7.71869692563789 95.01138112217427 1.054486651652806 3.214857818906276 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Me-His B_1 7.716693710348782 356.878687038203 3.698208944563904 3.317762404227683 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Me-His B_1 7.723430958691144 576.4205985956913 1.698990214446851 10.62735095569861 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Me-His B_1 7.717663092320048 54.43464777881233 0.4804929113273925 3.853350891225559 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Me-His B_1 7.719782393189852 422.7648330465314 3.750150386512202 3.70043739138905 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Me-His B_1 7.715820881815873 116.919804161951 1.429222035244219 3.468718128150349 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Me-His B_1 7.718912854417599 185.4302642653014 1.60991913628311 4.14892357902138 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Me-His B_1 7.729350058812416 167.283991488164 2.096468698823799 3.195697108184947 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Me-His B_1 7.724286485323536 366.3352159708767 2.429927963881258 4.897992232927229 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Me-His B_1 7.722118893322836 379.8049385678204 2.914407717866223 4.497082833767231 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-A1'_1 6.030372848393925 52.46146173932383 1.000814714294433 2.027883211772368 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_1 6.029821151991351 76.21114642529794 1.180063183121403 2.412049861702204 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-A1'_1 6.029836482353757 85.40474513818859 1.29943460238594 2.427921435424987 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-A1'_1 6.029855058520558 111.3412543175106 1.564023228692833 2.701081641301302 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_1 6.019792601711997 29.26473455937215 0.4960137352965314 2.065566086198625 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-A1'_1 6.029644234223942 123.1465132005461 1.981476057418514 2.478485150419556 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-A1'_1 6.030279872052853 68.50947108076082 0.8534793824236748 2.954586176582169 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_1 6.031025145014009 11.59343681309624 0.3002196546080958 1.558232519477437 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_1 6.030593384780573 147.7300536068797 1.889770002173494 2.790869035238848 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_1 6.030382092009302 84.53793081972384 1.156855274668908 2.694164748385182 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-A1'_1 6.030657653870439 72.74179034459974 0.9393394964875107 2.818232147021681 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-A1'_1 6.030757360902692 94.7610792109705 1.064214853067916 3.192259980708648 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_1 6.030948446686069 99.24887242519505 1.007498851184721 3.681917357007851 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-A1'_1 6.030527000860444 108.0596249561792 1.149932350971257 3.369129912863778 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-A1'_2 6.041100504856865 59.11966452932624 1.053944352264187 1.984670317433391 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_2 6.040826357367728 169.3630279648413 2.45757999766216 2.37836093281705 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-A1'_2 6.0432091836051 19.58826675377692 0.3358098519493661 2.039795021445035 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-A1'_2 6.042495065258287 76.33912576114764 1.157850974615031 2.954996485456822 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_2 6.030707656232317 45.65706587985982 0.6656156995616114 2.554641742998571 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-A1'_2 6.04182388052909 217.4644963563551 3.549290180233377 2.196713655137204 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-A1'_2 6.041434485645466 221.3962750735278 3.1216027131204 2.523945044504144 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_2 6.040887530356731 8.099206468802212 0.2020870515932663 1.467338669478613 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_2 6.042200536405372 347.5227505353607 4.888294786561721 2.598263615264077 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_2 6.042559629225139 78.4387869873319 1.103798609294129 3.166654808558977 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-A1'_2 6.041191887353245 75.20749413278756 1.083554177603971 2.449998589794567 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-A1'_2 6.043540900199869 51.74890874782989 0.70328074965204 2.78726489420331 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-A1'_2 6.042286357667335 105.9161260390931 1.421431804536704 3.092585447696365 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-A1'_2 6.042041195408067 122.8744394477477 1.794881712985796 2.547911201075086 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-N1' 13C-B_1 6.211829873737306 190.2737345427015 0.776385222666467 10.96452482718217 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-N1' 13C-B_1 6.213383376176271 116.8895674814623 0.5082549552295239 9.106704347649679 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1' 13C-B_1 6.215180278783482 109.7383611588536 0.4021452110514382 10.35381424786362 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-N1' 13C-B_1 6.219633343757546 220.1712821707998 0.6774386817234787 11.34022422484919 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1' 13C-B_1 6.21805128963527 276.341703777501 0.884966501253721 10.89558519010687 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-N1'_1 6.074709245775942 84.70188255401978 1.027653213899664 2.797990925974638 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_1 6.072836191792837 176.565392226816 1.589599821452114 3.850829826862009 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-N1'_1 6.072395549871599 265.353804077437 3.145323874651542 2.943682106302544 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-N1'_1 6.073481175258078 300.0595520926335 3.301238084635465 3.171477037859966 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_1 6.070584602155146 28.68930161111656 0.2704216336678136 3.696940658696164 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-N1'_1 6.072157364194307 337.0352018592432 3.901141452393952 3.026545124293995 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-N1'_1 6.071356965560001 66.67868185619174 0.7254978701233042 4.081857894677709 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_1 6.07783558295348 11.96687379767157 0.2884451242111987 1.619426516001773 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_1 6.075153605425301 222.90114643565 1.978152415423508 3.831474260015745 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_1 6.073002274461557 195.3759908503896 1.853433639426274 3.5439153029026 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-N1'_1 6.061703854574124 45.23893421169302 0.3 5.261651400864258 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-N1'_1 6.084138139851227 82.73415513371584 1.109297665297707 2.80519042025389 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_1 6.07112858253892 125.6215775767358 0.5939549001930652 7.582935592418586 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-N1'_1 6.054194054613806 79.82155510835726 1.446823848810065 1.999847930358157 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-N1'_2 6.084665550765368 53.19078907943413 0.9402635567294272 2.028212351171067 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_2 6.083212174456699 58.89201883842564 0.9760077168945864 2.23454248309198 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-N1'_2 6.082374963025927 186.7639416540744 2.418905448869471 2.763325436382391 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-N1'_2 6.08363826496963 181.3547753085177 2.553559446255645 2.493651218853697 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_2 6.0818839638427 184.7115431422771 2.727315904619343 2.517022154915472 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-N1'_2 6.08147410375897 25.32037961979211 0.4212626668621686 2.454906967755819 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_2 6.087672412428152 4.966535567362781 0.197786164354307 1.197518779667693 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_2 6.085174140038373 77.62735082392132 1.235273955658879 2.415422815979922 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_2 6.083063768894856 85.76069871590852 1.304656672363789 2.377966909523277 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-N1'_2 6.07808050561365 33.39324044036636 0.4632775433624222 2.515059575936004 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD+-N1'_2 6.093808737590681 100.5150953594394 1.246854262821099 2.812849888015954 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD+-N1'_2 6.081114971837613 41.11690924891114 0.601455608313172 2.48501865973877 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD+-N1'_2 6.072300208809363 205.5796900858189 0.8972489393389236 7.05009370672152 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N2_1 9.325426295095188 136.4926138976661 1.049943991050735 4.536009754502969 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N2_1 9.324698318304796 174.7245639739105 1.220382371601035 5.554241367869562 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N2_1 9.324912619303928 205.2865751734242 1.451581914454377 5.443468012199406 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N2_1 9.324880407069609 208.4823359523455 1.577359832221872 5.070779890131376 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N2_1 9.325182360562312 89.65780680489188 0.7658516056054779 5.131956518685285 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N2_1 9.325071801045818 296.3799639963032 2.177643192693469 5.458843118916351 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N2_1 9.3252876536924 131.0039372521192 1.024419705922571 5.648206654230103 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N2_1 9.32865218233422 5.992111304268938 0.1525878613809961 1.370221718975067 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N2_1 9.325263356649373 49.3715501223793 0.3943105668467538 5.288191016230803 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N2_1 9.325048761423261 166.3371579626241 1.221015452846472 5.203220678973747 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N2_1 9.324639844727274 114.5914111409926 0.9851376862333573 4.716302968970986 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N2_1 9.325128976573447 147.4939018609496 1.035307664168077 6.02403980137937 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N2_1 9.325504537419569 224.2542805479655 1.500547576905442 5.814423254010747 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N2_1 9.325603102636679 232.0263111355483 1.511424198786436 6.818013884854786 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N2_1 9.325297121950854 311.8497250878017 2.13422192013978 6.420972654602074 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N6_1 9.126101668933417 55.94963062591692 0.5497474364030167 4.237784601563946 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_1 9.12594574109005 106.9254706430731 0.621336427807113 6.703605837580654 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N6_1 9.125795725379623 92.71549856580496 0.7467520865758877 4.553352173824838 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N6_1 9.125306307738324 100.4099541657287 0.7858306574306373 5.390412421604558 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_1 9.12616686191653 38.07239427830064 0.3439255500124618 4.335951965866382 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N6_1 9.125553861598085 156.6319028199199 1.146164423846142 5.420070295076333 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N6_1 9.125732707271958 80.68632527630166 0.5310303132342001 5.087163393055256 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_1 9.138895727974724 7.066123126022111 0.1047828421266074 2.353000329650848 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N6_1 9.126585908212942 29.95732346186986 0.2517002646514154 4.152888757559776 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_1 9.126096817423704 114.705110610408 0.6422668309415503 6.151284090627444 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_1 9.12541152453461 53.24387382492907 0.4851212910597446 4.62230182285456 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N6_1 9.126490238394863 111.2714960091267 0.6182751167091857 6.279616477207609 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N6_1 9.126814761288834 107.1388378123449 0.758062906263015 5.862925288219488 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_1 9.125491023241153 102.0919630521407 0.8252200052073155 4.416053234459048 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N6_1 9.125794431627805 151.2936729126548 1.061492536254943 6.051389035386611 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N6_2 9.136078166849867 51.11391114444419 0.5067743537369749 4.241388017740674 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_2 9.135860734615854 53.0837301622975 0.5379669416456974 3.83233935821721 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N6_2 9.135762046694438 87.48471486090253 0.6864384427272074 4.835655836901103 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N6_2 9.13613427472522 80.60040123917288 0.7388340119929994 4.752510842870711 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_2 9.135802365954396 60.62955744633373 0.3906367620677555 6.268451874316486 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N6_2 9.136104460092918 134.8797367379767 1.049111794186713 4.99281151623224 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N6_2 9.136208507297287 81.37772627871531 0.5476601267389556 5.184720988769179 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_2 9.13645644167954 47.86097960383567 0.2949318493237673 5.335900972863167 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_2 9.135378982326479 78.03981733846466 0.5317972915165755 5.120366935784708 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_2 9.135930855979352 53.04987017610243 0.4869480357810565 4.461712719800619 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N6_2 9.135963089401862 55.38290319276059 0.4918474562575738 4.169448499597835 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NAD-N6_2 9.13722726802049 86.66622318066014 0.7242523584534153 5.178435620914322 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NAD-N6_2 9.13590359495444 163.416252684533 0.8442235304227734 7.699527640616981 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NAD-N6_2 9.136260353733936 171.0944960372651 1.079032704628472 5.909852377810219 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N2_1 9.276732528276368 9.754932208322174 0.17743379205495 1.918310406565094 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N2_1 9.27819894683754 31.72827097323015 0.2403186826424464 4.606698959215827 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N2_1 9.275844605230267 39.45877654768081 0.245383212420149 5.610863832884315 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N2_1 9.277103306762543 52.86536452863925 0.3504454707284325 4.875257525061274 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N2_1 9.276841314149616 8.189837925578619 0.1292489805135508 2.210951126555955 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N2_1 9.277634689426112 78.82149769691978 0.4938620327664646 6.055692908558605 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N2_1 9.277435163436142 15.07970594095107 0.1920007792699667 2.740443437950134 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N2_1 9.275706169609954 3.195847132277693 0.0776347488007293 1.436351746235378 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N2_1 9.27853507075072 67.81700757314731 0.4190020841146969 5.970652558376061 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N2_1 9.275377407747463 25.82406608533035 0.2453747921320654 3.67219420685318 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N2_1 9.27857890372578 16.67787790693362 0.1852470246001276 3.141380260552954 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N2_1 9.27655544584465 41.08492465789118 0.2645692772405799 5.418437214526029 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N2_1 9.278801997553403 43.80796293844991 0.2693746452011766 5.674496140470121 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N2_1 9.278141506097821 98.62212067018626 0.5889826365746204 6.626719932864744 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N6_1 9.085347943182402 2.654601708665019 0.06453066854249194 1.435370996630177 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_1 9.089346819761657 9.618901605952555 0.1323883217320175 2.928719229308242 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N6_1 9.086066179995324 16.1827209500449 0.187730193160967 3.007796015998522 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N6_1 9.085811076530055 13.07003883831395 0.1655165927659297 2.7552835664401 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_1 9.08872434609295 7.073369019735323 0.1549548437759396 1.89793689333088 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N6_1 9.087308629948145 52.2805315706893 0.2463799195611501 7.403986990768189 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N6_1 9.086709014151868 16.69177911324711 0.177105276991422 3.288532125540161 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_1 9.092823450171057 5.972155787400496 0.09617305219173597 2.166749426162921 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_1 9.085569506556453 13.05571107352555 0.1768896823050476 2.575306890983931 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_1 9.087479305838981 23.95388953742093 0.2031832634581002 4.113571708140761 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N6_1 9.086797912406382 8.189860376973874 0.1533478543797465 1.863501537806091 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N6_1 9.086381213119639 14.98929073661747 0.2446789450435105 2.137545881601105 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_1 9.089601821362056 5.483569750101512 0.2003762910880985 1.103110380683164 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N6_1 9.087431739897756 26.28906506731025 0.3347227723781518 2.740443437950134 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N6_2 9.094850286673218 1.700175965547984 0.06137562416479315 0.9665602087063518 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_2 9.096015037176436 5.65972689983845 0.104980501421561 1.936016765345099 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N6_2 9.095902042940773 12.85563722184942 0.1441614036142093 3.111541284732529 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N6_2 9.095856623854365 18.92447519364694 0.2047073744767312 3.225680270296795 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_2 9.096229533245104 2.903787703320795 0.09828731267464619 1.40894163182886 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N6_2 9.09616405667397 36.10254892377701 0.2603258123683139 4.83895512127055 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N6_2 9.096507684653998 13.78655195876574 0.1524752980444624 3.154911145868426 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_2 9.098838925675286 4.85960549012484 0.08659311317273398 1.958162015605045 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_2 9.095558469925672 7.938719903194637 0.1804980734879199 1.534648325252075 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_2 9.095918665705272 5.035057845485837 0.1187191622018814 1.479839456493072 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N6_2 9.097201816336895 8.185021083370147 0.119104820540584 2.397846758387408 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A NADP-N6_2 9.096828136864739 29.65377360387814 0.2597243116770014 3.983807317459063 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A NADP-N6_2 9.09867094624531 21.87689525396075 0.1847169697566215 4.169994415421169 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A NADP-N6_2 9.097670061895762 57.80172696894481 0.326591357665051 6.175428353937765 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Nicotin-5_1 7.581424382672291 37.10299825648501 0.3434958966876361 3.32364850624557 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Nicotin-5_1 7.58272794818342 28.60163052227038 0.4569420631649313 2.112036656526111 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Nicotin-5_1 7.582792974612549 74.51918179191007 0.4211006147436647 5.459763991269279 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Nicotin-5_1 7.581212619313081 40.58477612317953 0.350153847032341 3.625248220002307 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho A_1 3.215030513024977 17038.89677475013 237.193079415444 2.636316664450003 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho A_1 3.214374568614048 19796.79158086155 331.6185371623594 2.185419817539088 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho A_1 3.214103899575696 25916.283107454 373.2389151822135 2.500658034070366 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho A_1 3.215126692960987 32805.60879352728 448.9418180473396 2.735578402188474 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho A_1 3.214291027870007 4540.916617927473 69.0273912196934 2.369075387931874 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho A_1 3.215398227509218 48163.30532516413 725.2419679061638 2.3597456332036 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho A_1 3.214474765030559 5071.885721133997 69.07939676020973 2.557430509424571 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho A_1 3.214466612604084 493.2747266397006 8.201224158839484 2.156437006128789 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho A_1 3.214433156685138 5120.104972037406 80.04752125734225 2.333538048782806 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho A_1 3.223763963459872 20283.45037649703 284.1935648573241 2.430876725481817 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho A_1 3.21486177997181 12414.03132469985 194.1558518485935 2.292392326552112 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho A_1 3.214574751499101 5731.194659126048 80.74354368941896 2.494111934132465 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho A_1 3.214616682496166 7008.760371043032 96.73301590057822 2.528118606135334 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho A_1 3.215274214556777 10088.25596261254 121.7449166519209 2.891320380383485 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho A_1 3.215306433966549 10098.15569299417 139.1360327254938 2.527639003977685 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_1 4.133216745451168 82.44798417800166 1.383803332918196 2.097927366435898 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_1 4.132942597962031 155.149123543649 2.327767427223 2.414147770764735 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_1 4.133041448877375 237.196659325788 3.03742040209165 2.85868479321597 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_1 4.133192911845696 210.5368456328831 3.438593030966869 2.323122620494659 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_1 4.132103399677611 30.75693681880139 0.6599361703950907 2.221421062691272 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_1 4.134174619234097 325.5310230705673 5.288704435329108 2.405525584388034 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_1 4.14295 53.925203 0.983368 1.914869 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_1 4.137919636425945 60.44070855583448 1.02585447628488 2.112371906737241 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_1 4.139292225031861 113.5869977318289 2.113335811125756 1.933112599643621 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_1 4.137962011217776 49.39705681275162 1.016314844504627 1.716951888627843 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_1 4.138147536671695 68.16031836033973 1.151413587352271 2.095884159301913 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_1 4.138654046596973 47.77036280905408 0.9293168994408079 1.842982870650437 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_1 4.143266616191542 445.2049157166326 3.514519677977779 3.962085961425256 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_1 4.138878788405282 90.28742505351573 1.659651558147664 1.985933194092728 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_2 4.137960077724651 115.3405514835464 2.048822261304099 1.993921378382911 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_2 4.137733891605338 193.4767568096051 3.095855252663694 2.233457368041084 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_2 4.137968635262889 278.8132127151765 3.878800086081506 2.48058420357738 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_2 4.138091614269532 238.0245553792173 4.182585555231932 2.018440581339572 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_2 4.13787725276651 54.51999973793314 1.012683109372704 1.939738807094471 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_2 4.139072917036884 325.4727615900793 5.699739355482291 2.04428552241462 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_2 4.15111 1014.390019 3 12 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_2 4.142251122883441 157.9400186071868 2.227494788000274 2.468614082060469 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_2 4.143635823874575 312.0520010333161 4.163860650217141 2.592220238215809 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_2 4.14222927331922 209.060901938708 2.697309769790329 2.657384585413995 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_2 4.142486686772677 179.4651005217536 2.372764724249379 2.639102699013207 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_2 4.142997123263832 190.8456376471607 2.763281458430771 2.428665360871713 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_2 4.147497827948075 524.2182583073144 3.52575805341256 4.627351601026974 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_2 4.143314927604619 338.6254571159864 4.41410955207536 2.661656807303022 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_3 4.142250514598318 273.5166537816456 4.379508652679423 2.234463412981163 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_3 4.142120645145716 517.5023775593637 6.556145295497369 2.711320042979592 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_3 4.142251814591006 531.1716082011909 7.045545268343576 2.648733427309521 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_3 4.142379670161955 622.6739291065361 8.893171937754994 2.449916937291858 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_3 4.142139635715761 129.7074999243426 1.792317683979214 2.475901006682438 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_3 4.143401359038674 1108.197346956409 13.70585065199277 2.754168064444438 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_3 4.14658683937499 172.1861353103524 1.956932246322844 2.981037646596173 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_3 4.147959726446719 346.4131678466729 3.839711001833375 3.059547427671657 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_3 4.146588029527955 124.5879613007893 1.714953090412745 2.468715731448446 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_3 4.146682208366316 234.5701936930759 2.379966384938601 3.245579532311741 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_3 4.147219488166698 215.9480798761356 2.465378696083921 2.917475908702605 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_3 4.151522709913643 673.5638684467574 5.045218699452685 4.348767404614438 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_3 4.147509912344481 422.8128766546411 4.466561047670547 3.231511353761226 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_4 4.146741719306593 529.250333820073 4.900704805670545 3.49437212436072 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_4 4.146513104027549 608.9101291837652 5.89737157940439 3.371325085493754 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_4 4.146583391197505 662.9437395484038 6.484402708964014 3.385837286063782 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_4 4.146768265502483 886.0121739842602 8.983434802499213 3.235606819756172 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_4 4.146439095905465 22.2873809773934 0.5382932667620001 1.536386633894071 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_4 4.147838036630735 1252.377737334221 13.29000290882682 3.166918272723234 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_4 4.150663802853029 199.327798416961 2.314903339590036 3.075506353597199 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_4 4.151874404573571 459.1295715314913 4.855589499538771 3.354477770401973 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_4 4.150544287676061 268.3143773708946 2.843610694042126 3.293209052736358 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_4 4.150833373421786 211.4966668046472 2.352668722583819 3.286276274590146 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_4 4.151171055760948 335.3632367229137 3.451628729867848 3.419857897584571 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_4 4.155755687235438 505.921449394311 3.98819762319738 4.197048050363382 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_4 4.151584056313488 681.2334521713677 6.193429911284555 3.831297591374564 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_5 4.150814597492172 336.3653018017014 4.707373447348941 2.711173658858345 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_5 4.150634508180441 576.6539214396018 6.589574608841447 3.099963338995629 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_5 4.150743765916006 685.512288154173 7.459262841701911 3.231339938606029 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_5 4.150925869936009 931.6217464698663 10.32182071286689 3.173693204946215 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_5 4.150439206548606 528.1935649242572 2.748483392406872 6.890116776030401 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_5 4.151943705514284 1193.537847971156 14.39181094717953 2.991219932320905 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_5 4.154665778958752 175.6399781895718 2.007575788516796 2.998038221834411 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_5 4.155919474693908 340.7794347307604 3.525021367985893 3.340573689770147 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_5 4.15461171687031 159.4189570273903 1.99258389047014 2.784242948885947 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_5 4.154811757226655 173.1521739713904 1.947899561701188 3.034865913294781 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_5 4.155402510058573 283.7800104649407 2.793597911556617 3.451955221275233 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_5 4.159947598257835 358.7105542429165 3.662279746364403 3.303727761720713 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_5 4.155698489191992 449.0439236072718 4.328902936934552 3.524992734711875 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_6 4.154577861652952 288.0642178549105 3.99878797412524 2.595577389138398 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_6 4.15452989771928 428.3039909523301 5.125323679001585 2.932116296400824 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_6 4.154662262488602 480.4685989629302 5.574359439715726 2.978547453068575 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_6 4.154768940476571 575.2966474464677 7.418727441700484 2.741319987497864 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_6 4.158780174884467 75.36707371929182 1.086924257814923 2.304069021125721 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_6 4.155705578780942 1011.662563193567 11.40947865372894 3.057975778993994 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_6 4.158947980505272 117.452341159 1.728605089846482 2.370810553989501 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_6 4.160242694211671 153.3003029499236 2.480824973860835 2.178054569240965 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_6 4.158928734659471 87.94357043928098 1.619168314354061 1.980370065992363 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_6 4.159097705957898 104.1514562027597 1.563181399740553 2.324565221629932 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_6 4.159633495823561 233.0172611629532 2.67045561913404 2.934746987547982 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_6 4.164403356950173 81.95389173736746 1.134739754367835 2.460040468860657 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_6 4.159982911071725 338.1972458452729 4.123611445676924 2.824339462217702 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_7 4.158825967958179 326.7093050503381 4.184498978303335 2.659699471907015 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_7 4.158742790197308 376.3556844719421 4.990683282547888 2.603152193705032 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_7 4.158931591247316 396.7453269149093 5.295663520052587 2.614101213675398 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_7 4.159047691871429 558.3536824012258 7.826963870702763 2.483219250991965 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_7 4.16003569923064 823.3635144589996 10.89438271577618 2.603144594710537 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_7 4.163427736787764 27.47664079218895 0.6357320597141567 1.590057938829565 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_7 4.164656689286906 37.42500496307645 0.9165062253632583 1.464040332573587 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_7 4.163319322580997 16.2441840629305 0.3912152381532654 1.476302740498927 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_7 4.163527762179124 16.56879483042155 0.44321629621376 1.407956020033698 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_7 4.164071180380995 36.91295582589721 0.7017541358381109 1.863388740500727 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_7 4.168814670966664 29.68856011057088 0.5962741326352486 1.785129633402081 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_7 4.16435084300647 63.48796302168515 1.215330670136603 1.836027238750811 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_8 4.163493573213559 65.92900674991556 1.484279893307067 1.61076707225863 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_8 4.163293319445384 95.0471469457144 1.952820831938036 1.787552375757535 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_8 4.163372969256317 78.7767258650315 1.749862226044173 1.665708616056084 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_8 4.163504021759339 115.3644000505729 2.784354211546309 1.562563077593374 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_8 4.164496424174193 194.0378065601102 3.96992691350148 1.777170826209959 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_8 4.168505691207216 13.80890409974594 0.3780356174845506 1.371682396370433 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_8 4.168871857800043 25.05944807217726 0.592646431240283 1.524985693935129 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_9 4.167941296558316 51.50434496460414 1.040108696194507 1.796894455806732 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_9 4.167585825885368 47.67491233378966 1.017821618959875 1.734785326067662 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A P-Cho B_9 4.16775932908252 47.92939410534903 1.006185607543129 1.702473152912251 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A P-Cho B_9 4.167938368061569 60.74611914993255 1.548688068129146 1.47765411301388 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A P-Cho B_9 4.168961283475253 86.97488497486339 2.008009570042946 1.572117577471359 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Phe-2,6_1 7.30354117760924 92.9545282604387 0.7902651104566595 4.04723519981353 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_1 7.302894196699646 110.1948344620376 0.9161727983920513 4.196766484915901 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Phe-2,6_1 7.302836104503892 131.4774433291888 1.104704740639203 4.261096163366043 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Phe-2,6_1 7.302976828141117 176.2590510668988 1.586109166993051 3.877477745698309 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_1 7.304376215538259 59.40857913743525 0.5500572513408414 3.782105423843434 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Phe-2,6_1 7.302830239006577 266.6393382185697 2.410178952985595 3.932355299505953 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Phe-2,6_1 7.304840797435536 446.9080160688458 3.995047497043523 4.010724134513633 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_1 7.303966621698383 56.39077993380752 0.39620223172116 5.674022921274537 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_1 7.303725982517427 282.9169857088548 2.480004044545986 4.082903737417986 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_1 7.30291001486136 139.1066985341223 1.293292949814546 3.894061073639181 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Phe-2,6_1 7.304229099804217 118.4383724630506 1.025388476394146 4.394061333835768 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Phe-2,6_1 7.305294454171416 210.4743643261392 1.858178184517171 4.057565394182183 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_1 7.304842407321367 228.0989596397959 1.997671978715364 4.332353911481664 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Phe-2,6_1 7.304288855452107 233.9944670151146 1.958481923909003 4.286224321143839 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Phe-2,6_2 7.31602994019164 54.24630689801673 0.8004487499643205 2.863189025528819 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_2 7.31514917443409 65.71196210359258 0.9288280050041826 2.909265747972673 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Phe-2,6_2 7.315338034368938 69.15455912607793 1.042547049479038 2.894476980209313 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Phe-2,6_2 7.315336391246112 104.7171080220513 1.627176588754672 2.790172051018594 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_2 7.316480850826908 48.69134521107125 0.6609599322099373 2.76299741585577 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Phe-2,6_2 7.315245921069033 178.7509757207654 2.366366889060364 3.182958846262926 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Phe-2,6_2 7.317632600001365 331.7358635341422 4.529996244535742 3.379694237047405 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_2 7.316379098818956 31.08033129269633 0.3989498155467697 2.872228171389532 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_2 7.316378777441539 205.7444517783447 2.744177341940842 3.220015726808787 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_2 7.315650747585546 86.06708619208574 1.359496678598502 3.017509779836138 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Phe-2,6_2 7.316605977678886 71.27122306632548 1.042069933686248 2.957648986929702 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Phe-2,6_2 7.318096409810215 204.3159187480551 2.131397735420813 3.894254202651009 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Phe-2,6_2 7.317697325146573 223.8744529045779 2.288958361213833 4.032426665291132 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Phe-2,6_2 7.316999646633596 176.8778913352501 2.20530810455378 3.25702646133208 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_1 7.397856428599387 62.11614659311795 0.7617040684615325 2.771184755881492 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_1 7.396810176705647 72.43883727955871 0.8649933472162455 2.87770850292415 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_1 7.396785291763241 81.88670019217616 1.028011760195219 2.800410452074894 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_1 7.397125368628354 103.1055340656069 1.331893410158409 2.779946569899196 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_1 7.39860977584229 44.26892289016436 0.6055932354560769 2.484077780867032 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_1 7.396695322185588 184.8329260824678 2.157453446140081 3.030653771030759 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_1 7.399119380876493 279.6254503500034 3.740438628838199 2.665166890771922 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_1 7.398469781859409 31.86340969066237 0.3558750284934117 3.124105519263153 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_1 7.397678343939167 200.7037307968845 2.310095605653792 3.058046055885376 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_1 7.397000639869212 103.6330874511456 1.299837739800114 2.842609249787334 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_1 7.398490364353254 62.52414631916366 0.8887154866608433 2.522105296822068 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_1 7.399429192231432 147.8742581262149 1.745827448482056 2.998985343023675 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_1 7.39907302319299 198.8976493506597 2.037122659515933 3.4910160095266 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_1 7.398463655690543 179.8907777454863 1.878452083285129 3.341486720779457 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_2 7.410284448106965 72.78975266613632 0.940978049912696 2.628681697108086 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_2 7.409299863833961 77.18271512547307 1.070825794807168 2.73473361161731 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_2 7.409301375957125 97.42754356349256 1.188128121588177 2.97560460511144 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_2 7.409598761515091 137.8135071946368 1.818617647715836 2.747385974056399 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_2 7.41107204299078 51.77138082184543 0.7184351650635193 2.611247869735442 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_2 7.409085693048556 219.4183621317524 2.649135677961423 3.053657565065609 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_2 7.411537859880152 383.5413191942034 4.663302294392169 2.938292328168463 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_2 7.411440347055341 25.94216952106101 0.4139105215748555 2.301972487878113 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_2 7.410057093917199 272.993200732286 2.987488085358604 3.298281540518297 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_2 7.40940427520319 126.9426352412993 1.618419228761095 2.889561310630812 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_2 7.410850527289941 100.2220862067043 1.186845831716101 3.214839626499556 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_2 7.411930048921512 198.8455054163625 2.160865304225827 3.28411353657417 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_2 7.41142816884175 245.1803461578283 2.47163477275354 3.577083654544385 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_2 7.410829861055642 229.6804599904517 2.395080534719431 3.461093104479924 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_3 7.422231544207571 32.77787647826489 0.3676169754825459 2.8796371627963 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_3 7.421615877657991 30.12581093861986 0.3778724192717231 2.82867678649693 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_3 7.421536371553177 45.87154698335334 0.4403010254782124 3.602683132520377 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_3 7.421615877657991 56.46899756072722 0.5805669964044575 3.373496470641939 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_3 7.42382 25.336107 0.271232 3.352945 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_3 7.421185831223391 82.10079935846957 0.8705054846822476 3.381446087781682 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_3 7.423796187896065 131.7518212284441 1.547018731587985 2.986978142392201 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_3 7.42346 19.444762 0.294989 2.3 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_3 7.422576847676812 89.15848305813536 0.9627648704096657 3.414239655714863 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_3 7.421615877657991 56.7083286850642 0.5624501071075738 3.517983558978226 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_3 7.423541828158508 42.21823245975903 0.4241198827931421 3.71413756296388 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Phe-3,5_3 7.424572191051057 73.61612880186502 0.7704180403110205 3.631043972081503 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Phe-3,5_3 7.423577812980051 107.299430789099 0.8990172951375106 4.375482786587889 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Phe-3,5_3 7.423239929694755 99.67663774544482 0.8020071909651483 4.430832728366346 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_1 3.275866164421173 235.7116281078365 4.634615314857356 1.762085470616906 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_1 3.275683399428415 251.6847335305658 4.897778715831759 1.863501537806091 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_1 3.275912150591228 422.4581183950227 6.610581861747734 2.220965248700209 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_1 3.276069429609914 444.856219173845 7.878216867395717 1.970256170008181 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_1 3.275409251939277 282.8752452361597 3.8500884288782 2.40479656033615 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_1 3.277424293524807 558.7086501927371 10.05974975715011 1.975453527625234 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_1 3.27577267476319 217.599058006901 3.048792335264528 2.490348510300436 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_1 3.288038232012789 19.63637971729505 0.3657016562477272 1.873550725106754 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_1 3.275534771490014 161.6063962163547 2.067917643440508 2.638002987448841 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_1 3.277351666680729 1316.389685032772 16.31410821405845 2.742005883083539 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_1 3.275825750096565 611.5555220974347 9.508890393934836 2.225842858906894 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_1 3.275914737830796 344.1168801575678 6.143095110981127 1.970651898984951 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_1 3.275629330756875 1486.176115240956 8.31176925978381 5.501795389172782 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_1 3.273053502916764 1633.58923974095 4.527685941355583 14.09765421386646 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_1 3.271099157338085 274.5905425219137 1.393859792972089 7.407454348161646 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_2 3.288562214149645 137.7833784191907 2.272688450189859 2.14444392730231 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_2 3.288439237732171 183.5675234323137 2.738436644246697 2.355284160938552 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_2 3.288659713914266 349.207410429621 4.850192682106769 2.526534778326266 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_2 3.288712630192881 581.1191292169976 8.576218301023147 2.366893896454536 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_2 3.288148989816847 261.598939819082 3.978186328403545 2.307826496359165 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_2 3.289752611810453 755.915769830669 10.6736268030778 2.502757036055252 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_2 3.287817112520263 256.2005997392779 2.785076858674082 3.209770037766116 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_2 3.295384197538998 20.32147685290384 0.3898080137655932 1.843066763182577 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_2 3.288274330937204 153.4205334566948 2.055098943676263 2.60179328257647 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_2 3.289691786044052 914.998350199273 12.722312552655 2.532170279270744 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_2 3.288612571943327 693.0965527923399 9.627819173949709 2.49966575590089 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_2 3.288440440258156 354.8543853030794 5.134476933892848 2.436584001738916 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_2 3.288212602621088 602.167465147581 7.955221212122028 2.674456431437405 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_2 3.288844521004588 775.9651588558244 8.76687726608449 3.08836240088159 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_2 3.276715784542506 467.9810427655884 5.441167507420266 3.035951923642553 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_3 3.295958162868147 192.3768581998905 3.057627961124143 2.23351201376884 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_3 3.29578587269187 214.5904683460724 3.485459033513965 2.269875366480773 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_3 3.295990209312207 367.5656188178895 5.614993679106949 2.33848629175286 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_3 3.296061696120984 658.5606617067791 10.27446057088482 2.266512841477312 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_3 3.295530445412822 275.8090103656887 4.614708482776525 2.128589323310431 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_3 3.297104931955115 762.3443747322765 11.81106893721618 2.314134460000442 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_3 3.29560414539865 164.3078253438279 2.437123042989976 2.352403154679997 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_3 3.311946214327999 37.53743869942524 0.5881395972401797 2.210308905734423 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_3 3.295741391520674 147.6832279684602 2.305455749007801 2.291131876086595 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_3 3.297024275929254 957.4299891078473 14.39239593261733 2.352203056323637 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_3 3.29595124268024 688.5393087912502 10.81117713874864 2.254389336235893 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_3 3.295882581580874 387.5796035506353 5.849823986795304 2.318365281792744 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_3 3.295556388996588 505.6205724311019 7.288899780970005 2.425606294217514 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_3 3.296378744443844 706.1504735402125 8.996463678069322 2.762402034426283 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_3 3.289068564578536 781.3882361435025 10.32284149206273 2.705853316081204 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_4 3.312306181808071 195.8331429758834 3.277119877321782 2.165967912193466 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_4 3.31220205722484 263.9930184847681 3.901492141816692 2.360981948777017 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_4 3.312403363945946 453.9337741987799 6.61962560113652 2.48326630323434 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_4 3.312431879826437 772.1816958528161 10.97319008429003 2.455373485205808 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_4 3.311988216872946 304.8496914511524 4.777357088188107 2.282647965097609 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_4 3.313451235110576 1002.40909925162 13.8442076190478 2.593862218119842 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_4 3.312022422393443 191.1941075338387 2.940964803387615 2.34473524303063 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_4 3.319304941259513 35.47094441564257 0.5067736014095349 2.400257763930813 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_4 3.312135382635844 160.9194941944605 2.503666256945109 2.371159906621916 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_4 3.313440646898618 1044.106659278778 14.94692312780798 2.508978652054644 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_4 3.312383279803562 676.0187603789951 10.41101522860265 2.297998533655799 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_4 3.31221504217414 444.946032630892 6.345545248297613 2.528562673502848 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_4 3.311938482435141 656.6835016321314 9.05128085998099 2.548473151905112 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_4 3.312637172264597 875.0330756193182 11.23909643337046 2.824955306258238 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_4 3.296540099112875 798.6255133761823 11.27010835559559 2.497894919149338 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_5 3.319887781066195 196.5570413593185 2.855458406248137 2.460530918980252 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_5 3.319562676674454 227.3953834187541 3.316792231664992 2.414028460854653 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_5 3.319707869484825 506.7960904144449 6.032133216354409 3.024878051364984 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_5 3.319979879258942 627.0269646707707 9.666100398854448 2.31701900415346 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_5 3.319379555664847 280.2347848089484 3.960364381817543 2.491946261374242 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_5 3.320714879989996 1225.317790477914 13.41120340834304 3.245366288993857 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_5 3.31938676075353 156.7446122217396 2.307281203867384 2.400594182904251 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_5 3.319585581746235 132.5723913481266 1.813526274761229 2.664534571740885 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_5 3.320969551988504 1014.650019446261 12.72506637167549 2.858793629400314 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_5 3.319798121475282 723.2628488055943 9.927558883661398 2.533767091067361 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_5 3.319644231665073 397.8313290871561 5.164320386270251 2.711537245472088 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_5 3.319392546993901 682.4658378511344 7.799081586281025 2.924649628241708 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_5 3.32014828032502 896.7250552549235 9.633477401201475 3.192584203109077 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_5 3.312811557635709 1048.998703596129 13.71404747414947 2.742432182716034 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_6 3.331546370581532 181.9175996493204 2.9518226062064 2.162936133931089 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_6 3.330999218912543 206.0299906287413 3.33117909023153 2.158059539433471 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_6 3.33070755994239 335.3656831718745 4.661353353592305 2.654672091213818 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_6 3.331537700346133 443.2049518104891 7.316039059952609 2.1240107227786 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_6 3.330566349889894 46.37684225007011 0.9002149590412878 1.950515870985369 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_6 3.331544969399699 839.9638358223401 9.92729285452997 2.952301558819843 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_6 3.330801512240418 53.86996832189745 0.932123772868718 2.065511017066123 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_6 3.33136263171217 71.25999021338913 0.9335023430630826 2.597864191954967 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_6 3.333216959517094 256.1228364611195 3.627912427464294 3.135440217731623 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_6 3.331105742075756 210.0842584293435 3.625237273597105 2.077703968141537 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_6 3.330909683541243 150.2830203685399 2.462622226931133 2.259698360250422 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_6 3.330912142863753 217.0089426796135 3.374384851423498 2.243954154033105 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Pro-5 A_6 3.33138285150372 285.4067317952196 4.243298950878294 2.373789177640703 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_6 3.320315740326789 966.8389613684186 11.48931538926594 2.936235960887625 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_7 3.340016676879397 841.0910509243889 3.451355524513946 10.93361894354494 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_7 3.334964536875723 41.32288815166911 0.9793415778920834 1.506040467549538 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Pro-5 A_7 3.331506889603536 277.8619302871944 4.369719667254737 2.27982790902761 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Pro-5 A_8 3.337011791237764 50.16661558793149 1.164120733924848 1.52705371150611 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_1 3.948928388550887 785.6820805010661 14.97533809461025 1.841693519979815 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_1 3.948580031762611 1003.918294079378 18.64459174863255 1.909290731646077 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_1 3.94865360231647 1249.487662580495 20.96322988041157 2.086878402268719 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_1 3.949038299520008 1624.562122351234 29.74409410547717 1.930083389389895 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_1 3.948828772160985 462.6947430158966 8.696057788469433 1.900814639895062 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_1 3.949759606176447 2160.967673782531 40.51645532695446 1.912244502143385 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_1 3.94973672899264 550.6703305458127 7.702154546557628 2.494654526339319 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_1 3.949389411307173 79.83252537614914 1.315512507945446 2.174351910984667 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_1 3.948888571263044 315.2031543716083 6.061724540992684 1.865853936834254 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_1 3.946713984320519 92.31528342437608 2.505863704644339 1.285426127239929 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_1 3.948810491408143 794.4142120588704 16.21839682306972 1.725139633259012 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_1 3.949133618828871 611.6964887100686 10.44949973295422 2.042544136246332 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_1 3.949905231458922 890.3016160303123 17.01395194407639 1.859405623093471 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_1 3.950463336229549 1500.940813619168 18.26741423497775 2.81134397666709 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_1 3.950155531324299 1839.717470313761 30.33007642752594 2.112098437550748 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_2 3.952497110025708 146.2895847011948 2.425717106466238 2.049370623064511 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_2 3.952451824708813 148.2408616035954 2.699475435467356 1.917870391035553 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_2 3.956869634369128 1365.415823598085 20.0655980056212 2.347471763823742 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_2 3.954697950950744 412.9385165346159 7.507572284243124 1.919184963347987 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_2 3.953462988296117 175.2985062613757 2.370618315107225 2.863170323122644 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_2 3.954027428977348 541.9723421111769 8.106276737417918 3.160514389354911 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_2 3.957547141274795 993.6679417176076 11.94539970713888 2.753279243323313 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_2 3.957433207466747 169.2300052380783 1.504267026197093 3.643924075520613 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_2 3.952814870544328 151.9751849996715 1.424385883684711 3.727832159178159 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_2 3.950113087597017 924.9547299640961 17.84377180727456 1.808692669047089 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_2 3.952464074498219 39.24639164794254 1.438422752479483 1.067963559671868 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_2 3.953277950982735 236.6569609758913 3.788209781788268 2.198743310239678 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_2 3.953910797655705 398.4569738138572 4.741138509997538 2.704665342929373 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_2 3.958444931042568 2321.371404084908 25.18689325685349 3.149574478224165 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_2 3.958217580831465 2764.95792777416 31.05063702187227 3.075108191081791 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_3 3.954902243156705 184.3285587666085 3.777138118498848 1.658353118760832 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_3 3.956708788756676 1197.03675319886 16.84132069429965 2.465519266408092 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_3 3.959871953186548 1938.242091557922 27.93957472889081 2.422747926871899 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_3 3.957258299593783 1300.877422589894 23.45935702112445 1.924928217258754 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_3 3.957210485864182 522.9088352896176 8.150852791160036 2.172981084649087 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_3 3.958154747281071 2524.110283682257 36.86141919188491 2.305316515172541 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_3 3.960698896687198 701.637164310475 9.96170966694576 2.363444102034384 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_3 3.960598587109264 50.46695245048358 0.9883586061061573 1.730141374444006 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_3 3.957165676112961 482.9460204345101 6.146853905963486 2.658452978392711 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_3 3.953494239964176 858.1920280759559 9.665361814381601 3.017266078457467 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_3 3.956968947319488 977.1568154701237 13.09195968046949 2.391489116414462 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_3 3.95760501656327 744.3054417185607 11.32066416521051 2.211593522692986 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_3 3.95812203846037 1372.716037708325 18.56065369170251 2.524517524747471 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_3 3.961367780689181 1541.581475525639 20.68984727799437 2.56205612070111 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_3 3.961268780378896 2832.145716648432 38.00550316390358 2.537317926661451 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_4 3.957221206632564 695.2057813374115 12.76074791662302 1.887242807141378 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_4 3.959777927328384 1604.902280181718 22.63356461745316 2.412822567468836 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_4 3.965474323782159 1655.558224053572 26.53992730234271 2.194543648478942 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_4 3.960087457560004 2500.109513940236 36.42995722925335 2.332102431757336 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_4 3.960076990274424 689.726663747316 11.25211147229949 2.121602978346224 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_4 3.961009641550442 3824.502278180805 53.32777985184827 2.44064271934548 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_4 3.966002813350856 660.1529404252956 10.75980744008338 2.26199494274101 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_4 3.965940928416839 75.53817075849967 1.269662524656907 2.147872587090287 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_4 3.960207968820268 533.4919174066495 7.816951203765595 2.287918249224172 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_4 3.95852027726671 1455.166238277855 21.91890934882448 2.280471046302336 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_4 3.959937851237739 1117.743597028482 16.77383016932122 2.264421133832807 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_4 3.960387652004526 755.437367562679 12.14919853427828 2.15634662391873 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_4 3.961050070350122 1728.308478967031 24.71153385720347 2.376669581914902 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_4 3.96676073821724 2265.995349274828 26.51238652076507 2.973005581686765 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_4 3.966813490938434 2427.260210633248 37.38156786002352 2.326020901433028 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_5 3.960046321389653 1191.757901972249 18.3984487810411 2.201172520787865 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_5 3.965314854714924 1077.300669777473 19.31270548555934 1.999955838598337 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_5 3.968437231909206 1208.136358286037 18.86243184079797 2.234854390201511 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_5 3.965712629588028 2146.812025852393 35.06244938671735 2.134640254650579 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_5 3.965615596082174 615.7296845201455 10.64498145762021 2.080738833967968 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_5 3.966630429237934 3115.207413904042 51.49128652554 2.134755949347077 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_5 3.969655362704938 1139.435110772328 12.86322449791459 2.994510133678053 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_5 3.969337622944614 197.7365939979478 1.808822164667941 3.604238330827438 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_5 3.965713947831395 370.8112068650809 7.000173313940025 2.010427485569184 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_5 3.961382384660042 1708.924922247609 26.26455755389232 2.244235056540876 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_5 3.965453516989928 942.9008218373319 16.61678066922094 2.034443909187267 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_5 3.965788955056454 678.7417381392897 11.2950840914012 2.242370183064581 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_5 3.966701695154898 1369.14297596649 20.25170038917454 2.297389117095752 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_5 3.970570569105472 2213.440749255664 24.38219887125651 3.25477990204176 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_5 3.970376088704161 3163.706604485893 36.37612283198806 3.078296228107737 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_6 3.965579251494123 1107.77694483201 18.33025375336572 2.122879797158242 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_6 3.968561691174885 1730.237243044926 19.72262487198389 2.984322347571647 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_6 3.970449049342688 405.6467287532111 6.816444856956638 2.037770268715206 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_6 3.968728251968543 1523.959494670921 24.7485509611476 2.12981275113998 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_6 3.968717693382003 527.0998403135131 8.706052538828725 2.10970040433397 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_6 3.969600401900399 2216.328343116784 36.06659857014327 2.130927385269004 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_6 3.977506880514909 566.2886183962914 9.170567750264647 2.242054006917469 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_6 3.977261838618455 53.72375701409057 1.127267568786025 1.675422917128694 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_6 3.96891073362247 747.6065924446128 8.053529212767971 3.026043854598091 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_6 3.966959638308943 1707.703206405232 28.46061575333727 2.128614604372972 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_6 3.968565788926563 896.3224156729108 13.80560748517611 2.231687572428992 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_6 3.96932015255248 1187.441523522782 13.26462918055013 3.086973351222239 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_6 3.969963334374425 2473.259503098317 25.13118470555822 3.028198642613622 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_6 3.977951395894054 1323.084154331458 20.11748827230543 2.388145565636307 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_6 3.977844220558707 1769.289634878578 28.99922119506065 2.187374296468592 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_7 3.968655019989818 762.3919458649981 13.21589726263684 2.012855539540131 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_7 3.976549038070259 726.338286589764 15.83584114654029 1.737328428005186 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_7 3.976663376468439 989.2560126801969 19.16533897160627 1.874380519210241 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_7 3.970808386950706 433.0596320231858 8.440112959640112 1.790318934558885 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_7 3.970649697532092 141.5009940803148 2.767040598144146 1.755992798479547 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_7 3.97174222169149 768.116317452094 14.8148460168852 1.862750660357759 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_7 3.981902097535611 10.15374927811857 0.4298915063262007 0.8667013748711904 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_7 3.976929790909839 291.0168206231036 5.829844441802957 1.840401980111119 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_7 3.969955056847958 1322.256785929191 19.9158296253422 2.279196209313247 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_7 3.970528189313885 213.8512215134672 4.507701362116583 1.667191164651135 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_7 3.976908377576128 491.3842662867328 9.666681401446287 1.916119746702832 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_7 3.977716476380916 1298.640410200795 17.25036935187312 2.50376286046443 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_8 3.970738666888886 208.7425443667646 4.109901972932739 1.745819733397436 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_8 3.976884271212326 1232.95390589467 24.78691642855704 1.773681269931695 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_8 3.973101594591669 15.71918634998665 0.5774280031759625 1.032897012197868 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_8 3.977798579402724 1951.595780244821 37.69766541533411 1.852901668084608 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Ser-2_8 3.972085286528841 596.1328170208218 9.482771065802577 2.169324307749706 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_8 3.976646053233465 549.5828128229701 12.19543172141726 1.65745797886828 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_8 3.982107597273549 56.11644091548891 1.703878612341607 1.193435783993051 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_9 3.976818489163457 651.9157468694063 12.81045883479673 1.795472113841004 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Ser-2_9 3.9767718774795 390.9159696606104 7.767281644177872 1.825763909468971 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Ser-2_9 3.97808480087406 1015.799053979573 19.90258844544735 1.829889374220977 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Succinate-2,3_1 2.393700322541475 542.9370583001169 10.6983554095405 1.699074931529083 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Succinate-2,3_1 2.393519532274988 567.7077026008398 10.37028651303539 1.91013909217337 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Succinate-2,3_1 2.393674779463565 595.1425008794336 10.78905516977541 1.918310406565094 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Succinate-2,3_1 2.393748987038776 1022.396249481237 21.20148847436997 1.691567838087307 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Succinate-2,3_1 2.393519191061386 429.4470436251154 9.201279032188518 1.632002291035557 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Succinate-2,3_1 2.394726856352157 1313.770322505564 22.42575096174994 1.973119275324097 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Succinate-2,3_1 2.393867873874062 621.7654858062486 10.73488709458925 1.991911966866619 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Succinate-2,3_1 2.393734890862525 101.8672230801639 2.212905143015534 1.589457194011078 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Succinate-2,3_1 2.393707178411819 237.4605735921463 4.786124926444318 1.789316171759278 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Succinate-2,3_1 2.394873562784354 1873.091756328603 37.10098444325377 1.723397427888644 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Succinate-2,3_1 2.393653683260306 1103.080621623027 22.98515087651835 1.64426606277008 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Succinate-2,3_1 2.393842309368783 558.9358885778535 10.41735331269873 1.808692669047089 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Succinate-2,3_1 2.393952410004944 1132.972767066768 20.80412975483662 1.863501537806092 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Succinate-2,3_1 2.394524887226064 825.8128293481489 12.37084607999957 2.301972487878113 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Succinate-2,3_1 2.394556459342633 1064.37994503515 17.85122246479783 2.026170421462645 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_1 3.226934574791853 11386.17054489911 203.8999904589173 2.001672082372157 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_1 3.225472523979053 15492.67631908797 261.5245236838339 2.094736946406764 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_1 3.224011728269377 27608.03388258128 416.3774039400046 2.667445105813294 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_1 3.2271668081349 22276.33708061054 397.4352546078011 2.027928144083099 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_1 3.222102125763877 8508.401452549471 141.197215647138 2.200231312482898 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_1 3.226214381891467 38164.4336853451 591.8051527585457 2.26879258932312 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_1 3.22729074908592 3812.701055580411 66.2558450061282 2.03007142245496 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_1 3.225342512369994 670.1860048829703 11.39133068892718 2.313061328950796 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_1 3.222619606684567 2674.52434960577 47.49512409274555 2.091130101510147 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_1 3.242629800393052 13172.4695828651 229.6049158096559 2.036139030906044 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_1 3.22620467163693 13325.42918783666 229.328555826679 2.074067589201878 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_1 3.23259481009303 9392.39692646477 162.3187570730695 2.074599758824814 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_1 3.23097919121018 6685.755510356694 116.3651203370146 2.085548892183057 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_1 3.227617560334328 8421.390815668366 130.9928531911987 2.288829886837107 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_1 3.225376211471958 6602.529572536152 117.4806651968558 2.000033974303584 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_2 3.238017274604468 6876.81553633946 129.139780905164 1.909210980860784 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_2 3.236571783959243 8323.4428317546 163.0829191296202 1.910916596074336 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_2 3.235650933376305 10443.55648768967 203.661570000099 1.890561891631693 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_2 3.23827640194081 13306.24276040107 257.2654864810009 1.893570138951176 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_2 3.232775003728293 7186.39156599536 132.5924482878893 1.979689224468168 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_2 3.237380209361921 19099.92810709755 360.0835409651535 1.94896523012208 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_2 3.238279106016437 8733.64140630059 150.7886536402702 2.065491491980369 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_2 3.236716279382269 1151.881799944032 22.95332659746287 1.81935649773568 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_2 3.230768360309581 5254.523125543958 99.13438741184122 1.9596652760291 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_2 3.260411682353302 8211.975470044514 127.7916800730831 2.340626581309658 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_2 3.23729357898483 8029.003462172102 149.0120578819107 1.935806045061298 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_2 3.243732179332465 5606.845241903904 104.0559789928491 1.943854109688701 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_2 3.241987132897683 15583.46453109091 256.0782463486734 2.162376272769278 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_2 3.238625006703279 20554.20021026531 305.6735070878854 2.410091570444466 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_2 3.236535603214063 22240.48586429936 351.9759893088018 2.26546744718194 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_3 3.238017274604468 6876.81553633946 129.139780905164 1.909210980860784 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_3 3.236571783959243 8323.4428317546 163.0829191296202 1.910916596074336 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_3 3.235650933376305 10443.55648768967 203.661570000099 1.890561891631693 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_3 3.23827640194081 13306.24276040107 257.2654864810009 1.893570138951176 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_3 3.2438894420574 4508.348189330744 87.550384254167 1.846230781274127 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_3 3.237380209361921 19099.92810709755 360.0835409651535 1.94896523012208 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_3 3.24938222128992 4877.934301064908 92.92540314616481 1.897840285394052 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_3 3.247820743237913 666.5583859666199 14.39635272059336 1.695761962641902 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_3 3.241859101036856 3118.625191804213 62.48830572677972 1.825591605327577 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_3 3.260411682353302 8211.975470044514 127.7916800730831 2.340626581309658 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_3 3.259251971484943 4239.976572489627 65.29279886280074 2.328224018301072 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_3 3.243732179332465 5606.845241903904 104.0559789928491 1.943854109688701 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-1 (SCH2)_3 3.253076016168584 8586.435070015783 157.1776817572162 1.966729348111295 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-1 (SCH2)_3 3.249717649906682 11186.40774590365 185.7739541593986 2.173574329641011 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-1 (SCH2)_3 3.247617060954064 12958.81259648582 217.412098518879 2.15049439973365 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_1 3.359659468223777 6569.025400860861 125.3758441545279 1.918310406565094 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_1 3.356935183527625 8327.526316313319 162.801166864969 1.855559148089235 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_1 3.354891873983906 10832.81933250023 205.0482326590622 1.921584875520495 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_1 3.359518765986524 12918.51564244276 255.1056213340245 1.857650863758969 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_1 3.370963176401249 4184.997386771936 83.08974235779985 1.824643497682878 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_1 3.356519982536353 19947.53417807613 344.4199525793688 2.097658278311048 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_1 3.381018241249426 4879.771968767102 94.13816121097626 1.808692669047089 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_1 3.378650566484398 711.4478877830493 15.08024028393028 1.699074931529083 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_1 3.367230836695264 3047.353669507546 57.11894967608489 1.973833760133203 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_1 3.366408557813468 12665.79942372559 226.7367664625635 2.047192515270363 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_1 3.357956734434023 7989.334641791243 141.6197590636351 2.020936171142313 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_1 3.370196475230049 5374.825016015278 96.0175597811954 2.027928144083099 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_1 3.387650393598652 8914.76958813752 161.1478379273273 1.973119275324097 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_1 3.38046076300286 11738.44507668517 190.4425641155616 2.192354750360107 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_1 3.376293233125674 12823.0732144061 220.7506403759379 2.082737012842102 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_2 3.37073998718412 11135.2179038109 199.3478228173811 2.076330817283912 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_2 3.368007553862254 14564.3110296323 261.2677994196862 2.020101654646717 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_2 3.365964557840118 18493.98921915661 325.047001503159 2.066997029782264 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_2 3.370600722335658 22352.04929974018 405.7962633020818 2.037504366994689 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_2 3.38204924267785 7208.578851821424 132.3639266319656 1.971879958125349 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_2 3.36760232598439 32587.27921288394 545.0956239637375 2.221654394044117 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_2 3.392148507463363 8784.081565677468 151.402179711638 2.06861742895086 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_2 3.389740254362291 1237.584292807168 23.57775095999891 1.854890245016768 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_2 3.378303685958217 5217.802060995986 91.85942764560075 2.131602452822859 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_2 3.377501712106583 22180.05960814152 364.2901744085951 2.245496395464348 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_2 3.36906954441276 13214.85674792764 226.3586726781232 2.120947655858914 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_2 3.381269227434533 9317.01367615439 154.162397707304 2.224474637867299 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_2 3.398745947929221 15526.49787719263 260.0747472652141 2.137545881601105 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_2 3.391563244669401 20952.61633592292 308.4277594072998 2.464867122720162 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_2 3.387415824227633 23623.24569167457 359.2757766745287 2.317775254203649 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_3 3.38177978816273 4655.327038223287 88.40742882752103 1.964489489788672 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_3 3.379050903714113 5847.351574310089 114.8966009343901 1.908023868987997 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_3 3.377010433419125 7189.605381016728 141.3253704304739 1.918310406565094 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_3 3.381634671575629 9349.754156363313 180.7219038806333 1.922255422574125 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_3 3.393085828679859 3048.985743570821 59.54579035578576 1.887799628924839 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_3 3.378646581050024 13907.12720286789 244.9860562277214 2.092895900129586 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_3 3.40313 3559.036368 68.667774 1.906435 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_3 3.400751112180858 514.8439934125802 10.65463359030096 1.78151177821454 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_3 3.389341514232611 2231.829973967769 41.25842247874701 2.042171683918728 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_3 3.388534751080487 9455.278191538386 166.1553552179925 2.096991024739026 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_3 3.380106186858052 5396.063975592484 100.5858711676771 1.986821959160147 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_3 3.392317936218068 3811.961198321243 68.57760121068063 2.089440304836716 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tau-2 (NCH2)_3 3.409758019031969 7036.61927615608 121.7116334584648 2.057417509068447 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tau-2 (NCH2)_3 3.402570209439793 8809.342119739304 140.0817963004052 2.272042951989123 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tau-2 (NCH2)_3 3.39843 9452.514361 161.846391 2.116613 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Thr_1 1.301478454623216 327.2150333534002 6.985212801305825 1.645666631081507 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Thr_1 1.300673233698447 517.5290929493609 10.32890836847621 1.778934692950745 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Thr_1 1.300267975198462 514.118111882867 10.20450585676566 1.795513115066037 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Thr_1 1.301521490012701 972.1953123994095 19.48477389861576 1.757795579565856 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Thr_1 1.304088508000987 308.9346704160239 6.870920584662808 1.616743861184495 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Thr_1 1.301488111107612 1395.561501213592 27.16442840118795 1.792583401266327 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Thr_1 1.30711529786391 559.3711964711678 10.52196150442761 2.017103539625123 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Thr_1 1.303357290459099 236.337381790995 4.503273692607815 1.849383569305416 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Thr_1 1.304132904053902 1578.450138672017 29.53816499722595 1.881859662213335 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Thr_1 1.301033677239273 921.7042066722497 18.81868183885558 1.720030823612109 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Thr_1 1.304197422542769 890.4425484078201 17.38201933700291 1.786097283849513 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Thr_1 1.308345272812413 838.0714313548706 17.89188489721117 1.650196505034906 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Thr_1 1.307316765414765 1904.605753530747 27.77680373399714 2.389962412682554 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Thr_1 1.306273642258487 1590.542013756017 25.94988666852365 2.176952837750979 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Thr_2 1.301478454623216 327.2150333534002 6.985212801305825 1.645666631081507 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Thr_2 1.300673233698447 517.5290929493609 10.32890836847621 1.778934692950745 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Thr_2 1.300267975198462 514.118111882867 10.20450585676566 1.795513115066037 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Thr_2 1.301521490012701 972.1953123994095 19.48477389861576 1.757795579565856 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Thr_2 1.315071939611898 493.493061050142 10.39691199453527 1.649909974760987 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Thr_2 1.301488111107612 1395.561501213592 27.16442840118795 1.792583401266327 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Thr_2 1.317961354845645 824.8330194625163 10.63454033714226 2.578536586505531 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Thr_2 1.314718705482457 246.9351383446616 4.69568259519036 1.88362726305638 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Thr_2 1.32087502837632 643.7396805476687 12.5605014744416 1.720817726190885 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Thr_2 1.31953834458296 296.3484450691809 6.277035685105643 1.563534409088419 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Thr_2 1.315254704604657 939.5238985678528 19.27625949280768 1.702558272840861 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Thr_2 1.319532538725377 964.7680147103534 18.69610121677654 1.802228416838177 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Thr_2 1.318268884780249 1982.982009640481 28.55888221208637 2.422749598633972 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Thr_2 1.31714429652634 1887.356658453464 28.66080779867641 2.292861043118226 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Trp-4_1 7.515092606236409 15.63332154579185 0.2642909561521429 2.331722922215484 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Trp-4_1 7.51387 46.466965 0.3 5.966671 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Trp-4_1 7.51405 44.822615 0.36 5.000134 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Trp-4_1 7.51411573232122 38.86708827723675 0.3863852142147562 3.418288848300957 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Trp-4_1 7.516615149546344 18.97127147398427 0.1942812202327165 3.437530717262337 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Trp-4_1 7.515284718128631 51.61638837020047 0.5190131249280853 3.886656563553409 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Trp-4_1 7.514996207899338 38.49884229368193 0.4079866230010333 2.96068877345125 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Trp-4_1 7.514480596317213 28.83974927146294 0.4141867596986591 2.583845257762556 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Trp-4_1 7.514281892847131 99.0747427982762 0.6172372504149607 6.470126305592373 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Trp-4_1 7.513272681381552 50.79091127635968 0.5208360292185168 3.29417498984116 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Trp-4_1 7.514023992543307 64.45190489035446 0.5210102937022789 4.820094133191591 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Trp-4_1 7.513795864655569 102.8293558458443 0.7399590161469008 4.275993979465939 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Trp-4_2 7.528320418605308 16.29370144298067 0.2575214690318561 2.550399686328822 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Trp-4_2 7.52692 47.35061 0.37 5.158528 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Trp-4_2 7.52767 49.538734 0.35 5.705304 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Trp-4_2 7.527214649580443 27.96486501974068 0.4092237513596561 2.364458169276632 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Trp-4_2 7.530203652396622 14.59183861582957 0.2209346407570718 2.662245709851758 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Trp-4_2 7.528528144953436 31.17584299423807 0.3883083290997186 3.82676009529135 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Trp-4_2 7.527275661160966 35.57474784815608 0.5146486139322233 2.411914922263675 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Trp-4_2 7.527142616102023 22.47467875297572 0.34757316244778 2.447124636641866 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Trp-4_2 7.527234502096938 96.23947559727594 0.6328945508249385 5.602388414969995 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Trp-4_2 7.525814887795888 65.15410268832821 0.4970918679324742 4.033042007974839 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Trp-4_2 7.527022798933088 72.08928738038995 0.5090159322611432 4.552314896029913 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Trp-4_2 7.526475044709901 55.20742546279373 0.6043879868209622 3.175765879076226 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-2,6_1 7.165132537607199 87.34659005131853 1.246431171980363 2.363355732540998 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_1 7.164100002861303 90.04708517937252 1.156958941151135 2.711984350858022 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-2,6_1 7.163882356231313 88.1174357623603 1.156365886488885 2.692795743807083 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-2,6_1 7.164323051284264 189.351651633567 2.4494512494759 2.602627419720326 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_1 7.167207007738196 65.97792356014354 0.9243014350016111 2.466162705383243 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-2,6_1 7.163213043858782 334.9386117453051 4.211045294324659 2.768478323045222 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-2,6_1 7.16844 353.98613 5.335462 2.339765 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_1 7.167137184661744 30.48833943916714 0.5224754956113111 2.036098602213066 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_1 7.165243583082669 280.1622000389613 3.162661481048987 3.00421308989035 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_1 7.164314484456693 126.5347614450011 1.70640279804861 2.575160076901863 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-2,6_1 7.166898840087299 149.2024563796659 1.815663967519702 2.792465065039175 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-2,6_1 7.16943226107515 138.2073732282146 1.747273307979818 2.824491760220413 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_1 7.168072352975905 212.3464207090618 2.103039979996688 3.37951009376834 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-2,6_1 7.166959726211582 229.6650559633458 2.414865995103239 3.254111362677648 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-2,6_2 7.179286621645465 101.8249866286411 1.128769706477265 2.833564439515907 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_2 7.178026406528558 82.85716276166909 1.088616380654729 2.655743665870296 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-2,6_2 7.177911558645349 83.1297003935532 1.054403667467741 2.657541336493469 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-2,6_2 7.178343303402724 188.1608891692057 2.25836576666279 2.757037748343918 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_2 7.181371294676977 76.72710617868552 0.9058320996678988 2.735606488827938 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-2,6_2 7.177194565809469 338.4808960585199 3.809121580628437 2.985279865969404 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-2,6_2 7.18258 369.325292 5.034314 2.559763 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_2 7.181203588881254 30.07887309908965 0.4350990191553523 2.195217860302928 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_2 7.179151585117031 261.1172856187184 3.035803510217436 2.933635154410238 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_2 7.178209500164377 134.1401155569578 1.649469870370362 2.706141199214021 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-2,6_2 7.180864725479125 152.4113191485243 1.707113709923984 2.880660204561175 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-2,6_2 7.183486257369723 157.7941842598834 1.664575763308906 3.139401155573946 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-2,6_2 7.182098747104097 175.9699425638476 1.91308620120728 3.209481779281642 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-2,6_2 7.181060679599295 220.3429094886573 2.321926763060455 3.31117034452111 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-3,5_1 6.866166201606481 62.207573966696 1.066727683646974 1.995366173261576 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_1 6.864801187938022 73.05411131655421 1.113889913524603 2.228689880251632 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-3,5_1 6.864365414737406 80.7280962883836 1.155872537133423 2.504040562939864 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-3,5_1 6.865096474708439 157.672901560348 2.2195190126106 2.363239994339157 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_1 6.869025922052746 51.33583212442857 0.8943996143717411 2.002718751720389 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-3,5_1 6.863569838131348 321.9067722003908 3.984551390869278 2.688645536033841 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-3,5_1 6.871028149049966 386.9979037009853 5.078349801888721 2.492024195902977 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_1 6.871687674781934 12.72400056454356 0.2518947757298518 1.854529665477011 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-3,5_1 6.868719701240031 24.89861050887441 0.4740840146148121 1.832887964752901 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_1 6.866311313023641 229.829955921007 2.99619786394083 2.640547151922376 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_1 6.865113054162749 105.9730594721298 1.620516269526584 2.242264294267104 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-3,5_1 6.868551638525071 127.7329183691355 1.676161444096308 2.50081197139285 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-3,5_1 6.872432592703939 138.3128894668808 1.530944466128801 2.881600431520638 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_1 6.87043956211986 180.197958954778 1.947427123744508 3.178680514236514 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-3,5_1 6.868961405419521 212.4024128943487 2.217253168018815 3.175521356072148 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-3,5_2 6.880279662356584 76.35459806757748 1.237161512285726 2.098232686467964 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_2 6.87882742493917 75.03906024042054 1.228613371864333 2.127679448462834 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-3,5_2 6.878325135581855 90.0200661833313 1.27644134701171 2.448940931612736 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-3,5_2 6.879100383048218 166.2762562849053 2.430996126663125 2.32253897718323 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_2 6.88319020899153 63.81752563998607 1.014110173459963 2.164473516599639 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-3,5_2 6.877631453006366 276.178232525267 4.173218735526785 2.316472310034416 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-3,5_2 6.885102988998406 320.2762255640927 5.368801139894039 2.081509249701472 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_2 6.88603721653257 17.40624320008326 0.2664049619399819 2.377650837477516 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-3,5_2 6.882643384433434 38.70068231880041 0.565265285447386 2.399262412821621 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_2 6.880201452477915 284.144489743423 3.319100269550802 2.857222612802298 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_2 6.87907845841593 138.2492522474445 1.861439977805604 2.466540032066695 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-3,5_2 6.882503583118385 140.0911268197389 1.880389920032296 2.470639288756184 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Tyr-3,5_2 6.886329287197873 151.265888389086 1.735967993907289 2.803607608912867 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Tyr-3,5_2 6.884208704794694 208.4188126339743 2.076237915858281 3.330914727929865 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Tyr-3,5_2 6.882815041203916 201.9225769825044 2.427388716225807 2.843141576618393 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-1'_1 5.984850782903233 122.8478072722545 0.9784505622870485 4.255011578850141 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A UXP-1'_1 5.983124821030354 124.3877467033418 1.17073982917902 4.625685559201668 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A UXP-1'_1 5.98475471768149 88.57510295123734 1.329470651680426 2.374412092465391 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A UXP-1'_1 5.984965320620384 292.9693964754088 2.606175239219174 3.537766792027061 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-1'_1 5.984962758622596 317.597565837908 3.833091562279662 2.744020551927894 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A UXP-1'_1 5.984935069206212 167.053316973404 0.5435536853346133 9.89531542492717 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-1'_1 5.986070733670917 67.29417571901863 0.2253036609534919 9.19045187631279 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A UXP-1'_1 5.98548663134735 174.8905663079301 2.636060324032694 2.384705031421948 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-1'_1 5.984991652080014 88.88361181602914 1.424064885175443 2.184699968259273 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A UXP-1'_1 5.999806219986199 55.33266304826424 0.6473285994728684 2.63017359584624 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-1'_2 5.99949583952263 30.83253624572563 0.603568329355097 1.6917734130582 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A UXP-1'_2 5.999226192203052 69.15242683118817 1.266239374594746 1.90718088373177 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A UXP-1'_2 5.98475471768149 88.57510295123734 1.329470651680426 2.374412092465391 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A UXP-1'_2 6.000049543021399 171.3733249885278 2.331047264615619 2.374349554099718 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A UXP-1'_2 5.984935069206212 167.053316973404 0.5435536853346133 9.89531542492717 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-1'_2 6.000137812838843 122.8971953447615 2.017231997242581 2.083061709709659 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-1'_2 5.999806219986199 55.33266304826424 0.6473285994728684 2.63017359584624 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_1 5.962761831468414 44.01004682682287 0.8620181090354978 1.845535627399593 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_1 5.962061476022733 101.1790694618452 1.181312505543668 2.945467321401007 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A UXP-5_1 5.960368415703278 72.19043766542104 0.9933199466404304 2.950576659409774 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_1 5.959355442752451 100.8788241488568 1.366478452168 2.733386761432756 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_1 5.963526519336414 39.94464676760568 0.5527160105279425 2.538922288037913 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A UXP-5_1 5.959194826038369 110.38849055439 1.748349684799559 2.300226343186987 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_1 5.964225022153085 46.28172265750325 0.7525481344142282 2.164896681515209 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_1 5.963497268769394 23.05501610489565 0.3324247771566964 2.356781356637115 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_1 5.960104839937962 136.2491637494699 2.176014988073372 2.269425242823435 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_1 5.959381141144767 92.47504124514313 1.181422035752044 2.89793987590743 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A UXP-5_1 5.96305686488521 33.8158283182808 0.4835698184943272 2.576016831673126 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_1 5.960955548724401 67.24575856709133 0.8284508579680461 2.758324744013474 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_1 5.961034003966879 88.30298408153902 0.9379941380241 3.284779467622944 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A UXP-5_1 5.960469537911086 82.81048717548921 1.235826300751833 2.532963868828412 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_2 5.972593409950941 38.46958092253367 0.9929670176634302 1.514082451400091 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_2 5.972157323289191 97.64450773770702 1.676717977462119 2.094281640178021 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A UXP-5_2 5.971933101901463 56.99524931876934 1.240133563367769 1.767969115347462 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_2 5.971941563311304 76.62371883138474 1.499500276438426 1.851521606182906 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_2 5.973148261407595 21.33864089663554 0.448536484598614 1.659968861034387 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A UXP-5_2 5.962349309402757 94.66969219195329 1.560462452649581 2.136238667263594 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_2 5.973660469130267 26.50126840876026 0.5144698553410473 1.89914574367717 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_2 5.973229377115792 12.56861174535391 0.2865053515887532 1.584654817517732 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_2 5.963476195388662 66.70476038579476 1.293142038260413 1.880604696938828 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_2 5.9624057987495 31.27846994897931 0.6953809954442521 1.609448508447105 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A UXP-5_2 5.973124793679616 30.00309674549561 0.7077170754031693 1.608537568738595 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_2 5.973858476178137 30.90106583308367 0.5597185793819902 2.034525201167213 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_2 5.973893976080081 38.34937882642845 0.628346097509253 2.129562413806965 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A UXP-5_2 5.964024305940756 44.762656727859 0.9063955754896593 1.863175637968275 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_3 5.972014021118611 123.5932086703062 2.423979145897594 1.861009395678506 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_3 5.972863491482421 141.4377885907097 2.477890034906919 1.988642701872945 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-5_3 5.971950046904768 66.01224146509817 1.408501748437665 1.72118454056228 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A UXP-5_3 5.973507690594021 70.32937974277513 1.090697640006507 2.37729994634943 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-5_4 5.975981770161194 65.7841689675245 0.9156103472954422 2.501370504337221 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A UXP-6_1 7.860429612407867 92.58994448228965 1.677653617378046 2.112855643353628 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_1 7.85979732297542 147.0214345378403 2.581747603681537 2.644797762586697 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A UXP-6_1 7.858098117431146 95.02753587557439 1.407867238705174 2.280244868098492 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A UXP-6_1 7.859748028831385 134.2588788712885 2.205029880404032 2.183007014196619 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_1 7.863358865155218 33.75026509787312 0.4709916953288229 2.435068536635559 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A UXP-6_1 7.858287456582325 148.2349192534026 2.414264692200274 2.108568448892164 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A UXP-6_1 7.861059193174062 175.7224074574727 3.317980562060571 1.884978665360441 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_1 7.862269293319636 43.98491656341532 0.5957785038456377 2.646948775715618 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_1 7.861227303906015 314.1690711545323 4.549592984892594 2.418455824225902 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_1 7.859383805886047 144.9916297705169 1.657213598537526 3.058324970705879 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A UXP-6_1 7.86162648824468 81.86246532059495 1.067060627903874 2.809366009284274 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-6_1 7.86117633386031 54.01415053420759 0.4 5.225169146271815 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_1 7.860906946258571 68.77543467243693 0.9627786113155221 2.422749598633972 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A UXP-6_1 7.860866007923438 86.88689126942629 1.241296436451012 2.331783284194337 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-6_2 7.873593704749692 86.24286886960991 1.693037693317808 1.767632035957748 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_2 7.872919692992382 176.7197057137374 2.873091802474824 2.220429116750954 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A UXP-6_2 7.87173776127671 91.11686761236982 1.383983776134237 2.398955564006688 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A UXP-6_2 7.87293457583471 118.7804814344699 2.146442942850543 1.918310406565094 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_2 7.873674120050666 20.35100634972758 0.3889869777853631 1.741620028553562 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A UXP-6_2 7.860630389952441 116.1092287765138 2.243944236850254 1.825111740274366 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A UXP-6_2 7.873753611278769 168.6898688476351 3.095942009186524 1.907303539584746 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_2 7.875650927253385 36.25166388094237 0.5344890781864725 2.465833178137129 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_2 7.87415032903182 316.6633105684958 3.9618848781086 3.000517957651906 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_2 7.872679879785899 99.82875177433878 1.61733489429952 2.153707129154418 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A UXP-6_2 7.87386785223883 66.93957924825301 0.9358893246672925 2.348642766294726 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-6_2 7.872911848495971 26.40411171781826 0.4 2.660807790525091 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A UXP-6_2 7.873571746690431 62.63114878920872 0.8404481487934315 2.532367336151978 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A UXP-6_2 7.873468682007752 74.41109665739111 1.123319626710939 2.25549862891787 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A UXP-6_3 7.872649247399914 264.007171584468 3.702015691956002 2.705840977530825 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Val-B_1 1.025496928851561 279.1197606865476 5.495326487617926 1.808692669047089 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_1 1.025104376723476 338.5779578898183 6.390191404570433 1.91013909217337 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Val-B_1 1.025114247280147 456.7806785898329 8.06876428481038 2.027928144083099 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Val-B_1 1.025448988522926 598.1504637842145 11.51184249488728 1.863501537806091 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_1 1.025982602125282 232.1550081807439 4.398594638810613 1.866862998753439 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Val-B_1 1.026047340939926 1114.984505515439 19.90506768594366 1.973119275324097 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Val-B_1 1.0267569386346 516.3053419235513 9.047629751515112 2.026760921244052 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_1 0.9957908259634848 19.16431191035883 0.3807704341379155 1.800892842725722 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Val-B_1 1.02595 150.030534 2.910451 1.870728 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_1 1.026801546900887 932.3204371007931 16.11534236782473 2.027928144083099 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_1 1.025284768244555 492.2985519646837 9.40304920674409 1.863501537806091 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Val-B_1 1.026194072071289 390.0757708114639 7.495119258559845 1.863501537806091 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Val-B_1 1.027157764896582 614.17714759946 10.67690687113598 2.027928144083099 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_1 1.027320988287256 1021.938257939744 15.00981309733356 2.411217550170123 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Val-B_1 1.027066369546647 990.6964312996831 15.76742341448449 2.192354750360107 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Val-B_2 1.037177768122641 308.9575203792601 5.669454877086087 1.912445106411291 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_2 1.036741819177377 394.8443441445218 6.627689557402154 2.122871767005513 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A Val-B_2 1.036763655034634 519.9707535127654 8.497567713895407 2.173353412090402 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A Val-B_2 1.037124832577604 692.9675712863329 11.87649341706937 2.026336280307716 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_2 1.037716258211476 235.7135742387526 4.547127155198671 1.842471447798512 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Val-B_2 1.037752927019602 1221.924691537514 20.47108997307735 2.082737012842102 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A Val-B_2 1.038465508944416 538.8658789047931 9.279349557499643 2.035957370867095 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_2 1.007516891290867 17.25751222679584 0.369004711286557 1.69325858768749 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A Val-B_2 1.0377 173.857668 3.049225 1.993919 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_2 1.03851454895552 984.491487530569 16.37900730560843 2.082737012842102 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_2 1.036923024324469 509.4541631180998 9.521663441301007 1.918310406565094 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Val-B_2 1.037914847574488 454.73161218521 7.788070583590092 2.014325323827275 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A Val-B_2 1.038870065685419 672.5748045567777 10.97878607906294 2.137545881601105 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A Val-B_2 1.039025094253977 1050.36179281385 15.19729739647176 2.411590225396118 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A Val-B_2 1.038791220754303 1010.997358557185 16.09052270672252 2.192354750360107 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A aGlc 13C-A_1 5.040138013938012 68.10860058654849 0.4220004542762928 4.966113883423382 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A aGlc 13C-A_1 5.042022097854987 21.19361561880404 0.3937018201642308 2.040277324892491 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A aGlc 13C-A_1 5.041217001609118 301.5922104285347 0.6601245004989615 19.35428633935772 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A aGlc 13C-A_1 5.037081017138195 175.0548110463409 0.2955568781378157 23.4173794523556 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A aGlc 13C-A_1 5.038954928740283 78.90370505900417 0.3678140979198449 7.080452719364031 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A aGlc 13C-A_1 5.039802983862776 193.4385279146756 0.4736886223075858 13.61976037691068 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A aGlc 13C-B_1 5.35796 26.902122 0.176786 7.257154 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A aGlc 13C-B_1 5.35579 97.681099 0.316174 13.961579 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A aGlc 13C-B_1 5.357211187978579 238.6874914121651 0.8273468463864287 11.93558726371856 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A aGlc 13C-B_1 5.35708 230.796378 0.499179 18.463365 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A aGlc 13C-B_1 5.357950080289319 429.5732628907448 1.100201624407916 13.43442736937303 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A aGlc 13C-B_1 5.35591 118.516003 0.293755 15.907145 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A aGlc 13C-B_1 5.35581 68.771185 0.305534 9.07296 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A aGlc 13C-B_1 5.350447006161338 153.2483063584158 0.509807314418012 12.53877184315342 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A aGlc 13C-B_1 5.35685 176.590468 0.576278 10.958172 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A aGlc_1 5.216739005019774 33.41824498886574 0.4802319704939447 2.494934585375307 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_1 5.216655754083998 31.12565756422051 0.5100931098413717 2.223392379764959 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A aGlc_1 5.216984725036862 32.77899738247073 0.5321031330073841 2.224919868232102 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A aGlc_1 5.216756065969664 87.30137763768934 1.330263445871521 2.379907744996012 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_1 5.216662054698548 27.75106014036189 0.388865556694616 2.627362571649159 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A aGlc_1 5.218270267432094 48.77152025186587 0.8436537296279744 2.177201923977591 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A aGlc_1 5.2166573611506 92.97942214396116 1.228799853655449 2.652811624394467 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_1 5.21632 8.133643 0.165574 1.714049 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_1 5.218090264987338 177.9307547073237 2.182283167866285 2.826980724266643 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_1 5.216666168678987 66.86611437721972 1.002669967713051 2.326907081294777 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A aGlc_1 5.21674 23.029715 0.341756 2.351275 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A aGlc_1 5.21678 37.799059 0.39221 3.884759 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_1 5.21874 3.244348 0.027383 5.65038 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A aGlc_1 5.21786 23.07897 0.375696 2.476175 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A aGlc_2 5.223269135970439 38.88383401800206 0.5028049063161617 2.537190705308383 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_2 5.222953014773562 42.00923242627503 0.5937773606835702 2.483180819825381 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A aGlc_2 5.223383190972219 51.38650940091738 0.5624720340093798 3.061831661931976 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A aGlc_2 5.223012209448681 104.7392377378731 1.383546576912731 2.491354954086222 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_2 5.222719481340506 28.70967451978051 0.4033577377105682 2.406609095893038 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A aGlc_2 5.224612333926362 86.81590154346854 0.9759712917410195 3.247434611461667 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A aGlc_2 5.222843007020853 106.5685675598265 1.24586189294233 2.975247460457597 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_2 5.222829559502441 24.51941525520308 0.3098472113886363 2.819699326324205 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_2 5.22429795658952 198.8383350472095 2.192362389608424 2.992986340169371 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_2 5.222937752014507 95.44486327515115 1.08209865131098 2.848644257987427 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A aGlc_2 5.222877965336425 35.45840951728188 0.3487966742847345 3.128056236105738 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A aGlc_2 5.22319 19.679426 0.331423 2.089395 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A aGlc_2 5.22358 4.633385 0.144604 1.286185 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A aGlc_2 5.22428 45.437238 0.483271 3.357646 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_1 4.49788034001872 119.6045069180317 1.64285791651943 2.437888322629556 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_1 4.497495302278366 147.612902450274 2.124591870837609 2.385335076412114 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_1 4.497529435783177 182.9637098802002 2.85286020039719 2.292054011764643 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_1 4.497467376018805 236.3557591651467 3.513381089702018 2.352437393578975 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_1 4.497642766361804 44.75516363101217 0.8701926707366101 1.818306933633485 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_1 4.497953204992519 317.4730038135137 4.386387037124478 2.525403704085766 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_1 4.497184977661671 34.4779501909561 0.6231362126983815 1.898093643581557 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_1 4.50604129431639 34.28425282880004 0.3889054553390876 2.922824199601459 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_1 4.504665122019885 296.7560349384323 1.766482651748221 8.00718605874821 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_1 4.498027062950579 145.3900024304935 2.086383715967719 2.426450829738191 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_1 4.49741447731187 142.7100680297804 2.118904607432408 2.350034127811476 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_1 4.497799451445759 53.03648025733258 0.8455457441557609 2.188610850664798 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_1 4.497406746720046 105.3704430297687 1.585306206566088 2.374834952328909 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_1 4.497572981272604 88.40958159541962 1.175718428070387 2.773246632431793 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_1 4.497603230081556 113.584811974618 1.673544388924597 2.429260937988517 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_2 4.502457446401633 339.5624629621046 5.713830768136329 1.97259052406747 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_2 4.502395224835575 315.7748039918712 4.791169030711645 2.266059820861497 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_2 4.502411130182286 555.7481361515572 9.491316018927836 2.043066687094886 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_2 4.502516669906134 584.1636445926155 11.56031929598809 1.765761889812088 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_2 4.502484213538668 181.6439840703063 1.954056800816227 3.145150199302464 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_2 4.503516519079056 904.9831332226904 13.60255383598249 2.224888792188411 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_2 4.502515632060494 197.711524174679 3.082381929167036 2.23808458309091 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_2 4.512102441174176 25.00755786140698 0.3723723964465343 2.41117518895637 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_2 4.503572618867285 381.502901886143 6.35128377446281 2.108292089794183 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_2 4.502479387760775 204.6816428051062 2.670721137259798 2.594530822580455 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_2 4.502642623284148 156.1864095184108 1.435443940058725 3.853456927675651 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_2 4.502511731497723 373.9357183672266 6.257003949587318 2.024074020261442 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_2 4.503175992231665 460.9605204682939 6.385215272573276 2.462737634221314 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_2 4.503211757707485 387.4349611819478 5.744093274658537 2.292052572083275 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_3 4.505687818905312 329.8424456766561 5.867907151149888 1.910163574146994 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_3 4.505569421136644 363.8892695200664 5.311570405262116 2.320539875093649 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_3 4.505595683303466 722.1031182971304 10.83856728744911 2.276380620270336 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_3 4.505706058857424 884.7383681524416 13.86317381052449 2.117950837888893 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_3 4.50590823158467 107.8837997814871 1.587800395677172 2.264106037119631 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_3 4.506617717729727 920.9109485927805 14.31918279507744 2.184634464304051 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_3 4.505567514031322 185.4448992060682 2.974445943992348 2.161770752005005 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_3 4.506653033799923 415.2826141196632 6.513677277161669 2.189240738434969 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_3 4.505824733498532 230.956641474369 3.091383433966442 2.48742651048028 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_3 4.506241466867444 63.2793837798135 1.03979696950306 2.081302705174667 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_3 4.505723873228551 358.9508268764142 6.323634657900561 1.958889177912275 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_3 4.506340075283648 381.219469394565 5.81540752962106 2.276124246162961 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_3 4.506379107922795 371.3946246530101 5.6291078626402 2.23619143470313 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_4 4.511488160231583 152.822312592026 2.006617075848038 2.509613301943125 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_4 4.511271221736109 139.6730529971456 2.204441136110218 2.209839666877004 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_4 4.511357515468449 211.6022981021274 3.148180736704247 2.372547115265139 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_4 4.511081865209115 284.0358348753863 3.987932194994499 2.46981452173104 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_4 4.511743588005657 293.5564247386017 4.289927977471945 2.338211284514244 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_4 4.511833733081303 243.6739322486547 2.802953817744444 2.777638831268289 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_4 4.511111343705704 163.6451049836259 2.500746022413096 2.191968570664059 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A bGlc 13C-A_4 4.511236284215339 63.7410006471606 0.8563893585802844 2.597039626450966 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc 13C-A_4 4.510956726305379 89.23411249287123 1.291363609641969 2.366092384328722 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc 13C-A_4 4.511363226978029 110.6376289770998 1.54213970533955 2.491473919734355 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc_1 4.627222333949951 332.5295994130551 3.054451091350018 3.669392338906757 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_1 4.620389473891713 209.3374524364066 1.653218339616745 4.55632926543535 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A bGlc_1 4.619035883863322 238.1173544847206 2.135113980326311 3.881390866788433 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A bGlc_1 4.616771617181683 165.8807811726629 1.459025961632323 3.971482517577562 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_1 4.62742412707904 36.64984707805421 0.6325115255483651 2.065467165905413 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A bGlc_1 4.64193 113.229079 1.812949 2.221654 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A bGlc_1 4.627644753397408 110.2072040895423 1.653451658309891 2.309618981322728 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_1 4.627158952148503 11.34044403395696 0.2365828759014294 1.900274539965521 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A bGlc_1 4.626087966771466 330.3038683919517 1.22806789878428 8.677390950674294 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_1 4.629081238045015 237.7828711350567 3.783871525243704 2.192679447227664 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_1 4.627658881666287 261.6074033929423 2.654337318228034 3.053923620974889 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A bGlc_1 4.6273219033737 129.762894719301 0.9532237498764429 4.338795839814683 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc_1 4.628678244528277 513.8098500910421 2.095955993433043 9.136816325481737 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_1 4.628735542319538 594.6257828870991 2.556948661749195 8.040270387706581 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A bGlc_1 4.628800447540947 914.7397438128856 3.313710170165152 8.915291365272498 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc_2 4.634507426028258 114.0112822689477 1.35893041156679 3.015473758428298 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_2 4.627533636969576 194.9970590237712 1.550305225146972 3.955745416177837 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A bGlc_2 4.626715888007546 410.2283057811405 2.520080248629726 5.539425012375855 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A bGlc_2 4.62771228203729 721.5654413027811 4.347279936726713 5.107233971703478 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_2 4.640704209996551 56.6436080179506 0.9542977977505186 2.071085120583301 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A bGlc_2 4.64193 113.229079 1.812949 2.221654 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A bGlc_2 4.640617168638662 159.0567638641957 2.510999948301578 2.238792577332812 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_2 4.640739093956927 19.70710374417272 0.357175125408335 1.925185395149252 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A bGlc_2 4.640505791296095 38.98645450704918 0.6048406925325859 2.286278218503356 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_2 4.642206830039178 325.9253038858346 4.99947854296487 2.346907587099189 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_2 4.641062829054915 148.2299307581607 2.486982012427815 2.067437251361318 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A bGlc_2 4.640493961412331 39.9154710901948 0.6423881805655366 2.181796964810518 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bGlc_2 4.64089264487845 76.86085457071239 0.9863504160247413 2.70016011787295 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A bGlc_2 4.641337698394369 51.61391579490449 0.8019402296679929 2.240024088074096 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A bOH-butyrate_1 1.1804 31.10407 0.749237 1.465295 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A bOH-butyrate_2 1.192133877046782 64.56531137730451 1.624432452932239 1.42503058773407 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_1 3.508970806721861 318.1252328191654 6.493568741465535 1.709407623856207 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_1 3.508820952402548 413.0963328670906 7.767734682679795 1.903333095832409 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_1 3.509043398342017 567.9769373619231 9.74680433907185 2.062380018949935 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_1 3.509272965719964 588.6604153712146 11.10910551434477 1.860548992234464 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_1 3.508672009401652 195.5474105894472 4.190313584343862 1.655555799253976 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_1 3.510368689101906 763.5475181994308 14.61667151381963 1.863501537806092 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_1 3.509084197051842 293.5622082150375 3.993445195028841 2.428422449600839 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_1 3.508700887077748 28.29308246875375 0.6292507117576678 1.595353567082321 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_1 3.501274710788076 368.7602460538128 7.685381891864472 1.679698434241273 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_1 3.510498817523644 1500.717377112366 21.42408016611623 2.364586984521786 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_1 3.509053615976074 611.8001357529182 11.51807453904338 1.853363670200236 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_1 3.509043819215199 535.6587806144274 9.312657396714254 1.972528573162421 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_1 3.50901498488786 270.1575435486121 4.1462955216343 2.214134997016349 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_1 3.510229254398312 388.770378541543 5.437595867241956 2.532367336151978 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_1 3.509994081501664 360.9606809771329 5.82661777089002 2.140395858839188 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_2 3.513818283225425 384.0164276775588 7.409305117838842 1.808436588388842 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_2 3.513643419999946 464.5125121920444 8.48245570278659 1.958811137040831 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_2 3.513876863786458 635.5921295068871 10.57058070672369 2.112266712387299 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_2 3.514074589528061 736.3730307185764 12.68350519193433 2.025767245163047 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_2 3.513914044233496 910.5413773205644 11.70329792691496 2.752304503517168 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_2 3.515170135881468 899.5342009929064 15.89552142239719 2.002418919008106 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_2 3.5137405776661 275.8879267452822 4.20950229213402 2.27475680553591 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_2 3.513524033067636 29.10166228590406 0.6697329898163741 1.551532916967526 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_2 3.506328909450302 636.2932794779257 6.829613285431169 3.271064670429852 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_2 3.515178549376935 1676.106018860842 23.12504041412314 2.481030732877335 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_2 3.513895164548584 596.8608400267626 11.61548202760932 1.808692669047089 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_2 3.514031930079244 1263.584203463393 14.9511820581022 2.775285308817405 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_2 3.513975630477487 264.8878656135946 4.40175805539242 2.056023819221411 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_2 3.514634628011285 291.7854376970283 4.276346930799426 2.380793036323277 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_2 3.5149788772761 478.503628659446 6.737519538977868 2.478084773963219 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_3 3.525619435487396 420.6149378495952 8.761377630877416 1.693209631375281 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_3 3.525492290134431 512.4935232251544 9.718122036342884 1.875566788468339 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_3 3.525874926984653 823.1142834749422 14.40993753902712 2.047974918505099 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_3 3.525847608938242 623.8564506298887 13.14786482897618 1.699949488311976 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_3 3.525338698443901 218.9799480761499 5.027440597625095 1.561651038878096 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_3 3.527303294058468 1609.896864538373 23.6752455027254 2.412778179730994 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_3 3.53036234501461 370.2597548767249 6.468074755686642 2.080317688784284 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_3 3.529921650222985 78.14664030648053 1.803754960117364 1.613540826159114 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_3 3.525464508232907 105.6087428600685 2.334052531770217 1.63344767887664 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_3 3.527098403254361 1440.612229218535 23.88190258938051 2.065504020212771 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_3 3.52569418642176 712.5862276733635 14.55180289548125 1.738883231313192 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_3 3.525742277136765 605.1489879818669 11.61605676163107 1.836911473674672 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_3 3.525755333078034 253.9779022599222 4.602551626647877 1.885517406322049 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_3 3.52652819150975 203.5797879811618 3.927840138614385 1.918310406565094 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_3 3.526785192916498 632.1126217750976 9.267221289003329 2.37482398738518 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_4 3.530434025365696 741.1337450933356 13.97832004858007 1.952126573402393 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_4 3.530064243466457 793.3120100703004 13.90557350924894 2.19254913039117 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_4 3.530485888260136 729.1001833580349 13.93050107606647 1.892137529495249 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_4 3.530917011041877 1138.46151233837 21.92517222446152 1.909826443451375 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_4 3.530105045276313 345.851112810955 6.725284297394065 1.805869206488113 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_4 3.531803372062832 1217.329211501291 22.1544382006225 1.939241578190027 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_4 3.534754542724797 501.1375110118059 8.037391107089213 2.27475680553591 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_4 3.530242962130633 242.293294743784 4.605907637128642 1.886048101200376 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_4 3.531625417077147 2001.348946068602 30.92879151234294 2.47873198345304 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_4 3.530366705525339 1211.006725191332 22.35796303065548 1.996944008333615 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_4 3.530534485492881 772.2715515984298 13.96385923657565 1.962618029974092 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-1,3_4 3.530405379071858 318.534703585185 6.039483341653533 2.006837011629781 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-1,3_4 3.531363156396105 381.5715072553295 5.549169194099085 2.399268942654917 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-1,3_4 3.531222066929126 921.5963145257422 11.06658286232164 2.841440104539211 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_1 4.038627777658307 153.9153585621425 3.160830077223522 1.795280757089073 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_1 4.038522588367004 189.8384274282448 3.687382276731522 1.898093187551875 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_1 4.038745202311416 242.0399096496531 4.688166187498787 1.972151443988957 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_1 4.038966498844942 282.7717024466322 5.068879668975046 2.007347676132619 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_1 4.038338955683653 75.87101519384285 1.73190481018381 1.646658908300342 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_1 4.040086245008699 417.4838102474229 7.550485519362191 2.064101758042622 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_1 4.038734310372224 67.57639304986917 1.42342943061287 1.750292504499459 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_1 4.043234267512219 39.20041619643538 0.6266074478471618 2.178980065580192 08_C1-2_Spleen_allogenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_1 4.03845250395361 37.97471942398881 0.835331640805157 1.699074931529083 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_1 4.040080384159602 497.7154248738055 8.077533108373874 2.161086077298807 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_1 4.038771394636107 233.8832505860736 5.036914834066717 1.794594659792558 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_1 4.03876011409197 181.2947761684054 3.869262294487599 1.809259722460576 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_1 4.03895210599689 56.78619141204245 1.166422557179265 1.698704329330038 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_1 4.039688732885661 66.7953111620876 1.202663862897809 2.026941348586307 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_1 4.039815042640695 98.82802375503762 1.984522054520611 1.853951629151571 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_2 4.043533653205715 384.6848532501589 6.978780160224035 1.968889402212413 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_2 4.04340542048844 462.0277998458173 7.887221060832941 2.100248523382561 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_2 4.043604281003104 630.6944132105332 9.920260008056763 2.270454301254399 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_2 4.043795997312375 701.0806847221287 11.10297335074818 2.207879457830477 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_2 4.043223906994345 240.3456163720321 4.354780715755524 1.974523490297031 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_2 4.044901928292636 1068.088960006747 16.70345426044114 2.272531589123949 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_2 4.043537180526251 201.3334987578599 3.467568392776497 2.106810527803737 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_2 4.043269579240632 132.4864066591655 2.475851363023664 1.980123030856217 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_2 4.044975519574292 1291.549491686329 19.0594435584928 2.36611183980536 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_2 4.043599695511511 708.4161958533309 11.73627979677605 2.123914597035371 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_2 4.043649090769029 549.6531220991052 9.105702982485372 2.139696736758934 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_2 4.043841799599389 227.4997361885474 3.332207428017705 2.382208832968992 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_2 4.044480322022161 285.5787862443939 4.000640133038669 2.55151014659843 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_2 4.044634492465917 369.6774495039266 5.521511652180578 2.336124196267032 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_3 4.048557498239753 239.8071720654483 3.646814448118619 2.300510939852901 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_3 4.048449706235596 275.9285762827844 4.261588058197608 2.291942982952105 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_3 4.048655734981043 375.420126178077 5.448327718550879 2.4584842938804 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_3 4.04895551736021 462.8262269861747 6.57625220013258 2.481943435401815 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_3 4.048283455377635 174.5081608575814 2.49242971813221 2.427333899268713 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_3 4.049970821435623 578.6666918582589 9.460201232200285 2.199348695756784 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_3 4.048703972587854 152.995268075531 1.923964946823703 2.702265981856131 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_3 4.048421570013172 109.7973323574126 1.318152920224019 2.894024557365285 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_3 4.050088409368733 685.4735331813627 10.59885495997711 2.30229718474567 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_3 4.048692531068462 379.811853449749 6.32304070581687 2.188915856109216 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_3 4.04867047151795 311.3549763914291 4.685211374179732 2.322298263820474 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A m-Ins-2?_3 4.048879999255974 259.0340430871482 2.795392939787263 3.198562022067454 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A m-Ins-2?_3 4.049807089340657 242.4405950000855 3.187296174992011 2.673859761858162 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A m-Ins-2?_3 4.049602736969538 256.3189280603135 3.480675313991519 2.583277605914918 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A pyruvate-3_1 2.369211136293641 48.95944239074765 0.890440375314523 1.91850343127694 01_A0_Spleen_naive_0days_170427_UKy_GCH_rep1-polar-NMR_A pyruvate-3_1 2.36863344639244 59.88095145600428 0.9389231244445481 2.419822203845411 02_A1_Spleen_naive_0days_170427_UKy_GCH_rep2-polar-NMR_A pyruvate-3_1 2.368536190126151 64.58381406078344 1.021377118823619 2.273833645437769 03_A2_Spleen_naive_0days_170427_UKy_GCH_rep3-polar-NMR_A pyruvate-3_1 2.368910294634342 127.2532165933814 2.286122425273746 1.94222815945279 04_B0_Spleen_syngenic_42days_170427_UKy_GCH_rep1-polar-NMR_A pyruvate-3_1 2.369798211475324 42.12623091803187 0.7115116581386038 2.065863131413782 05_B1_Spleen_syngenic_42days_170427_UKy_GCH_rep2-polar-NMR_A pyruvate-3_1 2.369121788737211 136.2306064130515 2.128166837453013 2.360046636844211 06_B2_Spleen_syngenic_42days_170427_UKy_GCH_rep3-polar-NMR_A pyruvate-3_1 2.370522693134291 43.38697049742865 0.6750182442435825 2.261018825705895 07_C1-1_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A pyruvate-3_1 2.369959405990376 15.29852652794684 0.2780841302978658 1.898933909277284 09_C2-0_Spleen_allogenic_42days_170427_UKy_GCH_rep1-polar-NMR_A pyruvate-3_1 2.370120817529442 98.31188324154944 1.785364179582473 2.032700845970462 10_B1-0_Spleen_syngenic_7days_170427_UKy_GCH_rep1-polar-NMR_A pyruvate-3_1 2.36871598371564 76.89237075903375 1.463104984757339 1.916873795610371 11_B1-1_Spleen_syngenic_7days_170427_UKy_GCH_rep2-polar-NMR_A pyruvate-3_1 2.369875623458793 50.67391148922958 0.7529188912321196 2.356781356637115 12_B1-2_Spleen_syngenic_7days_170427_UKy_GCH_rep3-polar-NMR_A pyruvate-3_1 2.371140034255694 105.7484127778102 1.945732880701087 1.911139598085115 13_C1-1_Spleen_allogenic_7days_170427_UKy_GCH_rep1-polar-NMR_A pyruvate-3_1 2.371415503059624 99.94957074441493 1.30899877645701 2.695185087141112 14_C1-2_Spleen_allogenic_7days_170427_UKy_GCH_rep2-polar-NMR_A pyruvate-3_1 2.370840784644431 114.5254203840507 1.624475306593278 2.50301698591933 15_C1-20_Spleen_allogenic_7days_170427_UKy_GCH_rep3-polar-NMR_A EXTENDED_NMR_METABOLITE_DATA_END #END