{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST001471","ANALYSIS_ID":"AN002447","VERSION":"1","CREATED_ON":"2020-08-19"},

"PROJECT":{"PROJECT_TITLE":"Metabolomics of lung injury after allogeneic hematopoietic cell transplantation","PROJECT_SUMMARY":"Allogeneic hematopoietic cell transplantation (allo-HCT) is a potentially curative treatment option for a variety of hematological malignancies. Interactions between the donor immune system and the patient tissue result in a disease, called GVHD. The pathophysiology of acute GVHD can be hypothesized in three sequential phases: cytokine storm and activation of the antigen-presenting cells (APC), donor T cell activation and effector cell phase. Idiopathic pneumonia syndrome (IPS) is one of the most deleterious complications after allogeneic HCT and is considered not only to be related to conditioning regimen toxicity but also represents an end organ damage caused by allo-reactive T cells, therefore making the lung susceptible to a two-pronged attack, one of which overlaps with GVHD causing other target organ injury. IPS results in mortality of up to 90% of patients. We will use a murine model of IPS and GVHD which is well established in our group, and in which disease evolves either across disparities in major histocompatibility complex (MCH) class I and II, minor histocompatibility antigens (miHags) or both. Metabolomics changes following syngeneic and allogeneic HCT at post-transplantation Days +7 (cytokine storm phase) and Days +42 (cellular effector phase) are compared to baseline wild-type (naive) controls. Prior to analysis, naïve - and experimental mice (N=3 from each group) were fed with semi-liquid diet supplemented with tracers (13C6-glucose ) over 24 hours. At the end of 7 days or 42 days, respectively, feces and aGVHD target organs (colon, liver and lung) were collected from all groups and further processed and / or analyzed. We expect to reveal metabolic pathways affected after allo-HCT which contribute to immune cell mediated lung injury (IPS) and will potentially identify different metabolic pathways in other GVHD target organs.","INSTITUTE":"University of Kentucky","DEPARTMENT":"Markey Cancer Center, Hematology and Blood and Marrow Transplant","LAST_NAME":"Hildebrandt","FIRST_NAME":"Gerhard","ADDRESS":"Gerhard C. Hildebrandt, MD, Room no. CC401A, Ben Roach Building, Markey Cancer Center University of Kentucky, Lexington, 40536","EMAIL":"gerhard.hildebrandt@uky.edu","PHONE":"800-333-8874"},

"STUDY":{"STUDY_TITLE":"Metabolomics of lung injury after allogeneic hematopoietic cell transplantation - Small Intestines DI-FTMS","STUDY_TYPE":"preliminary data","STUDY_SUMMARY":"Allogeneic hematopoietic cell transplantation (allo-HCT) is a potentially curative treatment option for a variety of hematological malignancies. Interactions between the donor immune system and the patient tissue result in a disease, called GVHD. The pathophysiology of acute GVHD can be hypothesized in three sequential phases: cytokine storm and activation of the antigen-presenting cells (APC), donor T cell activation and effector cell phase. Idiopathic pneumonia syndrome (IPS) is one of the most deleterious complications after allogeneic HCT and is considered not only to be related to conditioning regimen toxicity but also represents an end organ damage caused by allo-reactive T cells, therefore making the lung susceptible to a two-pronged attack, one of which overlaps with GVHD causing other target organ injury. IPS results in mortality of up to 90% of patients. We will use a murine model of IPS and GVHD which is well established in our group, and in which disease evolves either across disparities in major histocompatibility complex (MCH) class I and II, minor histocompatibility antigens (miHags) or both. Metabolomics changes following syngeneic and allogeneic HCT at post-transplantation Days +7 (cytokine storm phase) and Days +42 (cellular effector phase) are compared to baseline wild-type (naive) controls. Prior to analysis, naïve - and experimental mice (N=3 from each group) were fed with semi-liquid diet supplemented with tracers (13C6-glucose ) over 24 hours. At the end of 7 days or 42 days, respectively, feces and aGVHD target organs (colon, liver and lung) were collected from all groups and further processed and / or analyzed. We expect to reveal metabolic pathways affected after allo-HCT which contribute to immune cell mediated lung injury (IPS) and will potentially identify different metabolic pathways in other GVHD target organs.","INSTITUTE":"University of Kentucky","DEPARTMENT":"MCC","LAST_NAME":"Hildebrandt","FIRST_NAME":"Gerhard","ADDRESS":"CTW-453, 900 South Limestone street. UKY. Lexington, Kentucky-40536","EMAIL":"gerhard.hildebrandt@uky.edu","PHONE":"800-333-8874"},

"SUBJECT":{"SUBJECT_TYPE":"Mouse","SUBJECT_SPECIES":"Mus musculus","TAXONOMY_ID":"10090"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"-",
"Sample ID":"05_B1_SI_syngenic_42days_170427_UKy_GCH_rep2-lipid",
"Factors":{"Treatment Protocol":"syngenic"},
"Additional sample data":{"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_SI_syngenic_42days_170427_UKy_GCH_rep2","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"05_B1_SI_syngenic_42days_170427_UKy_GCH_rep2-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage35']","type":"cell_extract","weight":"0.7745","weight%units":"g","lineage_4":"05_B1_SI_syngenic_42days_170427_UKy_GCH_rep2-protein","protein_weight":"1.0010730956302694","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"05_B1_SI_T03-2017_syn_170427_UKy_GCB_rep2-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"01_A0_SI_naive_0days_170427_UKy_GCH_rep1-lipid",
"Factors":{"Treatment Protocol":"naive"},
"Additional sample data":{"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":"0","lineage_2":"01_A0_SI_naive_0days_170427_UKy_GCH_rep1","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"01_A0_SI_naive_0days_170427_UKy_GCH_rep1-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage31']","type":"cell_extract","weight":"0.7569","weight%units":"g","lineage_4":"01_A0_SI_naive_0days_170427_UKy_GCH_rep1-protein","protein_weight":"1.360284489372172","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"01_A0_SI_T03-2017_naive_170427_UKy_GCB_rep1-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"08_C1-2_SI_allogenic_42days_170427_UKy_GCH_rep2-lipid",
"Factors":{"Treatment Protocol":"allogenic"},
"Additional sample data":{"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_SI_allogenic_42days_170427_UKy_GCH_rep2","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"08_C1-2_SI_allogenic_42days_170427_UKy_GCH_rep2-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage38']","type":"cell_extract","weight":"0.6659","weight%units":"g","lineage_4":"08_C1-2_SI_allogenic_42days_170427_UKy_GCH_rep2-protein","protein_weight":"3.1425075687553528","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"08_C1-2_SI_T03-2017_allo_170427_UKy_GCB_rep2-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"14_C1-2_SI_allogenic_7days_170427_UKy_GCH_rep2-lipid",
"Factors":{"Treatment Protocol":"allogenic"},
"Additional sample data":{"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_SI_allogenic_7days_170427_UKy_GCH_rep2","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"14_C1-2_SI_allogenic_7days_170427_UKy_GCH_rep2-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage44']","type":"cell_extract","weight":"0.7994","weight%units":"g","lineage_4":"14_C1-2_SI_allogenic_7days_170427_UKy_GCH_rep2-protein","protein_weight":"2.9949937519110956","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"14_C1-2_SI_T04-2017_allo_170427_UKy_GCB_rep2-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"11_B1-1_SI_syngenic_7days_170427_UKy_GCH_rep2-lipid",
"Factors":{"Treatment Protocol":"syngenic"},
"Additional sample data":{"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_SI_syngenic_7days_170427_UKy_GCH_rep2","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"11_B1-1_SI_syngenic_7days_170427_UKy_GCH_rep2-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage41']","type":"cell_extract","weight":"0.766","weight%units":"g","lineage_4":"11_B1-1_SI_syngenic_7days_170427_UKy_GCH_rep2-protein","protein_weight":"2.378970613770366","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"11_B1-1_SI_T04-2017_syn_170427_UKy_GCB_rep2-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"13_C1-1_SI_allogenic_7days_170427_UKy_GCH_rep1-lipid",
"Factors":{"Treatment Protocol":"allogenic"},
"Additional sample data":{"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_SI_allogenic_7days_170427_UKy_GCH_rep1","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"13_C1-1_SI_allogenic_7days_170427_UKy_GCH_rep1-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage43']","type":"cell_extract","weight":"0.7852","weight%units":"g","lineage_4":"13_C1-1_SI_allogenic_7days_170427_UKy_GCH_rep1-protein","protein_weight":"1.4507095321124897","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"13_C1-1_SI_T04-2017_allo_170427_UKy_GCB_rep1-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"15_C1-20_SI_allogenic_7days_170427_UKy_GCH_rep3-lipid",
"Factors":{"Treatment Protocol":"allogenic"},
"Additional sample data":{"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_SI_allogenic_7days_170427_UKy_GCH_rep3","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"15_C1-20_SI_allogenic_7days_170427_UKy_GCH_rep3-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage45']","type":"cell_extract","weight":"0.7982","weight%units":"g","lineage_4":"15_C1-20_SI_allogenic_7days_170427_UKy_GCH_rep3-protein","protein_weight":"0.07598828829511124","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"15_C1-20_SI_T04-2017_allo_170427_UKy_GCB_rep3-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"03_A2_SI_naive_0days_170427_UKy_GCH_rep3-lipid",
"Factors":{"Treatment Protocol":"naive"},
"Additional sample data":{"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":"0","lineage_2":"03_A2_SI_naive_0days_170427_UKy_GCH_rep3","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"03_A2_SI_naive_0days_170427_UKy_GCH_rep3-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage33']","type":"cell_extract","weight":"0.7949","weight%units":"g","lineage_4":"03_A2_SI_naive_0days_170427_UKy_GCH_rep3-protein","protein_weight":"0.8819362150128038","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"03_A2_SI_T03-2017_naive_170427_UKy_GCB_rep3-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"02_A1_SI_naive_0days_170427_UKy_GCH_rep2-lipid",
"Factors":{"Treatment Protocol":"naive"},
"Additional sample data":{"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":"0","lineage_2":"02_A1_SI_naive_0days_170427_UKy_GCH_rep2","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"02_A1_SI_naive_0days_170427_UKy_GCH_rep2-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage32']","type":"cell_extract","weight":"0.8076","weight%units":"g","lineage_4":"02_A1_SI_naive_0days_170427_UKy_GCH_rep2-protein","protein_weight":"1.2310244885693347","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"02_A1_SI_T03-2017_naive_170427_UKy_GCB_rep2-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"12_B1-2_SI_syngenic_7days_170427_UKy_GCH_rep3-lipid",
"Factors":{"Treatment Protocol":"syngenic"},
"Additional sample data":{"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_SI_syngenic_7days_170427_UKy_GCH_rep3","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"12_B1-2_SI_syngenic_7days_170427_UKy_GCH_rep3-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage42']","type":"cell_extract","weight":"0.7782","weight%units":"g","lineage_4":"12_B1-2_SI_syngenic_7days_170427_UKy_GCH_rep3-protein","protein_weight":"0.8102614389604975","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"12_B1-2_SI_T04-2017_syn_170427_UKy_GCB_rep3-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"04_B0_SI_syngenic_42days_170427_UKy_GCH_rep1-lipid",
"Factors":{"Treatment Protocol":"syngenic"},
"Additional sample data":{"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_SI_syngenic_42days_170427_UKy_GCH_rep1","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"04_B0_SI_syngenic_42days_170427_UKy_GCH_rep1-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage34']","type":"cell_extract","weight":"0.798","weight%units":"g","lineage_4":"04_B0_SI_syngenic_42days_170427_UKy_GCH_rep1-protein","protein_weight":"0.9825758684635557","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"04_B0_SI_T03-2017_syn_170427_UKy_GCB_rep1-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"09_C2-0_SI_allogenic_42days_170427_UKy_GCH_rep1-lipid",
"Factors":{"Treatment Protocol":"allogenic"},
"Additional sample data":{"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_SI_allogenic_42days_170427_UKy_GCH_rep1","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"09_C2-0_SI_allogenic_42days_170427_UKy_GCH_rep1-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage39']","type":"cell_extract","weight":"0.7646","weight%units":"g","lineage_4":"09_C2-0_SI_allogenic_42days_170427_UKy_GCH_rep1-protein","protein_weight":"2.180889533694321","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"09_C2-0_SI_T03-2017_allo_170427_UKy_GCB_rep1-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"06_B2_SI_syngenic_42days_170427_UKy_GCH_rep3-lipid",
"Factors":{"Treatment Protocol":"syngenic"},
"Additional sample data":{"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_SI_syngenic_42days_170427_UKy_GCH_rep3","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"06_B2_SI_syngenic_42days_170427_UKy_GCH_rep3-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage36']","type":"cell_extract","weight":"0.798","weight%units":"g","lineage_4":"06_B2_SI_syngenic_42days_170427_UKy_GCH_rep3-protein","protein_weight":"0.5913021972603197","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"06_B2_SI_T03-2017_syn_170427_UKy_GCB_rep3-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"07_C1-1_SI_allogenic_42days_170427_UKy_GCH_rep1-lipid",
"Factors":{"Treatment Protocol":"allogenic"},
"Additional sample data":{"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_SI_allogenic_42days_170427_UKy_GCH_rep1","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"07_C1-1_SI_allogenic_42days_170427_UKy_GCH_rep1-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage37']","type":"cell_extract","weight":"0.7654","weight%units":"g","lineage_4":"07_C1-1_SI_allogenic_42days_170427_UKy_GCH_rep1-protein","protein_weight":"3.4114953724241492","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"07_C1-1_SI_T03-2017_allo_170427_UKy_GCB_rep1-quench_pos.raw"}
},
{
"Subject ID":"-",
"Sample ID":"10_B1-0_SI_syngenic_7days_170427_UKy_GCH_rep1-lipid",
"Factors":{"Treatment Protocol":"syngenic"},
"Additional sample data":{"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_SI_syngenic_7days_170427_UKy_GCH_rep1","protocol.id":"['mouse_tissue_collection', 'tissue_quench', 'frozen_tissue_grind']","lineage_3":"10_B1-0_SI_syngenic_7days_170427_UKy_GCH_rep1-lipid","protocol.id":"['lipid_extraction', 'FTMS_file_storage40']","type":"cell_extract","weight":"0.8131","weight%units":"g","lineage_4":"10_B1-0_SI_syngenic_7days_170427_UKy_GCH_rep1-protein","protein_weight":"1.8221409547723206","protein_weight%units":"mg","protocol.id":"['protein_extraction']","RAW_FILE_NAME":"10_B1-0_SI_T04-2017_syn_170427_UKy_GCB_rep1-quench_pos.raw"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"Mouse is sacrificed and tissues are harvested.","COLLECTION_PROTOCOL_ID":"mouse_tissue_collection","SAMPLE_TYPE":"mouse"},

"TREATMENT":{"TREATMENT_SUMMARY":"Mouse with allogenic bone marrow transplant. Fed with semi-liquid diet supplemented with fully labeled glucose for 24 hours before harvest. Mouse with no treatment. Fed with semi-liquid diet supplemented with fully labeled glucose for 24 hours before harvest. Mouse with syngenic bone marrow transplant. Fed with semi-liquid diet supplemented with fully labeled glucose for 24 hours before harvest.","TREATMENT_PROTOCOL_ID":"allogenic naive syngenic"},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"Lipid extraction from homogenate. Frozen tissue is ground in a SPEX grinder under liquid nitrogen to homogenize the sample. Protein extraction and quantification. Tissue is frozen in liquid nitrogen to stop metabolic processes.","SAMPLEPREP_PROTOCOL_ID":"frozen_tissue_grind; protein_extraction; tissue_quench; lipid_extraction","SAMPLEPREP_PROTOCOL_FILENAME":"4D_17Jun4_Fan_Prot_Quant.pdf; 4B_Extract_Polar_Lipid_Prot_Fan_070417.pdf"},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_SUMMARY":"None","CHROMATOGRAPHY_TYPE":"None (Direct infusion)","INSTRUMENT_NAME":"None","COLUMN_NAME":"None"},

"ANALYSIS":{"ANALYSIS_TYPE":"MS"},

"MS":{"INSTRUMENT_NAME":"Orbitrap Fusion","INSTRUMENT_TYPE":"FTMS","MS_TYPE":"ESI","ION_MODE":"POSITIVE","MS_COMMENTS":"Measurements made using direct infusion (nano-electrospray) FTMS."},

"MS_METABOLITE_DATA":{
"Units":"peak_height",

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'C22H43N1O1']","isotopologue":"['13C2+2H0', '13C2+2H0']","isotopologue%type":"['13C+2H', '13C+2H']","natural_abundance_probability":"[0.02109122, 0.02109122]"},{"Metabolite":"IMF1000","adduct":"['14N1+1H4', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C27H63N2O9P1', 'C31H60N1O9', 'C31H60N1O9', 'C32H59N2Na1O6']","adducted_isotopic_formula":"['12C26+13C1+14N2+16O9+1H63+31P1', '12C30+13C1+14N1+16O9+1H60', '12C30+13C1+14N1+16O9+1H60', '12C31+13C1+14N2+16O6+1H59+23Na1']","charge":"['1', '1', '1', '1']","elemental_formula":"['C27H59N1O9P1', 'C31H56O9', 'C31H59N1O9', 'C32H59N2O6']","isotopologue":"['13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.21059697, 0.23253892, 0.23253892, 0.23836804]"},{"Metabolite":"IMF1019","adduct":"['14N1+1H4', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C41H91N2O6P1', 'C45H88N1O6', 'C45H88N1O6', 'C46H87N2Na1O3']","adducted_isotopic_formula":"['12C41+14N2+16O6+1H91+31P1', '12C45+14N1+16O6+1H88', '12C45+14N1+16O6+1H88', '12C46+14N2+16O3+1H87+23Na1']","charge":"['1', '1', '1', '1']","elemental_formula":"['C41H87N1O6P1', 'C45H84O6', 'C45H87N1O6', 'C46H87N2O3']","isotopologue":"['13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.62286807, 0.59902047, 0.59902047, 0.59484766]"},{"Metabolite":"IMF102","adduct":"['14N1+1H4', '1H1']","adducted_elemental_formula":"['C43H84N1O6', 'C43H84N1O6']","adducted_isotopic_formula":"['12C43+14N1+16O6+1H84', '12C43+14N1+16O6+1H84']","charge":"['1', '1']","elemental_formula":"['C43H80O6', 'C43H83N1O6']","isotopologue":"['13C0', '13C0']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.61232985, 0.61232985]"},{"Metabolite":"IMF1020","adduct":"['14N1+1H4', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C41H91N2O6P1', 'C45H88N1O6', 'C45H88N1O6', 'C46H87N2Na1O3']","adducted_isotopic_formula":"['12C40+13C1+14N2+16O6+1H91+31P1', '12C44+13C1+14N1+16O6+1H88', '12C44+13C1+14N1+16O6+1H88', '12C45+13C1+14N2+16O3+1H87+23Na1']","charge":"['1', '1', '1', '1']","elemental_formula":"['C41H87N1O6P1', 'C45H84O6', 'C45H87N1O6', 'C46H87N2O3']","isotopologue":"['13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.27620764, 0.29154792, 0.29154792, 0.29595069]"},{"Metabolite":"IMF103","adduct":"['14N1+1H4', '1H1']","adducted_elemental_formula":"['C43H84N1O6', 'C43H84N1O6']","adducted_isotopic_formula":"['12C42+13C1+14N1+16O6+1H84', '12C42+13C1+14N1+16O6+1H84']","charge":"['1', '1']","elemental_formula":"['C43H80O6', 'C43H83N1O6']","isotopologue":"['13C1', '13C1']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.28478011, 0.28478011]"},{"Metabolite":"IMF104","adduct":"['14N1+1H4', '1H1']","adducted_elemental_formula":"['C43H84N1O6', 'C43H84N1O6']","adducted_isotopic_formula":"['12C41+13C2+14N1+16O6+1H84', '12C41+13C2+14N1+16O6+1H84']","charge":"['1', '1']","elemental_formula":"['C43H80O6', 'C43H83N1O6']","isotopologue":"['13C2', '13C2']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.06468219, 0.06468219]"},{"Metabolite":"IMF1072","adduct":"1H1","adducted_elemental_formula":"C18H29","adducted_isotopic_formula":"12C18+1H29","charge":"1","elemental_formula":"C18H28","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.8212128"},{"Metabolite":"IMF1073","adduct":"1H1","adducted_elemental_formula":"C18H29","adducted_isotopic_formula":"12C17+13C1+1H29","charge":"1","elemental_formula":"C18H28","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.15987626"},{"Metabolite":"IMF1074","adduct":"['39K1', '23Na1', '39K1', '39K1', '39K1', '39K1', '1H1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '23Na1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C47H27K1N6O27P2', 'C50H23N6Na1O26P2', 'C51H24K1N5O27P1', 'C55H21K1N4O27', 'C55H26K1N5O20P3', 'C57H28K1N2O21P3', 'C59H25N1O23P3', 'C60H24N2Na1O20P3', 'C61H25K1N1O21P2', 'C66H142N2Na1O10P2', 'C67H138N3O12P1', 'C67H138N3O12P1', 'C68H137N4Na1O9P1', 'C68H134N7O8P1', 'C69H138K1N3O10', 'C69H140O13P1', 'C70H139N1Na1O10P1', 'C71H140K1O11', 'C72H134N3Na1O9', 'C72H141K1N5P3', 'C72H131N6O8', 'C72H131N6O8', 'C74H133N3O9', 'C74H133N3O9', 'C74H136Na1O10', 'C76H138K1N4P2', 'C80H135K1N3P1', 'C84H132K1N2', 'C85H133Na1P1', 'C86H129N1O2', 'C86H129N1O2']","adducted_isotopic_formula":"['12C47+14N6+16O27+1H27+31P2+39K1', '12C50+14N6+16O26+1H23+23Na1+31P2', '12C51+14N5+16O27+1H24+31P1+39K1', '12C55+14N4+16O27+1H21+39K1', '12C55+14N5+16O20+1H26+31P3+39K1', '12C57+14N2+16O21+1H28+31P3+39K1', '12C59+14N1+16O23+1H25+31P3', '12C60+14N2+16O20+1H24+23Na1+31P3', '12C61+14N1+16O21+1H25+31P2+39K1', '12C66+14N2+16O10+1H142+23Na1+31P2', '12C67+14N3+16O12+1H138+31P1', '12C67+14N3+16O12+1H138+31P1', '12C68+14N4+16O9+1H137+23Na1+31P1', '12C68+14N7+16O8+1H134+31P1', '12C69+14N3+16O10+1H138+39K1', '12C69+16O13+1H140+31P1', '12C70+14N1+16O10+1H139+23Na1+31P1', '12C71+16O11+1H140+39K1', '12C72+14N3+16O9+1H134+23Na1', '12C72+14N5+1H141+31P3+39K1', '12C72+14N6+16O8+1H131', '12C72+14N6+16O8+1H131', '12C74+14N3+16O9+1H133', '12C74+14N3+16O9+1H133', '12C74+16O10+1H136+23Na1', '12C76+14N4+1H138+31P2+39K1', '12C80+14N3+1H135+31P1+39K1', '12C84+14N2+1H132+39K1', '12C85+1H133+23Na1+31P1', '12C86+14N1+16O2+1H129', '12C86+14N1+16O2+1H129']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C47H27N6O27P2', 'C50H23N6O26P2', 'C51H24N5O27P1', 'C55H21N4O27', 'C55H26N5O20P3', 'C57H28N2O21P3', 'C59H24N1O23P3', 'C60H24N2O20P3', 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0.45674491, 0.46862185, 0.45988937, 0.45988937, 0.45668576, 0.45297349, 0.42180254, 0.45384131, 0.45067983, 0.41625537, 0.43920074, 0.41528108, 0.4356306, 0.4356306, 0.42990157, 0.42990157, 0.43342476, 0.39938131, 0.38409029, 0.36938472, 0.3946734, 0.38731891, 0.38731891]"},{"Metabolite":"IMF1075","adduct":"['39K1', '23Na1', '39K1', '39K1', '39K1', '39K1', '1H1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '23Na1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C47H27K1N6O27P2', 'C50H23N6Na1O26P2', 'C51H24K1N5O27P1', 'C55H21K1N4O27', 'C55H26K1N5O20P3', 'C57H28K1N2O21P3', 'C59H25N1O23P3', 'C60H24N2Na1O20P3', 'C61H25K1N1O21P2', 'C66H142N2Na1O10P2', 'C67H138N3O12P1', 'C67H138N3O12P1', 'C68H137N4Na1O9P1', 'C68H134N7O8P1', 'C69H138K1N3O10', 'C69H140O13P1', 'C70H139N1Na1O10P1', 'C71H140K1O11', 'C72H134N3Na1O9', 'C72H141K1N5P3', 'C72H131N6O8', 'C72H131N6O8', 'C74H133N3O9', 'C74H133N3O9', 'C74H136Na1O10', 'C76H138K1N4P2', 'C80H135K1N3P1', 'C84H132K1N2', 'C85H133Na1P1', 'C86H129N1O2', 'C86H129N1O2']","adducted_isotopic_formula":"['12C46+13C1+14N6+16O27+1H27+31P2+39K1', '12C49+13C1+14N6+16O26+1H23+23Na1+31P2', '12C50+13C1+14N5+16O27+1H24+31P1+39K1', '12C54+13C1+14N4+16O27+1H21+39K1', '12C54+13C1+14N5+16O20+1H26+31P3+39K1', '12C56+13C1+14N2+16O21+1H28+31P3+39K1', '12C58+13C1+14N1+16O23+1H25+31P3', '12C59+13C1+14N2+16O20+1H24+23Na1+31P3', '12C60+13C1+14N1+16O21+1H25+31P2+39K1', '12C65+13C1+14N2+16O10+1H142+23Na1+31P2', '12C66+13C1+14N3+16O12+1H138+31P1', '12C66+13C1+14N3+16O12+1H138+31P1', '12C67+13C1+14N4+16O9+1H137+23Na1+31P1', '12C67+13C1+14N7+16O8+1H134+31P1', '12C68+13C1+14N3+16O10+1H138+39K1', '12C68+13C1+16O13+1H140+31P1', '12C69+13C1+14N1+16O10+1H139+23Na1+31P1', '12C70+13C1+16O11+1H140+39K1', '12C71+13C1+14N3+16O9+1H134+23Na1', '12C71+13C1+14N5+1H141+31P3+39K1', '12C71+13C1+14N6+16O8+1H131', '12C71+13C1+14N6+16O8+1H131', '12C73+13C1+14N3+16O9+1H133', '12C73+13C1+14N3+16O9+1H133', '12C73+13C1+16O10+1H136+23Na1', '12C75+13C1+14N4+1H138+31P2+39K1', '12C79+13C1+14N3+1H135+31P1+39K1', '12C83+13C1+14N2+1H132+39K1', '12C84+13C1+1H133+23Na1+31P1', '12C85+13C1+14N1+16O2+1H129', '12C85+13C1+14N1+16O2+1H129']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C47H27N6O27P2', 'C50H23N6O26P2', 'C51H24N5O27P1', 'C55H21N4O27', 'C55H26N5O20P3', 'C57H28N2O21P3', 'C59H24N1O23P3', 'C60H24N2O20P3', 'C61H25N1O21P2', 'C66H142N2O10P2', 'C67H134N2O12P1', 'C67H137N3O12P1', 'C68H137N4O9P1', 'C68H130N6O8P1', 'C69H138N3O10', 'C69H139O13P1', 'C70H139N1O10P1', 'C71H140O11', 'C72H134N3O9', 'C72H141N5P3', 'C72H127N5O8', 'C72H130N6O8', 'C74H129N2O9', 'C74H132N3O9', 'C74H136O10', 'C76H138N4P2', 'C80H135N3P1', 'C84H132N2', 'C85H133P1', 'C86H125O2', 'C86H128N1O2']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.26114218, 0.28926976, 0.27251784, 0.28263962, 0.28628324, 0.29279169, 0.31777935, 0.32091426, 0.30134176, 0.33452011, 0.33326058, 0.33326058, 0.33587846, 0.33314819, 0.31478502, 0.33869508, 0.34121014, 0.31964945, 0.34201986, 0.32339285, 0.33923968, 0.33923968, 0.34407769, 0.34407769, 0.34689753, 0.32828958, 0.3323373, 0.33559384, 0.36283782, 0.3602657, 0.3602657]"},{"Metabolite":"IMF1076","adduct":"['39K1', '23Na1', '39K1', '39K1', '39K1', '39K1', '1H1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '23Na1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C47H27K1N6O27P2', 'C50H23N6Na1O26P2', 'C51H24K1N5O27P1', 'C55H21K1N4O27', 'C55H26K1N5O20P3', 'C57H28K1N2O21P3', 'C59H25N1O23P3', 'C60H24N2Na1O20P3', 'C61H25K1N1O21P2', 'C66H142N2Na1O10P2', 'C67H138N3O12P1', 'C67H138N3O12P1', 'C68H137N4Na1O9P1', 'C68H134N7O8P1', 'C69H138K1N3O10', 'C69H140O13P1', 'C70H139N1Na1O10P1', 'C71H140K1O11', 'C72H134N3Na1O9', 'C72H141K1N5P3', 'C72H131N6O8', 'C72H131N6O8', 'C74H133N3O9', 'C74H133N3O9', 'C74H136Na1O10', 'C76H138K1N4P2', 'C80H135K1N3P1', 'C84H132K1N2', 'C85H133Na1P1', 'C86H129N1O2', 'C86H129N1O2']","adducted_isotopic_formula":"['12C45+13C2+14N6+16O27+1H27+31P2+39K1', '12C48+13C2+14N6+16O26+1H23+23Na1+31P2', '12C49+13C2+14N5+16O27+1H24+31P1+39K1', '12C53+13C2+14N4+16O27+1H21+39K1', '12C53+13C2+14N5+16O20+1H26+31P3+39K1', '12C55+13C2+14N2+16O21+1H28+31P3+39K1', '12C57+13C2+14N1+16O23+1H25+31P3', '12C58+13C2+14N2+16O20+1H24+23Na1+31P3', '12C59+13C2+14N1+16O21+1H25+31P2+39K1', '12C64+13C2+14N2+16O10+1H142+23Na1+31P2', '12C65+13C2+14N3+16O12+1H138+31P1', '12C65+13C2+14N3+16O12+1H138+31P1', '12C66+13C2+14N4+16O9+1H137+23Na1+31P1', '12C66+13C2+14N7+16O8+1H134+31P1', '12C67+13C2+14N3+16O10+1H138+39K1', '12C67+13C2+16O13+1H140+31P1', '12C68+13C2+14N1+16O10+1H139+23Na1+31P1', '12C69+13C2+16O11+1H140+39K1', '12C70+13C2+14N3+16O9+1H134+23Na1', '12C70+13C2+14N5+1H141+31P3+39K1', '12C70+13C2+14N6+16O8+1H131', '12C70+13C2+14N6+16O8+1H131', '12C72+13C2+14N3+16O9+1H133', '12C72+13C2+14N3+16O9+1H133', '12C72+13C2+16O10+1H136+23Na1', '12C74+13C2+14N4+1H138+31P2+39K1', '12C78+13C2+14N3+1H135+31P1+39K1', '12C82+13C2+14N2+1H132+39K1', '12C83+13C2+1H133+23Na1+31P1', '12C84+13C2+14N1+16O2+1H129', '12C84+13C2+14N1+16O2+1H129']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C47H27N6O27P2', 'C50H23N6O26P2', 'C51H24N5O27P1', 'C55H21N4O27', 'C55H26N5O20P3', 'C57H28N2O21P3', 'C59H24N1O23P3', 'C60H24N2O20P3', 'C61H25N1O21P2', 'C66H142N2O10P2', 'C67H134N2O12P1', 'C67H137N3O12P1', 'C68H137N4O9P1', 'C68H130N6O8P1', 'C69H138N3O10', 'C69H139O13P1', 'C70H139N1O10P1', 'C71H140O11', 'C72H134N3O9', 'C72H141N5P3', 'C72H127N5O8', 'C72H130N6O8', 'C74H129N2O9', 'C74H132N3O9', 'C74H136O10', 'C76H138N4P2', 'C80H135N3P1', 'C84H132N2', 'C85H133P1', 'C86H125O2', 'C86H128N1O2']","isotopologue":"['13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.06496219, 0.07665225, 0.07368697, 0.08253774, 0.08360177, 0.08866915, 0.09967344, 0.10239218, 0.09777692, 0.11758756, 0.11894704, 0.11894704, 0.1216978, 0.12070855, 0.11575739, 0.12454995, 0.12732005, 0.12100346, 0.13132138, 0.12416939, 0.13025391, 0.13025391, 0.13583296, 0.13583296, 0.13694615, 0.13315091, 0.14198156, 0.15063221, 0.16482292, 0.16560278, 0.16560278]"},{"Metabolite":"IMF1077","adduct":"39K1","adducted_elemental_formula":"C34H72K1N6O2","adducted_isotopic_formula":"12C34+14N6+16O2+1H72+39K1","charge":"1","elemental_formula":"C34H72N6O2","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.62463623"},{"Metabolite":"IMF1078","adduct":"39K1","adducted_elemental_formula":"C34H72K1N6O2","adducted_isotopic_formula":"12C33+13C1+14N6+16O2+1H72+39K1","charge":"1","elemental_formula":"C34H72N6O2","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.22970046"},{"Metabolite":"IMF1079","adduct":"23Na1","adducted_elemental_formula":"C18H32Na1O2","adducted_isotopic_formula":"12C18+16O2+1H32+23Na1","charge":"1","elemental_formula":"C18H32O2","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.81694464"},{"Metabolite":"IMF1080","adduct":"23Na1","adducted_elemental_formula":"C18H32Na1O2","adducted_isotopic_formula":"12C17+13C1+16O2+1H32+23Na1","charge":"1","elemental_formula":"C18H32O2","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.15904532"},{"Metabolite":"IMF1081","adduct":"23Na1","adducted_elemental_formula":"C35H66Na1O5","adducted_isotopic_formula":"12C35+16O5+1H66+23Na1","charge":"1","elemental_formula":"C35H66O5","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.67282285"},{"Metabolite":"IMF1082","adduct":"23Na1","adducted_elemental_formula":"C35H66Na1O5","adducted_isotopic_formula":"12C34+13C1+16O5+1H66+23Na1","charge":"1","elemental_formula":"C35H66O5","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.25469742"},{"Metabolite":"IMF1083","adduct":"1H1","adducted_elemental_formula":"C18H33O1","adducted_isotopic_formula":"12C18+16O1+1H33","charge":"1","elemental_formula":"C18H32O1","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.81884047"},{"Metabolite":"IMF1084","adduct":"1H1","adducted_elemental_formula":"C18H33O1","adducted_isotopic_formula":"12C17+13C1+16O1+1H33","charge":"1","elemental_formula":"C18H32O1","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.15941441"},{"Metabolite":"IMF1086","adduct":"1H1","adducted_elemental_formula":"C19H35O3","adducted_isotopic_formula":"12C19+16O3+1H35","charge":"1","elemental_formula":"C19H34O3","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.80596128"},{"Metabolite":"IMF1087","adduct":"1H1","adducted_elemental_formula":"C19H35O3","adducted_isotopic_formula":"12C18+13C1+16O3+1H35","charge":"1","elemental_formula":"C19H34O3","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.16562411"},{"Metabolite":"IMF1088","adduct":"['39K1', '23Na1']","adducted_elemental_formula":"['C19H36K1O3', 'C22H32Na1O2']","adducted_isotopic_formula":"['12C19+16O3+1H36+39K1', '12C22+16O2+1H32+23Na1']","charge":"['1', '1']","elemental_formula":"['C19H36O3', 'C22H32O2']","isotopologue":"['13C0', '13C0']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.75153774, 0.78253661]"},{"Metabolite":"IMF1089","adduct":"['39K1', '23Na1']","adducted_elemental_formula":"['C19H36K1O3', 'C22H32Na1O2']","adducted_isotopic_formula":"['12C18+13C1+16O3+1H36+39K1', '12C21+13C1+16O2+1H32+23Na1']","charge":"['1', '1']","elemental_formula":"['C19H36O3', 'C22H32O2']","isotopologue":"['13C1', '13C1']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.15444013, 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0.30598577, 0.30598577, 0.30993135, 0.29187063, 0.31133034, 0.31781221, 0.32144273]"},{"Metabolite":"IMF1124","adduct":"['14N1+1H4', '1H1']","adducted_elemental_formula":"['C25H50N1O5', 'C25H50N1O5']","adducted_isotopic_formula":"['12C25+14N1+16O5+1H50', '12C25+14N1+16O5+1H50']","charge":"['1', '1']","elemental_formula":"['C25H46O5', 'C25H49N1O5']","isotopologue":"['13C0', '13C0']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.74788716, 0.74788716]"},{"Metabolite":"IMF1125","adduct":"['14N1+1H4', '1H1']","adducted_elemental_formula":"['C25H50N1O5', 'C25H50N1O5']","adducted_isotopic_formula":"['12C24+13C1+14N1+16O5+1H50', '12C24+13C1+14N1+16O5+1H50']","charge":"['1', '1']","elemental_formula":"['C25H46O5', 'C25H49N1O5']","isotopologue":"['13C1', '13C1']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.20222361, 0.20222361]"},{"Metabolite":"IMF1126","adduct":"['39K1', '23Na1', '39K1', '23Na1', '39K1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '23Na1', '14N1+1H4', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '39K1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C49H31K1N6O27P2', 'C52H27N6Na1O26P2', 'C53H28K1N5O27P1', 'C56H24N5Na1O26P1', 'C57H25K1N4O27', 'C57H30K1N5O20P3', 'C59H32K1N2O21P3', 'C60H26N5Na1O19P3', 'C61H29N1O23P3', 'C61H29N1O23P3', 'C61H27K1N4O20P2', 'C62H28N2Na1O20P3', 'C63H29K1N1O21P2', 'C65H145N4O12P2', 'C65H26O23P2', 'C66H25N1Na1O20P2', 'C66H144N5Na1O9P2', 'C67H147N1O13P2', 'C67H26K1O21P1', 'C68H146N2Na1O10P2', 'C69H142N3O12P1', 'C69H142N3O12P1', 'C70H141N4Na1O9P1', 'C70H138N7O8P1', 'C71H142K1N3O10', 'C71H144O13P1', 'C71H28K1O14P3', 'C72H143N1Na1O10P1', 'C73H139N2O12', 'C73H139N2O12', 'C73H144K1O11', 'C74H138N3Na1O9', 'C74H145K1N5P3', 'C74H135N6O8', 'C74H135N6O8', 'C76H137N3O9', 'C76H137N3O9', 'C76H140Na1O10', 'C78H142K1N4P2', 'C82H139K1N3P1', 'C86H136K1N2', 'C88H133N1O2', 'C88H133N1O2']","adducted_isotopic_formula":"['12C49+14N6+16O27+1H31+31P2+39K1', '12C52+14N6+16O26+1H27+23Na1+31P2', '12C53+14N5+16O27+1H28+31P1+39K1', '12C56+14N5+16O26+1H24+23Na1+31P1', '12C57+14N4+16O27+1H25+39K1', '12C57+14N5+16O20+1H30+31P3+39K1', '12C59+14N2+16O21+1H32+31P3+39K1', '12C60+14N5+16O19+1H26+23Na1+31P3', '12C61+14N1+16O23+1H29+31P3', '12C61+14N1+16O23+1H29+31P3', '12C61+14N4+16O20+1H27+31P2+39K1', '12C62+14N2+16O20+1H28+23Na1+31P3', '12C63+14N1+16O21+1H29+31P2+39K1', '12C65+14N4+16O12+1H145+31P2', '12C65+16O23+1H26+31P2', '12C66+14N1+16O20+1H25+23Na1+31P2', '12C66+14N5+16O9+1H144+23Na1+31P2', '12C67+14N1+16O13+1H147+31P2', '12C67+16O21+1H26+31P1+39K1', '12C68+14N2+16O10+1H146+23Na1+31P2', '12C69+14N3+16O12+1H142+31P1', '12C69+14N3+16O12+1H142+31P1', '12C70+14N4+16O9+1H141+23Na1+31P1', '12C70+14N7+16O8+1H138+31P1', '12C71+14N3+16O10+1H142+39K1', '12C71+16O13+1H144+31P1', '12C71+16O14+1H28+31P3+39K1', '12C72+14N1+16O10+1H143+23Na1+31P1', '12C73+14N2+16O12+1H139', '12C73+14N2+16O12+1H139', '12C73+16O11+1H144+39K1', '12C74+14N3+16O9+1H138+23Na1', '12C74+14N5+1H145+31P3+39K1', '12C74+14N6+16O8+1H135', '12C74+14N6+16O8+1H135', '12C76+14N3+16O9+1H137', '12C76+14N3+16O9+1H137', '12C76+16O10+1H140+23Na1', '12C78+14N4+1H142+31P2+39K1', '12C82+14N3+1H139+31P1+39K1', '12C86+14N2+1H136+39K1', '12C88+14N1+16O2+1H133', '12C88+14N1+16O2+1H133']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C49H31N6O27P2', 'C52H27N6O26P2', 'C53H28N5O27P1', 'C56H24N5O26P1', 'C57H25N4O27', 'C57H30N5O20P3', 'C59H32N2O21P3', 'C60H26N5O19P3', 'C61H25O23P3', 'C61H28N1O23P3', 'C61H27N4O20P2', 'C62H28N2O20P3', 'C63H29N1O21P2', 'C65H141N3O12P2', 'C65H25O23P2', 'C66H25N1O20P2', 'C66H144N5O9P2', 'C67H143O13P2', 'C67H26O21P1', 'C68H146N2O10P2', 'C69H138N2O12P1', 'C69H141N3O12P1', 'C70H141N4O9P1', 'C70H134N6O8P1', 'C71H142N3O10', 'C71H143O13P1', 'C71H28O14P3', 'C72H143N1O10P1', 'C73H135N1O12', 'C73H138N2O12', 'C73H144O11', 'C74H138N3O9', 'C74H145N5P3', 'C74H131N5O8', 'C74H134N6O8', 'C76H133N2O9', 'C76H136N3O9', 'C76H140O10', 'C78H142N4P2', 'C82H139N3P1', 'C86H136N2', 'C88H129O2', 'C88H132N1O2']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.5025504, 0.52327923, 0.48330937, 0.50324456, 0.46480502, 0.47079701, 0.46460551, 0.4902161, 0.48716281, 0.48716281, 0.45277172, 0.48376921, 0.44681726, 0.46780409, 0.46851092, 0.46524725, 0.46454534, 0.46165194, 0.42971008, 0.45843605, 0.44989338, 0.44989338, 0.4467594, 0.44312782, 0.41263439, 0.44397678, 0.41858535, 0.44088402, 0.43266842, 0.43266842, 0.40720779, 0.42965443, 0.40625468, 0.42616189, 0.42616189, 0.42055738, 0.42055738, 0.42400399, 0.3907005, 0.37574184, 0.3613559, 0.37890028, 0.37890028]"},{"Metabolite":"IMF1127","adduct":"['39K1', '23Na1', '39K1', '23Na1', '39K1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '23Na1', '14N1+1H4', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '39K1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C49H31K1N6O27P2', 'C52H27N6Na1O26P2', 'C53H28K1N5O27P1', 'C56H24N5Na1O26P1', 'C57H25K1N4O27', 'C57H30K1N5O20P3', 'C59H32K1N2O21P3', 'C60H26N5Na1O19P3', 'C61H29N1O23P3', 'C61H29N1O23P3', 'C61H27K1N4O20P2', 'C62H28N2Na1O20P3', 'C63H29K1N1O21P2', 'C65H145N4O12P2', 'C65H26O23P2', 'C66H25N1Na1O20P2', 'C66H144N5Na1O9P2', 'C67H147N1O13P2', 'C67H26K1O21P1', 'C68H146N2Na1O10P2', 'C69H142N3O12P1', 'C69H142N3O12P1', 'C70H141N4Na1O9P1', 'C70H138N7O8P1', 'C71H142K1N3O10', 'C71H144O13P1', 'C71H28K1O14P3', 'C72H143N1Na1O10P1', 'C73H139N2O12', 'C73H139N2O12', 'C73H144K1O11', 'C74H138N3Na1O9', 'C74H145K1N5P3', 'C74H135N6O8', 'C74H135N6O8', 'C76H137N3O9', 'C76H137N3O9', 'C76H140Na1O10', 'C78H142K1N4P2', 'C82H139K1N3P1', 'C86H136K1N2', 'C88H133N1O2', 'C88H133N1O2']","adducted_isotopic_formula":"['12C48+13C1+14N6+16O27+1H31+31P2+39K1', '12C51+13C1+14N6+16O26+1H27+23Na1+31P2', '12C52+13C1+14N5+16O27+1H28+31P1+39K1', '12C55+13C1+14N5+16O26+1H24+23Na1+31P1', '12C56+13C1+14N4+16O27+1H25+39K1', '12C56+13C1+14N5+16O20+1H30+31P3+39K1', '12C58+13C1+14N2+16O21+1H32+31P3+39K1', '12C59+13C1+14N5+16O19+1H26+23Na1+31P3', '12C60+13C1+14N1+16O23+1H29+31P3', '12C60+13C1+14N1+16O23+1H29+31P3', '12C60+13C1+14N4+16O20+1H27+31P2+39K1', '12C61+13C1+14N2+16O20+1H28+23Na1+31P3', '12C62+13C1+14N1+16O21+1H29+31P2+39K1', '12C64+13C1+14N4+16O12+1H145+31P2', '12C64+13C1+16O23+1H26+31P2', '12C65+13C1+14N1+16O20+1H25+23Na1+31P2', '12C65+13C1+14N5+16O9+1H144+23Na1+31P2', '12C66+13C1+14N1+16O13+1H147+31P2', '12C66+13C1+16O21+1H26+31P1+39K1', '12C67+13C1+14N2+16O10+1H146+23Na1+31P2', '12C68+13C1+14N3+16O12+1H142+31P1', '12C68+13C1+14N3+16O12+1H142+31P1', '12C69+13C1+14N4+16O9+1H141+23Na1+31P1', '12C69+13C1+14N7+16O8+1H138+31P1', '12C70+13C1+14N3+16O10+1H142+39K1', '12C70+13C1+16O13+1H144+31P1', '12C70+13C1+16O14+1H28+31P3+39K1', '12C71+13C1+14N1+16O10+1H143+23Na1+31P1', '12C72+13C1+14N2+16O12+1H139', '12C72+13C1+14N2+16O12+1H139', '12C72+13C1+16O11+1H144+39K1', '12C73+13C1+14N3+16O9+1H138+23Na1', '12C73+13C1+14N5+1H145+31P3+39K1', '12C73+13C1+14N6+16O8+1H135', '12C73+13C1+14N6+16O8+1H135', '12C75+13C1+14N3+16O9+1H137', '12C75+13C1+14N3+16O9+1H137', '12C75+13C1+16O10+1H140+23Na1', '12C77+13C1+14N4+1H142+31P2+39K1', '12C81+13C1+14N3+1H139+31P1+39K1', '12C85+13C1+14N2+1H136+39K1', '12C87+13C1+14N1+16O2+1H133', '12C87+13C1+14N1+16O2+1H133']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C49H31N6O27P2', 'C52H27N6O26P2', 'C53H28N5O27P1', 'C56H24N5O26P1', 'C57H25N4O27', 'C57H30N5O20P3', 'C59H32N2O21P3', 'C60H26N5O19P3', 'C61H25O23P3', 'C61H28N1O23P3', 'C61H27N4O20P2', 'C62H28N2O20P3', 'C63H29N1O21P2', 'C65H141N3O12P2', 'C65H25O23P2', 'C66H25N1O20P2', 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'1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '39K1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C49H31K1N6O27P2', 'C52H27N6Na1O26P2', 'C53H28K1N5O27P1', 'C56H24N5Na1O26P1', 'C57H25K1N4O27', 'C57H30K1N5O20P3', 'C59H32K1N2O21P3', 'C60H26N5Na1O19P3', 'C61H29N1O23P3', 'C61H29N1O23P3', 'C61H27K1N4O20P2', 'C62H28N2Na1O20P3', 'C63H29K1N1O21P2', 'C65H145N4O12P2', 'C65H26O23P2', 'C66H25N1Na1O20P2', 'C66H144N5Na1O9P2', 'C67H147N1O13P2', 'C67H26K1O21P1', 'C68H146N2Na1O10P2', 'C69H142N3O12P1', 'C69H142N3O12P1', 'C70H141N4Na1O9P1', 'C70H138N7O8P1', 'C71H142K1N3O10', 'C71H144O13P1', 'C71H28K1O14P3', 'C72H143N1Na1O10P1', 'C73H139N2O12', 'C73H144K1O11', 'C74H138N3Na1O9', 'C74H145K1N5P3', 'C74H135N6O8', 'C74H135N6O8', 'C76H137N3O9', 'C76H137N3O9', 'C76H140Na1O10', 'C78H142K1N4P2', 'C82H139K1N3P1', 'C86H136K1N2', 'C88H133N1O2', 'C88H133N1O2']","adducted_isotopic_formula":"['12C47+13C2+14N6+16O27+1H31+31P2+39K1', '12C50+13C2+14N6+16O26+1H27+23Na1+31P2', '12C51+13C2+14N5+16O27+1H28+31P1+39K1', '12C54+13C2+14N5+16O26+1H24+23Na1+31P1', '12C55+13C2+14N4+16O27+1H25+39K1', '12C55+13C2+14N5+16O20+1H30+31P3+39K1', '12C57+13C2+14N2+16O21+1H32+31P3+39K1', '12C58+13C2+14N5+16O19+1H26+23Na1+31P3', '12C59+13C2+14N1+16O23+1H29+31P3', '12C59+13C2+14N1+16O23+1H29+31P3', '12C59+13C2+14N4+16O20+1H27+31P2+39K1', '12C60+13C2+14N2+16O20+1H28+23Na1+31P3', '12C61+13C2+14N1+16O21+1H29+31P2+39K1', '12C63+13C2+14N4+16O12+1H145+31P2', '12C63+13C2+16O23+1H26+31P2', '12C64+13C2+14N1+16O20+1H25+23Na1+31P2', '12C64+13C2+14N5+16O9+1H144+23Na1+31P2', '12C65+13C2+14N1+16O13+1H147+31P2', '12C65+13C2+16O21+1H26+31P1+39K1', '12C66+13C2+14N2+16O10+1H146+23Na1+31P2', '12C67+13C2+14N3+16O12+1H142+31P1', '12C67+13C2+14N3+16O12+1H142+31P1', '12C68+13C2+14N4+16O9+1H141+23Na1+31P1', '12C68+13C2+14N7+16O8+1H138+31P1', '12C69+13C2+14N3+16O10+1H142+39K1', '12C69+13C2+16O13+1H144+31P1', '12C69+13C2+16O14+1H28+31P3+39K1', '12C70+13C2+14N1+16O10+1H143+23Na1+31P1', '12C71+13C2+14N2+16O12+1H139', '12C71+13C2+16O11+1H144+39K1', '12C72+13C2+14N3+16O9+1H138+23Na1', '12C72+13C2+14N5+1H145+31P3+39K1', '12C72+13C2+14N6+16O8+1H135', '12C72+13C2+14N6+16O8+1H135', '12C74+13C2+14N3+16O9+1H137', '12C74+13C2+14N3+16O9+1H137', '12C74+13C2+16O10+1H140+23Na1', '12C76+13C2+14N4+1H142+31P2+39K1', '12C80+13C2+14N3+1H139+31P1+39K1', '12C84+13C2+14N2+1H136+39K1', '12C86+13C2+14N1+16O2+1H133', '12C86+13C2+14N1+16O2+1H133']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C49H31N6O27P2', 'C52H27N6O26P2', 'C53H28N5O27P1', 'C56H24N5O26P1', 'C57H25N4O27', 'C57H30N5O20P3', 'C59H32N2O21P3', 'C60H26N5O19P3', 'C61H25O23P3', 'C61H28N1O23P3', 'C61H27N4O20P2', 'C62H28N2O20P3', 'C63H29N1O21P2', 'C65H141N3O12P2', 'C65H25O23P2', 'C66H25N1O20P2', 'C66H144N5O9P2', 'C67H143O13P2', 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0.1696713]"},{"Metabolite":"IMF1129","adduct":"23Na1","adducted_elemental_formula":"C62H23N1Na1O27","adducted_isotopic_formula":"12C62+14N1+16O27+1H23+23Na1","charge":"1","elemental_formula":"C62H23N1O27","isotopologue":"13C0+18O0","isotopologue%type":"13C+18O","natural_abundance_probability":"0.47761211"},{"Metabolite":"IMF1130","adduct":"23Na1","adducted_elemental_formula":"C62H23N1Na1O27","adducted_isotopic_formula":"12C61+13C1+14N1+16O27+1H23+23Na1","charge":"1","elemental_formula":"C62H23N1O27","isotopologue":"13C1+18O0","isotopologue%type":"13C+18O","natural_abundance_probability":"0.32027482"},{"Metabolite":"IMF1131","adduct":"23Na1","adducted_elemental_formula":"C62H23N1Na1O27","adducted_isotopic_formula":"12C60+13C2+14N1+16O27+1H23+23Na1","charge":"1","elemental_formula":"C62H23N1O27","isotopologue":"13C2+18O0","isotopologue%type":"13C+18O","natural_abundance_probability":"0.10565216"},{"Metabolite":"IMF1132","adduct":"23Na1","adducted_elemental_formula":"C62H23N1Na1O27","adducted_isotopic_formula":"12C62+14N1+16O26+18O1+1H23+23Na1","charge":"1","elemental_formula":"C62H23N1O27","isotopologue":"13C0+18O1","isotopologue%type":"13C+18O","natural_abundance_probability":"0.02650023"},{"Metabolite":"IMF1133","adduct":"23Na1","adducted_elemental_formula":"C51H80Na1","adducted_isotopic_formula":"12C51+1H80+23Na1","charge":"1","elemental_formula":"C51H80","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.57244363"},{"Metabolite":"IMF1134","adduct":"23Na1","adducted_elemental_formula":"C51H80Na1","adducted_isotopic_formula":"12C50+13C1+1H80+23Na1","charge":"1","elemental_formula":"C51H80","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.31576113"},{"Metabolite":"IMF1135","adduct":"23Na1","adducted_elemental_formula":"C29H52N1Na1O7","adducted_isotopic_formula":"12C29+14N1+16O7+1H52+23Na1","charge":"1","elemental_formula":"C29H52N1O7","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.71274631"},{"Metabolite":"IMF1136","adduct":"23Na1","adducted_elemental_formula":"C29H52N1Na1O7","adducted_isotopic_formula":"12C28+13C1+14N1+16O7+1H52+23Na1","charge":"1","elemental_formula":"C29H52N1O7","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.22355724"},{"Metabolite":"IMF1137","adduct":"['14N1+1H4', 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'C59H111N1Na1O3']","adducted_isotopic_formula":"['12C54+14N1+16O6+1H115+31P1', '12C54+14N1+16O6+1H115+31P1', '12C57+14N7+16O1+1H106', '12C58+16O6+1H112', '12C59+14N1+16O3+1H111+23Na1']","charge":"['1', '1', '1', '1', '1']","elemental_formula":"['C54H111O6P1', 'C54H114N1O6P1', 'C57H102N6O1', 'C58H111O6', 'C59H111N1O3']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.54205728, 0.54205728, 0.52030684, 0.52130366, 0.51767223]"},{"Metabolite":"IMF1140","adduct":"['14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C54H115N1O6P1', 'C54H115N1O6P1', 'C57H106N7O1', 'C58H112O6', 'C59H111N1Na1O3']","adducted_isotopic_formula":"['12C53+13C1+14N1+16O6+1H115+31P1', '12C53+13C1+14N1+16O6+1H115+31P1', '12C56+13C1+14N7+16O1+1H106', '12C57+13C1+16O6+1H112', '12C58+13C1+14N1+16O3+1H111+23Na1']","charge":"['1', '1', '1', '1', '1']","elemental_formula":"['C54H111O6P1', 'C54H114N1O6P1', 'C57H102N6O1', 'C58H111O6', 'C59H111N1O3']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.31658819, 0.31658819, 0.32076735, 0.32702017, 0.33034113]"},{"Metabolite":"IMF1141","adduct":"['23Na1', '23Na1']","adducted_elemental_formula":"['C31H67N1Na1O5P1', 'C35H64Na1O5']","adducted_isotopic_formula":"['12C31+14N1+16O5+1H67+23Na1+31P1', '12C35+16O5+1H64+23Na1']","charge":"['1', '1']","elemental_formula":"['C31H67N1O5P1', 'C35H64O5']","isotopologue":"['13C0', '13C0']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.69976954, 0.67297763]"},{"Metabolite":"IMF1142","adduct":"['23Na1', '23Na1']","adducted_elemental_formula":"['C31H67N1Na1O5P1', 'C35H64Na1O5']","adducted_isotopic_formula":"['12C30+13C1+14N1+16O5+1H67+23Na1+31P1', '12C34+13C1+16O5+1H64+23Na1']","charge":"['1', '1']","elemental_formula":"['C31H67N1O5P1', 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'C60H115K1N2O4', 'C61H109N5Na1O2', 'C62H112N1O6', 'C62H112N1O6', 'C63H111N2Na1O3']","adducted_isotopic_formula":"['12C54+13C2+14N3+16O4+1H118+31P1+39K1', '12C54+13C2+14N5+16O5+1H113+31P1', '12C54+13C2+14N5+16O5+1H113+31P1', '12C56+13C2+14N2+16O6+1H115+31P1', '12C56+13C2+14N2+16O6+1H115+31P1', '12C56+13C2+14N5+16O3+1H113+39K1', '12C58+13C2+14N2+16O4+1H115+39K1', '12C59+13C2+14N5+16O2+1H109+23Na1', '12C60+13C2+14N1+16O6+1H112', '12C60+13C2+14N1+16O6+1H112', '12C61+13C2+14N2+16O3+1H111+23Na1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C56H118N3O4P1', 'C56H109N4O5P1', 'C56H112N5O5P1', 'C58H111N1O6P1', 'C58H114N2O6P1', 'C58H113N5O3', 'C60H115N2O4', 'C61H109N5O2', 'C62H108O6', 'C62H111N1O6', 'C63H111N2O3']","isotopologue":"['13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', 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'C48H22N3O25P3', 'C48H25Na1O26P3', 'C49H21N4Na1O22P3', 'C50H22K1N3O23P2', 'C50H24O26P3', 'C55H20Na1O23P2']","adducted_isotopic_formula":"['12C44+13C1+16O27+1H29+31P3+39K1', '12C45+13C1+14N4+16O23+1H25+31P3+39K1', '12C47+13C1+14N3+16O25+1H22+31P3', '12C47+13C1+16O26+1H25+23Na1+31P3', '12C48+13C1+14N4+16O22+1H21+23Na1+31P3', '12C49+13C1+14N3+16O23+1H22+31P2+39K1', '12C49+13C1+16O26+1H24+31P3', '12C54+13C1+16O23+1H20+23Na1+31P2']","charge":"['1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C45H29O27P3', 'C46H25N4O23P3', 'C48H21N3O25P3', 'C48H25O26P3', 'C49H21N4O22P3', 'C50H22N3O23P2', 'C50H23O26P3', 'C55H20O23P2']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.26105863, 0.26284686, 0.28759145, 0.28994836, 0.29153783, 0.27476446, 0.29563469, 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0.71800047]"},{"Metabolite":"IMF1574","adduct":"['14N1+1H4', '1H1', '1H1']","adducted_elemental_formula":"['C25H44N1O6P1', 'C25H44N1O6P1', 'C29H41O6']","adducted_isotopic_formula":"['12C24+13C1+14N1+16O6+1H44+31P1', '12C24+13C1+14N1+16O6+1H44+31P1', '12C28+13C1+16O6+1H41']","charge":"['1', '1', '1']","elemental_formula":"['C25H40O6P1', 'C25H43N1O6P1', 'C29H40O6']","isotopologue":"['13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C']","natural_abundance_probability":"[0.20187145, 0.20187145, 0.22520524]"},{"Metabolite":"IMF1575","adduct":"['14N1+1H4', '14N1+1H4']","adducted_elemental_formula":"['C25H47N2O6P1', 'C29H44N1O6']","adducted_isotopic_formula":"['12C25+14N2+16O6+1H47+31P1', '12C29+14N1+16O6+1H44']","charge":"['1', '1']","elemental_formula":"['C25H43N1O6P1', 'C29H40O6']","isotopologue":"['13C0', '13C0']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.74361061, 0.71514017]"},{"Metabolite":"IMF1576","adduct":"['14N1+1H4', '14N1+1H4']","adducted_elemental_formula":"['C25H47N2O6P1', 'C29H44N1O6']","adducted_isotopic_formula":"['12C24+13C1+14N2+16O6+1H47+31P1', '12C28+13C1+14N1+16O6+1H44']","charge":"['1', '1']","elemental_formula":"['C25H43N1O6P1', 'C29H40O6']","isotopologue":"['13C1', '13C1']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.20106726, 0.22430809]"},{"Metabolite":"IMF1577","adduct":"['23Na1', '39K1', '23Na1', '39K1', '23Na1', '39K1', '1H1', '14N1+1H4', '39K1', '23Na1', '39K1', '23Na1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '23Na1', '39K1', '23Na1', '39K1']","adducted_elemental_formula":"['C51H30N5Na1O27P3', 'C54H26K1N6O27P1', 'C55H27N4Na1O27P2', 'C58H23K1N5O27', 'C59H24N3Na1O27P1', 'C60H30K1N3O21P3', 'C62H27N2O23P3', 'C62H146N6O12P3', 'C62H32K1O22P3', 'C63H26N3Na1O20P3', 'C64H27K1N2O21P2', 'C65H147N4Na1O10P3', 'C65H28Na1O21P3', 'C68H145N2O13P2', 'C68H145N2O13P2', 'C69H144N3Na1O10P2', 'C69H141N6O9P2', 'C69H141N6O9P2', 'C70H145K1N2O11P1', 'C71H141K1N6O7P1', 'C71H146Na1O11P2', 'C72H142N1O13P1', 'C72H142N1O13P1', 'C73H141N2Na1O10P1', 'C73H138N5O9P1', 'C73H138N5O9P1', 'C74H142K1N1O11', 'C74H137N6Na1O6P1', 'C75H138K1N5O7', 'C75H143K1N6P3', 'C75H133N7O8', 'C76H139O13', 'C77H138N1Na1O10', 'C77H135N4O9', 'C77H135N4O9', 'C78H134N5Na1O6', 'C79H140K1N5P2', 'C80H141N3Na1P3', 'C83H137K1N4P1']","adducted_isotopic_formula":"['12C51+14N5+16O27+1H30+23Na1+31P3', '12C54+14N6+16O27+1H26+31P1+39K1', '12C55+14N4+16O27+1H27+23Na1+31P2', '12C58+14N5+16O27+1H23+39K1', '12C59+14N3+16O27+1H24+23Na1+31P1', '12C60+14N3+16O21+1H30+31P3+39K1', '12C62+14N2+16O23+1H27+31P3', '12C62+14N6+16O12+1H146+31P3', '12C62+16O22+1H32+31P3+39K1', '12C63+14N3+16O20+1H26+23Na1+31P3', '12C64+14N2+16O21+1H27+31P2+39K1', '12C65+14N4+16O10+1H147+23Na1+31P3', '12C65+16O21+1H28+23Na1+31P3', '12C68+14N2+16O13+1H145+31P2', '12C68+14N2+16O13+1H145+31P2', '12C69+14N3+16O10+1H144+23Na1+31P2', '12C69+14N6+16O9+1H141+31P2', '12C69+14N6+16O9+1H141+31P2', '12C70+14N2+16O11+1H145+31P1+39K1', '12C71+14N6+16O7+1H141+31P1+39K1', '12C71+16O11+1H146+23Na1+31P2', '12C72+14N1+16O13+1H142+31P1', '12C72+14N1+16O13+1H142+31P1', '12C73+14N2+16O10+1H141+23Na1+31P1', '12C73+14N5+16O9+1H138+31P1', '12C73+14N5+16O9+1H138+31P1', '12C74+14N1+16O11+1H142+39K1', '12C74+14N6+16O6+1H137+23Na1+31P1', '12C75+14N5+16O7+1H138+39K1', '12C75+14N6+1H143+31P3+39K1', '12C75+14N7+16O8+1H133', '12C76+16O13+1H139', '12C77+14N1+16O10+1H138+23Na1', '12C77+14N4+16O9+1H135', '12C77+14N4+16O9+1H135', '12C78+14N5+16O6+1H134+23Na1', '12C79+14N5+1H140+31P2+39K1', '12C80+14N3+1H141+23Na1+31P3', '12C83+14N4+1H137+31P1+39K1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C51H30N5O27P3', 'C54H26N6O27P1', 'C55H27N4O27P2', 'C58H23N5O27', 'C59H24N3O27P1', 'C60H30N3O21P3', 'C62H26N2O23P3', 'C62H142N5O12P3', 'C62H32O22P3', 'C63H26N3O20P3', 'C64H27N2O21P2', 'C65H147N4O10P3', 'C65H28O21P3', 'C68H141N1O13P2', 'C68H144N2O13P2', 'C69H144N3O10P2', 'C69H137N5O9P2', 'C69H140N6O9P2', 'C70H145N2O11P1', 'C71H141N6O7P1', 'C71H146O11P2', 'C72H138O13P1', 'C72H141N1O13P1', 'C73H141N2O10P1', 'C73H134N4O9P1', 'C73H137N5O9P1', 'C74H142N1O11', 'C74H137N6O6P1', 'C75H138N5O7', 'C75H143N6P3', 'C75H129N6O8', 'C76H138O13', 'C77H138N1O10', 'C77H131N3O9', 'C77H134N4O9', 'C78H134N5O6', 'C79H140N5P2', 'C80H141N3P3', 'C83H137N4P1']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.52939854, 0.47650713, 0.50912959, 0.45826321, 0.48963666, 0.45806651, 0.48030633, 0.4795817, 0.45204242, 0.4769605, 0.44052862, 0.46997781, 0.47068793, 0.45515451, 0.45515451, 0.45198388, 0.44830983, 0.44830983, 0.41745981, 0.41118199, 0.44603979, 0.43772812, 0.43772812, 0.43467888, 0.4311455, 0.4311455, 0.40147662, 0.42814212, 0.39543916, 0.40053693, 0.42016396, 0.42096892, 0.41803643, 0.41463833, 0.41463833, 0.41174994, 0.38520167, 0.4115732, 0.37045354]"},{"Metabolite":"IMF1578","adduct":"['23Na1', '39K1', '23Na1', '39K1', '23Na1', '39K1', '1H1', '14N1+1H4', '39K1', '23Na1', '39K1', '23Na1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '23Na1', '39K1', '23Na1', '39K1']","adducted_elemental_formula":"['C51H30N5Na1O27P3', 'C54H26K1N6O27P1', 'C55H27N4Na1O27P2', 'C58H23K1N5O27', 'C59H24N3Na1O27P1', 'C60H30K1N3O21P3', 'C62H27N2O23P3', 'C62H146N6O12P3', 'C62H32K1O22P3', 'C63H26N3Na1O20P3', 'C64H27K1N2O21P2', 'C65H147N4Na1O10P3', 'C65H28Na1O21P3', 'C68H145N2O13P2', 'C68H145N2O13P2', 'C69H144N3Na1O10P2', 'C69H141N6O9P2', 'C69H141N6O9P2', 'C70H145K1N2O11P1', 'C71H141K1N6O7P1', 'C71H146Na1O11P2', 'C72H142N1O13P1', 'C72H142N1O13P1', 'C73H141N2Na1O10P1', 'C73H138N5O9P1', 'C73H138N5O9P1', 'C74H142K1N1O11', 'C74H137N6Na1O6P1', 'C75H138K1N5O7', 'C75H143K1N6P3', 'C75H133N7O8', 'C76H139O13', 'C77H138N1Na1O10', 'C77H135N4O9', 'C77H135N4O9', 'C78H134N5Na1O6', 'C79H140K1N5P2', 'C80H141N3Na1P3', 'C83H137K1N4P1']","adducted_isotopic_formula":"['12C50+13C1+14N5+16O27+1H30+23Na1+31P3', '12C53+13C1+14N6+16O27+1H26+31P1+39K1', '12C54+13C1+14N4+16O27+1H27+23Na1+31P2', '12C57+13C1+14N5+16O27+1H23+39K1', '12C58+13C1+14N3+16O27+1H24+23Na1+31P1', '12C59+13C1+14N3+16O21+1H30+31P3+39K1', '12C61+13C1+14N2+16O23+1H27+31P3', '12C61+13C1+14N6+16O12+1H146+31P3', '12C61+13C1+16O22+1H32+31P3+39K1', '12C62+13C1+14N3+16O20+1H26+23Na1+31P3', '12C63+13C1+14N2+16O21+1H27+31P2+39K1', '12C64+13C1+14N4+16O10+1H147+23Na1+31P3', '12C64+13C1+16O21+1H28+23Na1+31P3', '12C67+13C1+14N2+16O13+1H145+31P2', '12C67+13C1+14N2+16O13+1H145+31P2', '12C68+13C1+14N3+16O10+1H144+23Na1+31P2', '12C68+13C1+14N6+16O9+1H141+31P2', '12C68+13C1+14N6+16O9+1H141+31P2', '12C69+13C1+14N2+16O11+1H145+31P1+39K1', '12C70+13C1+14N6+16O7+1H141+31P1+39K1', '12C70+13C1+16O11+1H146+23Na1+31P2', '12C71+13C1+14N1+16O13+1H142+31P1', '12C71+13C1+14N1+16O13+1H142+31P1', '12C72+13C1+14N2+16O10+1H141+23Na1+31P1', '12C72+13C1+14N5+16O9+1H138+31P1', '12C72+13C1+14N5+16O9+1H138+31P1', '12C73+13C1+14N1+16O11+1H142+39K1', '12C73+13C1+14N6+16O6+1H137+23Na1+31P1', '12C74+13C1+14N5+16O7+1H138+39K1', '12C74+13C1+14N6+1H143+31P3+39K1', '12C74+13C1+14N7+16O8+1H133', '12C75+13C1+16O13+1H139', '12C76+13C1+14N1+16O10+1H138+23Na1', '12C76+13C1+14N4+16O9+1H135', '12C76+13C1+14N4+16O9+1H135', '12C77+13C1+14N5+16O6+1H134+23Na1', '12C78+13C1+14N5+1H140+31P2+39K1', '12C79+13C1+14N3+1H141+23Na1+31P3', '12C82+13C1+14N4+1H137+31P1+39K1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C51H30N5O27P3', 'C54H26N6O27P1', 'C55H27N4O27P2', 'C58H23N5O27', 'C59H24N3O27P1', 'C60H30N3O21P3', 'C62H26N2O23P3', 'C62H142N5O12P3', 'C62H32O22P3', 'C63H26N3O20P3', 'C64H27N2O21P2', 'C65H147N4O10P3', 'C65H28O21P3', 'C68H141N1O13P2', 'C68H144N2O13P2', 'C69H144N3O10P2', 'C69H137N5O9P2', 'C69H140N6O9P2', 'C70H145N2O11P1', 'C71H141N6O7P1', 'C71H146O11P2', 'C72H138O13P1', 'C72H141N1O13P1', 'C73H141N2O10P1', 'C73H134N4O9P1', 'C73H137N5O9P1', 'C74H142N1O11', 'C74H137N6O6P1', 'C75H138N5O7', 'C75H143N6P3', 'C75H129N6O8', 'C76H138O13', 'C77H138N1O10', 'C77H131N3O9', 'C77H134N4O9', 'C78H134N5O6', 'C79H140N5P2', 'C80H141N3P3', 'C83H137N4P1']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.29201737, 0.27830367, 0.3028634, 0.28747412, 0.31245085, 0.29725937, 0.32208149, 0.32159557, 0.30312842, 0.32499653, 0.30493683, 0.3304049, 0.33090413, 0.33475227, 0.33475227, 0.33730891, 0.33456701, 0.33456701, 0.31605923, 0.31575352, 0.34252141, 0.34087308, 0.34087308, 0.34319991, 0.34041014, 0.34041014, 0.32132739, 0.34266949, 0.32077219, 0.3249074, 0.34082844, 0.3460345, 0.34814537, 0.34531539, 0.34531539, 0.34736329, 0.32913269, 0.35611711, 0.33255816]"},{"Metabolite":"IMF1579","adduct":"23Na1","adducted_elemental_formula":"C21H26Na1O5","adducted_isotopic_formula":"12C21+16O5+1H26+23Na1","charge":"1","elemental_formula":"C21H26O5","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.78578996"},{"Metabolite":"IMF1580","adduct":"23Na1","adducted_elemental_formula":"C21H26Na1O5","adducted_isotopic_formula":"12C20+13C1+16O5+1H26+23Na1","charge":"1","elemental_formula":"C21H26O5","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.1784767"},{"Metabolite":"IMF1581","adduct":"['39K1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '23Na1', '1H1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C53H29K1N3O24P3', 'C55H26N2O26P3', 'C55H26N2O26P3', 'C55H31K1O25P3', 'C56H25N3Na1O23P3', 'C57H26K1N2O24P2', 'C58H27Na1O24P3', 'C59H23N1O26P2', 'C61H23K1N1O24P1', 'C62H140N6O12P2', 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0.56068239, 0.60327003, 0.59906762, 0.55330879, 0.583809, 0.57906338, 0.57906338, 0.53921568, 0.53110687, 0.57613126, 0.55689292, 0.55689292, 0.55301358, 0.51077251, 0.53557129, 0.53557129, 0.53184048, 0.51484491, 0.51484491, 0.47220681, 0.49513316, 0.49168404, 0.45412754, 0.4472983, 0.47526558, 0.47526558, 0.46901531, 0.46901531, 0.47285905, 0.46574813]"},{"Metabolite":"IMF1594","adduct":"['14N1+1H4', '1H1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '14N1+1H4', '39K1', '1H1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '1H1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1']","adducted_elemental_formula":"['C34H79N6O23P1', 'C34H79N6O23P1', 'C36H81N3O24P1', 'C36H81N3O24P1', 'C36H79K1N6O21', 'C37H80N4Na1O21P1', 'C38H86K1N4O15P3', 'C39H75N6Na1O20', 'C40H78N2O24', 'C40H78N2O24', 'C40H83N3O17P3', 'C40H83N3O17P3', 'C41H77N3Na1O21', 'C41H82N4Na1O14P3', 'C41H79N7O13P3', 'C42H83K1N3O15P2', 'C42H85O18P3', 'C43H84N1Na1O15P3', 'C44H85K1O16P2', 'C45H79N3Na1O14P2', 'C45H76N6O13P2', 'C45H76N6O13P2', 'C46H80K1N2O15P1', 'C47H76K1N6O11P1', 'C47H81Na1O15P2', 'C49H73N5O13P1', 'C49H73N5O13P1', 'C50H72N6Na1O10P1', 'C51H73K1N5O11', 'C53H70N4O13', 'C53H70N4O13', 'C54H69N5Na1O10', 'C59H74N1O7P2', 'C59H74N1O7P2', 'C61H74K1N1O5P1', 'C63H71O7P1', 'C64H70N1Na1O4P1', 'C65H71K1O5', 'C66H67K1N4O1', 'C66H62N6O2', 'C66H62N6O2', 'C68H64N3O3', 'C68H64N3O3', 'C68H67Na1O4', 'C69H63N4Na1']","adducted_isotopic_formula":"['12C33+13C1+14N6+16O23+1H79+31P1', '12C33+13C1+14N6+16O23+1H79+31P1', '12C35+13C1+14N3+16O24+1H81+31P1', '12C35+13C1+14N3+16O24+1H81+31P1', '12C35+13C1+14N6+16O21+1H79+39K1', '12C36+13C1+14N4+16O21+1H80+23Na1+31P1', '12C37+13C1+14N4+16O15+1H86+31P3+39K1', '12C38+13C1+14N6+16O20+1H75+23Na1', '12C39+13C1+14N2+16O24+1H78', '12C39+13C1+14N2+16O24+1H78', '12C39+13C1+14N3+16O17+1H83+31P3', '12C39+13C1+14N3+16O17+1H83+31P3', '12C40+13C1+14N3+16O21+1H77+23Na1', '12C40+13C1+14N4+16O14+1H82+23Na1+31P3', '12C40+13C1+14N7+16O13+1H79+31P3', '12C41+13C1+14N3+16O15+1H83+31P2+39K1', '12C41+13C1+16O18+1H85+31P3', '12C42+13C1+14N1+16O15+1H84+23Na1+31P3', '12C43+13C1+16O16+1H85+31P2+39K1', '12C44+13C1+14N3+16O14+1H79+23Na1+31P2', '12C44+13C1+14N6+16O13+1H76+31P2', '12C44+13C1+14N6+16O13+1H76+31P2', '12C45+13C1+14N2+16O15+1H80+31P1+39K1', '12C46+13C1+14N6+16O11+1H76+31P1+39K1', '12C46+13C1+16O15+1H81+23Na1+31P2', '12C48+13C1+14N5+16O13+1H73+31P1', '12C48+13C1+14N5+16O13+1H73+31P1', '12C49+13C1+14N6+16O10+1H72+23Na1+31P1', '12C50+13C1+14N5+16O11+1H73+39K1', '12C52+13C1+14N4+16O13+1H70', '12C52+13C1+14N4+16O13+1H70', '12C53+13C1+14N5+16O10+1H69+23Na1', '12C58+13C1+14N1+16O7+1H74+31P2', '12C58+13C1+14N1+16O7+1H74+31P2', '12C60+13C1+14N1+16O5+1H74+31P1+39K1', '12C62+13C1+16O7+1H71+31P1', '12C63+13C1+14N1+16O4+1H70+23Na1+31P1', '12C64+13C1+16O5+1H71+39K1', '12C65+13C1+14N4+16O1+1H67+39K1', '12C65+13C1+14N6+16O2+1H62', '12C65+13C1+14N6+16O2+1H62', '12C67+13C1+14N3+16O3+1H64', '12C67+13C1+14N3+16O3+1H64', '12C67+13C1+16O4+1H67+23Na1', '12C68+13C1+14N4+1H63+23Na1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C34H75N5O23P1', 'C34H78N6O23P1', 'C36H77N2O24P1', 'C36H80N3O24P1', 'C36H79N6O21', 'C37H80N4O21P1', 'C38H86N4O15P3', 'C39H75N6O20', 'C40H74N1O24', 'C40H77N2O24', 'C40H79N2O17P3', 'C40H82N3O17P3', 'C41H77N3O21', 'C41H82N4O14P3', 'C41H75N6O13P3', 'C42H83N3O15P2', 'C42H84O18P3', 'C43H84N1O15P3', 'C44H85O16P2', 'C45H79N3O14P2', 'C45H72N5O13P2', 'C45H75N6O13P2', 'C46H80N2O15P1', 'C47H76N6O11P1', 'C47H81O15P2', 'C49H69N4O13P1', 'C49H72N5O13P1', 'C50H72N6O10P1', 'C51H73N5O11', 'C53H66N3O13', 'C53H69N4O13', 'C54H69N5O10', 'C59H70O7P2', 'C59H73N1O7P2', 'C61H74N1O5P1', 'C63H70O7P1', 'C64H70N1O4P1', 'C65H71O5', 'C66H67N4O1', 'C66H58N5O2', 'C66H61N6O2', 'C68H60N2O3', 'C68H63N3O3', 'C68H67O4', 'C69H63N4']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.23384961, 0.23384961, 0.24434918, 0.24434918, 0.22709943, 0.24938723, 0.23961317, 0.25617222, 0.26110427, 0.26110427, 0.26447027, 0.26447027, 0.26576754, 0.26919366, 0.26700546, 0.25469591, 0.2740418, 0.27861216, 0.26331525, 0.28414438, 0.28183465, 0.28183465, 0.26827247, 0.26998246, 0.29287012, 0.29513692, 0.29513692, 0.29906223, 0.28174321, 0.30700746, 0.30700746, 0.31062107, 0.32853694, 0.32853694, 0.31154289, 0.33737922, 0.34034694, 0.3192618, 0.31929855, 0.33926267, 0.33926267, 0.34494647, 0.34494647, 0.34777342, 0.34758096]"},{"Metabolite":"IMF1595","adduct":"23Na1","adducted_elemental_formula":"C35H62Na1O4","adducted_isotopic_formula":"12C35+16O4+1H62+23Na1","charge":"1","elemental_formula":"C35H62O4","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.67477214"},{"Metabolite":"IMF1596","adduct":"23Na1","adducted_elemental_formula":"C35H62Na1O4","adducted_isotopic_formula":"12C34+13C1+16O4+1H62+23Na1","charge":"1","elemental_formula":"C35H62O4","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.25543532"},{"Metabolite":"IMF1597","adduct":"23Na1","adducted_elemental_formula":"C35H62Na1O4","adducted_isotopic_formula":"12C33+13C2+16O4+1H62+23Na1","charge":"1","elemental_formula":"C35H62O4","isotopologue":"13C2","isotopologue%type":"13C","natural_abundance_probability":"0.04696622"},{"Metabolite":"IMF1598","adduct":"['1H1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '14N1+1H4', 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'C51H70N5Na1O20', 'C51H75N6Na1O13P3', 'C52H78N2O17P3', 'C52H78N2O17P3', 'C52H76K1N5O14P2', 'C54H78K1N2O15P2', 'C54H73N4O16P2', 'C54H73N4O16P2', 'C55H72N5Na1O13P2', 'C56H75N1O17P2', 'C56H75N1O17P2', 'C56H73K1N4O14P1', 'C57H74N2Na1O14P2', 'C58H75K1N1O15P1', 'C58H70N3O16P1', 'C58H70N3O16P1', 'C59H69N4Na1O13P1', 'C59H66N7O12P1', 'C60H70K1N3O14', 'C60H72O17P1', 'C61H71N1Na1O14P1', 'C62H72K1O15', 'C63H66N3Na1O13', 'C63H63N6O12', 'C63H63N6O12', 'C64H74O10P3', 'C65H68Na1O14', 'C66H74K1O8P2', 'C69H70Na1O7P2', 'C71H67K1N3O4P1', 'C73H64N2O6P1', 'C73H64N2O6P1', 'C75H64K1N2O4', 'C77H61N1O6', 'C77H61N1O6', 'C78H60N2Na1O3', 'C78H57N5O2', 'C78H57N5O2']","adducted_isotopic_formula":"['12C35+14N6+16O26+1H82+31P3', '12C37+14N3+16O27+1H84+31P3', '12C37+14N3+16O27+1H84+31P3', '12C37+14N6+16O24+1H82+31P2+39K1', '12C38+14N4+16O24+1H83+23Na1+31P3', '12C39+14N3+16O25+1H84+31P2+39K1', '12C40+14N6+16O23+1H78+23Na1+31P2', '12C41+14N2+16O27+1H81+31P2', '12C41+14N2+16O27+1H81+31P2', '12C42+14N3+16O24+1H80+23Na1+31P2', '12C42+14N6+16O23+1H77+31P2', '12C43+14N2+16O25+1H81+31P1+39K1', '12C45+14N1+16O27+1H78+31P1', '12C45+14N1+16O27+1H78+31P1', '12C46+14N2+16O24+1H77+23Na1+31P1', '12C46+14N5+16O23+1H74+31P1', '12C46+14N5+16O23+1H74+31P1', '12C47+14N1+16O25+1H78+39K1', '12C47+14N6+16O20+1H73+23Na1+31P1', '12C48+14N5+16O21+1H74+39K1', '12C48+14N6+16O14+1H79+31P3+39K1', '12C48+14N7+16O22+1H69', '12C49+16O27+1H75', '12C50+14N1+16O24+1H74+23Na1', '12C50+14N4+16O23+1H71', '12C50+14N4+16O23+1H71', '12C50+14N5+16O16+1H76+31P3', '12C50+14N5+16O16+1H76+31P3', '12C51+14N5+16O20+1H70+23Na1', '12C51+14N6+16O13+1H75+23Na1+31P3', '12C52+14N2+16O17+1H78+31P3', '12C52+14N2+16O17+1H78+31P3', '12C52+14N5+16O14+1H76+31P2+39K1', '12C54+14N2+16O15+1H78+31P2+39K1', '12C54+14N4+16O16+1H73+31P2', '12C54+14N4+16O16+1H73+31P2', '12C55+14N5+16O13+1H72+23Na1+31P2', '12C56+14N1+16O17+1H75+31P2', '12C56+14N1+16O17+1H75+31P2', '12C56+14N4+16O14+1H73+31P1+39K1', '12C57+14N2+16O14+1H74+23Na1+31P2', 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'C69H70O7P2', 'C71H67N3O4P1', 'C73H60N1O6P1', 'C73H63N2O6P1', 'C75H64N2O4', 'C77H57O6', 'C77H60N1O6', 'C78H60N2O3', 'C78H53N4O2', 'C78H56N5O2']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', 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0.41947485]"},{"Metabolite":"IMF1599","adduct":"['1H1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '1H1', '23Na1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C35H82N6O26P3', 'C37H84N3O27P3', 'C37H84N3O27P3', 'C37H82K1N6O24P2', 'C38H83N4Na1O24P3', 'C39H84K1N3O25P2', 'C40H78N6Na1O23P2', 'C41H81N2O27P2', 'C41H81N2O27P2', 'C42H80N3Na1O24P2', 'C42H77N6O23P2', 'C43H81K1N2O25P1', 'C45H78N1O27P1', 'C45H78N1O27P1', 'C46H77N2Na1O24P1', 'C46H74N5O23P1', 'C46H74N5O23P1', 'C47H78K1N1O25', 'C47H73N6Na1O20P1', 'C48H74K1N5O21', 'C48H79K1N6O14P3', 'C48H69N7O22', 'C49H75O27', 'C50H74N1Na1O24', 'C50H71N4O23', 'C50H71N4O23', 'C50H76N5O16P3', 'C50H76N5O16P3', 'C51H70N5Na1O20', 'C51H75N6Na1O13P3', 'C52H78N2O17P3', 'C52H78N2O17P3', 'C52H76K1N5O14P2', 'C54H78K1N2O15P2', 'C54H73N4O16P2', 'C54H73N4O16P2', 'C55H72N5Na1O13P2', 'C56H75N1O17P2', 'C56H75N1O17P2', 'C56H73K1N4O14P1', 'C57H74N2Na1O14P2', 'C58H75K1N1O15P1', 'C58H70N3O16P1', 'C58H70N3O16P1', 'C59H69N4Na1O13P1', 'C59H66N7O12P1', 'C60H70K1N3O14', 'C60H72O17P1', 'C61H71N1Na1O14P1', 'C62H72K1O15', 'C63H66N3Na1O13', 'C63H63N6O12', 'C63H63N6O12', 'C64H74O10P3', 'C65H68Na1O14', 'C66H74K1O8P2', 'C69H70Na1O7P2', 'C71H67K1N3O4P1', 'C73H64N2O6P1', 'C73H64N2O6P1', 'C75H64K1N2O4', 'C77H61N1O6', 'C77H61N1O6', 'C78H60N2Na1O3', 'C78H57N5O2', 'C78H57N5O2']","adducted_isotopic_formula":"['12C34+13C1+14N6+16O26+1H82+31P3', '12C36+13C1+14N3+16O27+1H84+31P3', '12C36+13C1+14N3+16O27+1H84+31P3', '12C36+13C1+14N6+16O24+1H82+31P2+39K1', '12C37+13C1+14N4+16O24+1H83+23Na1+31P3', '12C38+13C1+14N3+16O25+1H84+31P2+39K1', '12C39+13C1+14N6+16O23+1H78+23Na1+31P2', '12C40+13C1+14N2+16O27+1H81+31P2', '12C40+13C1+14N2+16O27+1H81+31P2', '12C41+13C1+14N3+16O24+1H80+23Na1+31P2', '12C41+13C1+14N6+16O23+1H77+31P2', '12C42+13C1+14N2+16O25+1H81+31P1+39K1', '12C44+13C1+14N1+16O27+1H78+31P1', '12C44+13C1+14N1+16O27+1H78+31P1', '12C45+13C1+14N2+16O24+1H77+23Na1+31P1', '12C45+13C1+14N5+16O23+1H74+31P1', '12C45+13C1+14N5+16O23+1H74+31P1', '12C46+13C1+14N1+16O25+1H78+39K1', '12C46+13C1+14N6+16O20+1H73+23Na1+31P1', '12C47+13C1+14N5+16O21+1H74+39K1', '12C47+13C1+14N6+16O14+1H79+31P3+39K1', '12C47+13C1+14N7+16O22+1H69', '12C48+13C1+16O27+1H75', '12C49+13C1+14N1+16O24+1H74+23Na1', '12C49+13C1+14N4+16O23+1H71', '12C49+13C1+14N4+16O23+1H71', '12C49+13C1+14N5+16O16+1H76+31P3', '12C49+13C1+14N5+16O16+1H76+31P3', '12C50+13C1+14N5+16O20+1H70+23Na1', '12C50+13C1+14N6+16O13+1H75+23Na1+31P3', '12C51+13C1+14N2+16O17+1H78+31P3', '12C51+13C1+14N2+16O17+1H78+31P3', '12C51+13C1+14N5+16O14+1H76+31P2+39K1', '12C53+13C1+14N2+16O15+1H78+31P2+39K1', '12C53+13C1+14N4+16O16+1H73+31P2', '12C53+13C1+14N4+16O16+1H73+31P2', '12C54+13C1+14N5+16O13+1H72+23Na1+31P2', '12C55+13C1+14N1+16O17+1H75+31P2', '12C55+13C1+14N1+16O17+1H75+31P2', '12C55+13C1+14N4+16O14+1H73+31P1+39K1', '12C56+13C1+14N2+16O14+1H74+23Na1+31P2', '12C57+13C1+14N1+16O15+1H75+31P1+39K1', '12C57+13C1+14N3+16O16+1H70+31P1', '12C57+13C1+14N3+16O16+1H70+31P1', '12C58+13C1+14N4+16O13+1H69+23Na1+31P1', '12C58+13C1+14N7+16O12+1H66+31P1', '12C59+13C1+14N3+16O14+1H70+39K1', '12C59+13C1+16O17+1H72+31P1', '12C60+13C1+14N1+16O14+1H71+23Na1+31P1', '12C61+13C1+16O15+1H72+39K1', '12C62+13C1+14N3+16O13+1H66+23Na1', '12C62+13C1+14N6+16O12+1H63', '12C62+13C1+14N6+16O12+1H63', '12C63+13C1+16O10+1H74+31P3', '12C64+13C1+16O14+1H68+23Na1', '12C65+13C1+16O8+1H74+31P2+39K1', '12C68+13C1+16O7+1H70+23Na1+31P2', '12C70+13C1+14N3+16O4+1H67+31P1+39K1', '12C72+13C1+14N2+16O6+1H64+31P1', '12C72+13C1+14N2+16O6+1H64+31P1', '12C74+13C1+14N2+16O4+1H64+39K1', '12C76+13C1+14N1+16O6+1H61', '12C76+13C1+14N1+16O6+1H61', '12C77+13C1+14N2+16O3+1H60+23Na1', '12C77+13C1+14N5+16O2+1H57', '12C77+13C1+14N5+16O2+1H57']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C35H81N6O26P3', 'C37H80N2O27P3', 'C37H83N3O27P3', 'C37H82N6O24P2', 'C38H83N4O24P3', 'C39H84N3O25P2', 'C40H78N6O23P2', 'C41H77N1O27P2', 'C41H80N2O27P2', 'C42H80N3O24P2', 'C42H73N5O23P2', 'C43H81N2O25P1', 'C45H74O27P1', 'C45H77N1O27P1', 'C46H77N2O24P1', 'C46H70N4O23P1', 'C46H73N5O23P1', 'C47H78N1O25', 'C47H73N6O20P1', 'C48H74N5O21', 'C48H79N6O14P3', 'C48H65N6O22', 'C49H74O27', 'C50H74N1O24', 'C50H67N3O23', 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0.29190591, 0.29190591, 0.29566899, 0.29566899, 0.29566993, 0.29948153, 0.30345184, 0.30345184, 0.28202976, 0.2890254, 0.30709668, 0.30709668, 0.31060479, 0.31428239, 0.31428239, 0.29209573, 0.31766617, 0.29854915, 0.3172159, 0.3172159, 0.3204373, 0.31783256, 0.3009775, 0.32383878, 0.32694262, 0.30691995, 0.32906159, 0.32638674, 0.32638674, 0.33648528, 0.33504308, 0.31826278, 0.34645344, 0.32431368, 0.34963874, 0.34963874, 0.3294684, 0.35467698, 0.35467698, 0.3567804, 0.35388023, 0.35388023]"},{"Metabolite":"IMF16","adduct":"['14N1+1H4', '1H1', '1H1', '23Na1']","adducted_elemental_formula":"['C35H70N1O4P1', 'C35H70N1O4P1', 'C39H67O4', 'C40H66N1Na1O1']","adducted_isotopic_formula":"['12C34+13C1+14N1+16O4+1H70+31P1', '12C34+13C1+14N1+16O4+1H70+31P1', '12C38+13C1+16O4+1H67', '12C39+13C1+14N1+16O1+1H66+23Na1']","charge":"['1', '1', '1', '1']","elemental_formula":"['C35H66O4P1', 'C35H69N1O4P1', 'C39H66O4', 'C40H66N1O1']","isotopologue":"['13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.25427149, 0.25427149, 0.27248326, 0.27752321]"},{"Metabolite":"IMF1600","adduct":"['1H1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '1H1', '23Na1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C35H82N6O26P3', 'C37H84N3O27P3', 'C37H84N3O27P3', 'C37H82K1N6O24P2', 'C38H83N4Na1O24P3', 'C39H84K1N3O25P2', 'C40H78N6Na1O23P2', 'C41H81N2O27P2', 'C41H81N2O27P2', 'C42H80N3Na1O24P2', 'C42H77N6O23P2', 'C43H81K1N2O25P1', 'C45H78N1O27P1', 'C45H78N1O27P1', 'C46H77N2Na1O24P1', 'C46H74N5O23P1', 'C46H74N5O23P1', 'C47H78K1N1O25', 'C47H73N6Na1O20P1', 'C48H74K1N5O21', 'C48H79K1N6O14P3', 'C48H69N7O22', 'C49H75O27', 'C50H74N1Na1O24', 'C50H71N4O23', 'C50H71N4O23', 'C50H76N5O16P3', 'C50H76N5O16P3', 'C51H70N5Na1O20', 'C51H75N6Na1O13P3', 'C52H78N2O17P3', 'C52H78N2O17P3', 'C52H76K1N5O14P2', 'C54H78K1N2O15P2', 'C54H73N4O16P2', 'C54H73N4O16P2', 'C55H72N5Na1O13P2', 'C56H75N1O17P2', 'C56H75N1O17P2', 'C56H73K1N4O14P1', 'C57H74N2Na1O14P2', 'C58H75K1N1O15P1', 'C58H70N3O16P1', 'C58H70N3O16P1', 'C59H69N4Na1O13P1', 'C59H66N7O12P1', 'C60H70K1N3O14', 'C60H72O17P1', 'C61H71N1Na1O14P1', 'C62H72K1O15', 'C63H66N3Na1O13', 'C63H63N6O12', 'C63H63N6O12', 'C64H74O10P3', 'C65H68Na1O14', 'C66H74K1O8P2', 'C69H70Na1O7P2', 'C71H67K1N3O4P1', 'C73H64N2O6P1', 'C73H64N2O6P1', 'C75H64K1N2O4', 'C77H61N1O6', 'C77H61N1O6', 'C78H60N2Na1O3', 'C78H57N5O2', 'C78H57N5O2']","adducted_isotopic_formula":"['12C33+13C2+14N6+16O26+1H82+31P3', '12C35+13C2+14N3+16O27+1H84+31P3', '12C35+13C2+14N3+16O27+1H84+31P3', '12C35+13C2+14N6+16O24+1H82+31P2+39K1', '12C36+13C2+14N4+16O24+1H83+23Na1+31P3', '12C37+13C2+14N3+16O25+1H84+31P2+39K1', '12C38+13C2+14N6+16O23+1H78+23Na1+31P2', '12C39+13C2+14N2+16O27+1H81+31P2', '12C39+13C2+14N2+16O27+1H81+31P2', '12C40+13C2+14N3+16O24+1H80+23Na1+31P2', '12C40+13C2+14N6+16O23+1H77+31P2', '12C41+13C2+14N2+16O25+1H81+31P1+39K1', '12C43+13C2+14N1+16O27+1H78+31P1', '12C43+13C2+14N1+16O27+1H78+31P1', '12C44+13C2+14N2+16O24+1H77+23Na1+31P1', '12C44+13C2+14N5+16O23+1H74+31P1', '12C44+13C2+14N5+16O23+1H74+31P1', '12C45+13C2+14N1+16O25+1H78+39K1', '12C45+13C2+14N6+16O20+1H73+23Na1+31P1', '12C46+13C2+14N5+16O21+1H74+39K1', '12C46+13C2+14N6+16O14+1H79+31P3+39K1', '12C46+13C2+14N7+16O22+1H69', '12C47+13C2+16O27+1H75', '12C48+13C2+14N1+16O24+1H74+23Na1', '12C48+13C2+14N4+16O23+1H71', '12C48+13C2+14N4+16O23+1H71', '12C48+13C2+14N5+16O16+1H76+31P3', '12C48+13C2+14N5+16O16+1H76+31P3', '12C49+13C2+14N5+16O20+1H70+23Na1', '12C49+13C2+14N6+16O13+1H75+23Na1+31P3', '12C50+13C2+14N2+16O17+1H78+31P3', '12C50+13C2+14N2+16O17+1H78+31P3', '12C50+13C2+14N5+16O14+1H76+31P2+39K1', '12C52+13C2+14N2+16O15+1H78+31P2+39K1', '12C52+13C2+14N4+16O16+1H73+31P2', '12C52+13C2+14N4+16O16+1H73+31P2', '12C53+13C2+14N5+16O13+1H72+23Na1+31P2', '12C54+13C2+14N1+16O17+1H75+31P2', '12C54+13C2+14N1+16O17+1H75+31P2', '12C54+13C2+14N4+16O14+1H73+31P1+39K1', '12C55+13C2+14N2+16O14+1H74+23Na1+31P2', '12C56+13C2+14N1+16O15+1H75+31P1+39K1', '12C56+13C2+14N3+16O16+1H70+31P1', '12C56+13C2+14N3+16O16+1H70+31P1', '12C57+13C2+14N4+16O13+1H69+23Na1+31P1', '12C57+13C2+14N7+16O12+1H66+31P1', '12C58+13C2+14N3+16O14+1H70+39K1', '12C58+13C2+16O17+1H72+31P1', '12C59+13C2+14N1+16O14+1H71+23Na1+31P1', '12C60+13C2+16O15+1H72+39K1', '12C61+13C2+14N3+16O13+1H66+23Na1', '12C61+13C2+14N6+16O12+1H63', '12C61+13C2+14N6+16O12+1H63', '12C62+13C2+16O10+1H74+31P3', '12C63+13C2+16O14+1H68+23Na1', '12C64+13C2+16O8+1H74+31P2+39K1', '12C67+13C2+16O7+1H70+23Na1+31P2', '12C69+13C2+14N3+16O4+1H67+31P1+39K1', '12C71+13C2+14N2+16O6+1H64+31P1', '12C71+13C2+14N2+16O6+1H64+31P1', '12C73+13C2+14N2+16O4+1H64+39K1', '12C75+13C2+14N1+16O6+1H61', '12C75+13C2+14N1+16O6+1H61', '12C76+13C2+14N2+16O3+1H60+23Na1', '12C76+13C2+14N5+16O2+1H57', '12C76+13C2+14N5+16O2+1H57']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C35H81N6O26P3', 'C37H80N2O27P3', 'C37H83N3O27P3', 'C37H82N6O24P2', 'C38H83N4O24P3', 'C39H84N3O25P2', 'C40H78N6O23P2', 'C41H77N1O27P2', 'C41H80N2O27P2', 'C42H80N3O24P2', 'C42H73N5O23P2', 'C43H81N2O25P1', 'C45H74O27P1', 'C45H77N1O27P1', 'C46H77N2O24P1', 'C46H70N4O23P1', 'C46H73N5O23P1', 'C47H78N1O25', 'C47H73N6O20P1', 'C48H74N5O21', 'C48H79N6O14P3', 'C48H65N6O22', 'C49H74O27', 'C50H74N1O24', 'C50H67N3O23', 'C50H70N4O23', 'C50H72N4O16P3', 'C50H75N5O16P3', 'C51H70N5O20', 'C51H75N6O13P3', 'C52H74N1O17P3', 'C52H77N2O17P3', 'C52H76N5O14P2', 'C54H78N2O15P2', 'C54H69N3O16P2', 'C54H72N4O16P2', 'C55H72N5O13P2', 'C56H71O17P2', 'C56H74N1O17P2', 'C56H73N4O14P1', 'C57H74N2O14P2', 'C58H75N1O15P1', 'C58H66N2O16P1', 'C58H69N3O16P1', 'C59H69N4O13P1', 'C59H62N6O12P1', 'C60H70N3O14', 'C60H71O17P1', 'C61H71N1O14P1', 'C62H72O15', 'C63H66N3O13', 'C63H59N5O12', 'C63H62N6O12', 'C64H73O10P3', 'C65H68O14', 'C66H74O8P2', 'C69H70O7P2', 'C71H67N3O4P1', 'C73H60N1O6P1', 'C73H63N2O6P1', 'C75H64N2O4', 'C77H57O6', 'C77H60N1O6', 'C78H60N2O3', 'C78H53N4O2', 'C78H56N5O2']","isotopologue":"['13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.0434549, 0.0480006, 0.0480006, 0.04461202, 0.05031435, 0.04898313, 0.05440341, 0.0568371, 0.0568371, 0.05926323, 0.05878149, 0.05740657, 0.06599315, 0.06599315, 0.06851223, 0.06795531, 0.06795531, 0.06609143, 0.07048113, 0.06792787, 0.06880355, 0.07217505, 0.07539049, 0.0779847, 0.07735079, 0.07735079, 0.07834795, 0.07834795, 0.07994714, 0.08097777, 0.08369234, 0.08369234, 0.07778411, 0.08283953, 0.08801907, 0.08801907, 0.09070426, 0.09347781, 0.09347781, 0.08687877, 0.09620215, 0.09202725, 0.09778125, 0.09778125, 0.10050712, 0.09969013, 0.09603108, 0.10332529, 0.10608368, 0.10124667, 0.11033026, 0.10943342, 0.10943342, 0.114639, 0.11595952, 0.11187292, 0.12740297, 0.1227691, 0.13613751, 0.13613751, 0.13184731, 0.14577142, 0.14577142, 0.14856533, 0.14735769, 0.14735769]"},{"Metabolite":"IMF1601","adduct":"['14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '1H1', '23Na1', '23Na1', '39K1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '23Na1']","adducted_elemental_formula":"['C36H69N3O19P1', 'C36H69N3O19P1', 'C37H68N4Na1O16P1', 'C37H65N7O15P1', 'C38H69K1N3O17', 'C38H71O20P1', 'C40H76K1N1O11P3', 'C40H71K1O18', 'C41H65N3Na1O16', 'C41H62N6O15', 'C41H62N6O15', 'C42H73O13P3', 'C43H72N1Na1O10P3', 'C43H67Na1O17', 'C44H73K1O11P2', 'C47H66N3O9P2', 'C47H66N3O9P2', 'C47H64K1N6O6P1', 'C47H69Na1O10P2', 'C49H66K1N3O7P1', 'C51H63N2O9P1', 'C51H63N2O9P1', 'C52H62N3Na1O6P1', 'C53H63K1N2O7', 'C53H68K1N3P3', 'C55H60N1O9', 'C55H60N1O9', 'C56H59N2Na1O6', 'C58H66Na1P3']","adducted_isotopic_formula":"['12C36+14N3+16O19+1H69+31P1', '12C36+14N3+16O19+1H69+31P1', '12C37+14N4+16O16+1H68+23Na1+31P1', '12C37+14N7+16O15+1H65+31P1', '12C38+14N3+16O17+1H69+39K1', '12C38+16O20+1H71+31P1', '12C40+14N1+16O11+1H76+31P3+39K1', '12C40+16O18+1H71+39K1', '12C41+14N3+16O16+1H65+23Na1', '12C41+14N6+16O15+1H62', '12C41+14N6+16O15+1H62', '12C42+16O13+1H73+31P3', '12C43+14N1+16O10+1H72+23Na1+31P3', '12C43+16O17+1H67+23Na1', '12C44+16O11+1H73+31P2+39K1', '12C47+14N3+16O9+1H66+31P2', '12C47+14N3+16O9+1H66+31P2', '12C47+14N6+16O6+1H64+31P1+39K1', '12C47+16O10+1H69+23Na1+31P2', '12C49+14N3+16O7+1H66+31P1+39K1', '12C51+14N2+16O9+1H63+31P1', '12C51+14N2+16O9+1H63+31P1', '12C52+14N3+16O6+1H62+23Na1+31P1', '12C53+14N2+16O7+1H63+39K1', '12C53+14N3+1H68+31P3+39K1', '12C55+14N1+16O9+1H60', '12C55+14N1+16O9+1H60', '12C56+14N2+16O6+1H59+23Na1', '12C58+1H66+23Na1+31P3']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C36H65N2O19P1', 'C36H68N3O19P1', 'C37H68N4O16P1', 'C37H61N6O15P1', 'C38H69N3O17', 'C38H70O20P1', 'C40H76N1O11P3', 'C40H71O18', 'C41H65N3O16', 'C41H58N5O15', 'C41H61N6O15', 'C42H72O13P3', 'C43H72N1O10P3', 'C43H67O17', 'C44H73O11P2', 'C47H62N2O9P2', 'C47H65N3O9P2', 'C47H64N6O6P1', 'C47H69O10P2', 'C49H66N3O7P1', 'C51H59N1O9P1', 'C51H62N2O9P1', 'C52H62N3O6P1', 'C53H63N2O7', 'C53H68N3P3', 'C55H56O9', 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'39K1', '23Na1', '14N1+1H4', '1H1', '1H1', '23Na1', '23Na1', '39K1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '23Na1']","adducted_elemental_formula":"['C36H69N3O19P1', 'C36H69N3O19P1', 'C37H68N4Na1O16P1', 'C37H65N7O15P1', 'C38H69K1N3O17', 'C38H71O20P1', 'C40H76K1N1O11P3', 'C40H71K1O18', 'C41H65N3Na1O16', 'C41H62N6O15', 'C41H62N6O15', 'C42H73O13P3', 'C43H72N1Na1O10P3', 'C43H67Na1O17', 'C44H73K1O11P2', 'C47H66N3O9P2', 'C47H66N3O9P2', 'C47H64K1N6O6P1', 'C47H69Na1O10P2', 'C49H66K1N3O7P1', 'C51H63N2O9P1', 'C51H63N2O9P1', 'C52H62N3Na1O6P1', 'C53H63K1N2O7', 'C53H68K1N3P3', 'C55H60N1O9', 'C55H60N1O9', 'C56H59N2Na1O6', 'C58H66Na1P3']","adducted_isotopic_formula":"['12C35+13C1+14N3+16O19+1H69+31P1', '12C35+13C1+14N3+16O19+1H69+31P1', '12C36+13C1+14N4+16O16+1H68+23Na1+31P1', '12C36+13C1+14N7+16O15+1H65+31P1', '12C37+13C1+14N3+16O17+1H69+39K1', '12C37+13C1+16O20+1H71+31P1', '12C39+13C1+14N1+16O11+1H76+31P3+39K1', '12C39+13C1+16O18+1H71+39K1', '12C40+13C1+14N3+16O16+1H65+23Na1', '12C40+13C1+14N6+16O15+1H62', '12C40+13C1+14N6+16O15+1H62', '12C41+13C1+16O13+1H73+31P3', '12C42+13C1+14N1+16O10+1H72+23Na1+31P3', '12C42+13C1+16O17+1H67+23Na1', '12C43+13C1+16O11+1H73+31P2+39K1', '12C46+13C1+14N3+16O9+1H66+31P2', '12C46+13C1+14N3+16O9+1H66+31P2', '12C46+13C1+14N6+16O6+1H64+31P1+39K1', '12C46+13C1+16O10+1H69+23Na1+31P2', '12C48+13C1+14N3+16O7+1H66+31P1+39K1', '12C50+13C1+14N2+16O9+1H63+31P1', '12C50+13C1+14N2+16O9+1H63+31P1', '12C51+13C1+14N3+16O6+1H62+23Na1+31P1', '12C52+13C1+14N2+16O7+1H63+39K1', '12C52+13C1+14N3+1H68+31P3+39K1', '12C54+13C1+14N1+16O9+1H60', '12C54+13C1+14N1+16O9+1H60', '12C55+13C1+14N2+16O6+1H59+23Na1', '12C57+13C1+1H66+23Na1+31P3']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C36H65N2O19P1', 'C36H68N3O19P1', 'C37H68N4O16P1', 'C37H61N6O15P1', 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'13C1']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.23738778, 0.25233044]"},{"Metabolite":"IMF1605","adduct":"['14N1+1H4', '1H1', '23Na1', '39K1']","adducted_elemental_formula":"['C38H68N5O8', 'C38H68N5O8', 'C39H67N6Na1O5', 'C46H72K1N2P1']","adducted_isotopic_formula":"['12C38+14N5+16O8+1H68', '12C38+14N5+16O8+1H68', '12C39+14N6+16O5+1H67+23Na1', '12C46+14N2+1H72+31P1+39K1']","charge":"['1', '1', '1', '1']","elemental_formula":"['C38H64N4O8', 'C38H67N5O8', 'C39H67N6O5', 'C46H72N2P1']","isotopologue":"['13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.63488699, 0.63488699, 0.63046434, 0.55977227]"},{"Metabolite":"IMF1606","adduct":"['14N1+1H4', '1H1', '23Na1', '39K1']","adducted_elemental_formula":"['C38H68N5O8', 'C38H68N5O8', 'C39H67N6Na1O5', 'C46H72K1N2P1']","adducted_isotopic_formula":"['12C37+13C1+14N5+16O8+1H68', '12C37+13C1+14N5+16O8+1H68', '12C38+13C1+14N6+16O5+1H67+23Na1', 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'39K1']","adducted_elemental_formula":"['C39H24K1N4O26P3', 'C39H19N6O27P3', 'C41H19K1N6O25P2', 'C42H20N4Na1O25P3', 'C43H21K1N3O26P2', 'C47H18K1N2O26P1', 'C51H20K1N2O19P3']","adducted_isotopic_formula":"['12C39+14N4+16O26+1H24+31P3+39K1', '12C39+14N6+16O27+1H19+31P3', '12C41+14N6+16O25+1H19+31P2+39K1', '12C42+14N4+16O25+1H20+23Na1+31P3', '12C43+14N3+16O26+1H21+31P2+39K1', '12C47+14N2+16O26+1H18+31P1+39K1', '12C51+14N2+16O19+1H20+31P3+39K1']","charge":"['1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C39H24N4O26P3', 'C39H18N6O27P3', 'C41H19N6O25P2', 'C42H20N4O25P3', 'C43H21N3O26P2', 'C47H18N2O26P1', 'C51H20N2O19P3']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.56555287, 0.60091401, 0.5511479, 0.58888038, 0.54389968, 0.52307552, 0.50953366]"},{"Metabolite":"IMF1610","adduct":"['39K1', '1H1', '39K1', '23Na1', '39K1', '39K1', '39K1']","adducted_elemental_formula":"['C39H24K1N4O26P3', 'C39H19N6O27P3', 'C41H19K1N6O25P2', 'C42H20N4Na1O25P3', 'C43H21K1N3O26P2', 'C47H18K1N2O26P1', 'C51H20K1N2O19P3']","adducted_isotopic_formula":"['12C38+13C1+14N4+16O26+1H24+31P3+39K1', '12C38+13C1+14N6+16O27+1H19+31P3', '12C40+13C1+14N6+16O25+1H19+31P2+39K1', '12C41+13C1+14N4+16O25+1H20+23Na1+31P3', '12C42+13C1+14N3+16O26+1H21+31P2+39K1', '12C46+13C1+14N2+16O26+1H18+31P1+39K1', '12C50+13C1+14N2+16O19+1H20+31P3+39K1']","charge":"['1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C39H24N4O26P3', 'C39H18N6O27P3', 'C41H19N6O25P2', 'C42H20N4O25P3', 'C43H21N3O26P2', 'C47H18N2O26P1', 'C51H20N2O19P3']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.23855778, 0.25347359, 0.2444037, 0.26750515, 0.25295486, 0.26589981, 0.28105986]"},{"Metabolite":"IMF1611","adduct":"14N1+1H4","adducted_elemental_formula":"C21H30N1O5","adducted_isotopic_formula":"12C21+14N1+16O5+1H30","charge":"1","elemental_formula":"C21H26O5","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.7825696"},{"Metabolite":"IMF1612","adduct":"14N1+1H4","adducted_elemental_formula":"C21H30N1O5","adducted_isotopic_formula":"12C20+13C1+14N1+16O5+1H30","charge":"1","elemental_formula":"C21H26O5","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.17774526"},{"Metabolite":"IMF1613","adduct":"['23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C21H56N6Na1O9P2', 'C26H56N1O13P1', 'C26H56N1O13P1', 'C29H47N7O8', 'C30H53O13', 'C31H52N1Na1O10', 'C37H51K1N4P1', 'C41H48K1N3', 'C43H45N2O2', 'C43H45N2O2']","adducted_isotopic_formula":"['12C21+14N6+16O9+1H56+23Na1+31P2', '12C26+14N1+16O13+1H56+31P1', '12C26+14N1+16O13+1H56+31P1', '12C29+14N7+16O8+1H47', '12C30+16O13+1H53', '12C31+14N1+16O10+1H52+23Na1', '12C37+14N4+1H51+31P1+39K1', '12C41+14N3+1H48+39K1', '12C43+14N2+16O2+1H45', '12C43+14N2+16O2+1H45']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C21H56N6O9P2', 'C26H52O13P1', 'C26H55N1O13P1', 'C29H43N6O8', 'C30H52O13', 'C31H52N1O10', 'C37H51N4P1', 'C41H48N3', 'C43H41N1O2', 'C43H44N2O2']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.7587161, 0.7251226, 0.7251226, 0.69602653, 0.69736001, 0.69250217, 0.61367828, 0.59018252, 0.61883678, 0.61883678]"},{"Metabolite":"IMF1614","adduct":"['23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C21H56N6Na1O9P2', 'C26H56N1O13P1', 'C26H56N1O13P1', 'C29H47N7O8', 'C30H53O13', 'C31H52N1Na1O10', 'C37H51K1N4P1', 'C41H48K1N3', 'C43H45N2O2', 'C43H45N2O2']","adducted_isotopic_formula":"['12C20+13C1+14N6+16O9+1H56+23Na1+31P2', '12C25+13C1+14N1+16O13+1H56+31P1', '12C25+13C1+14N1+16O13+1H56+31P1', '12C28+13C1+14N7+16O8+1H47', '12C29+13C1+16O13+1H53', '12C30+13C1+14N1+16O10+1H52+23Na1', '12C36+13C1+14N4+1H51+31P1+39K1', '12C40+13C1+14N3+1H48+39K1', '12C42+13C1+14N2+16O2+1H45', '12C42+13C1+14N2+16O2+1H45']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C21H56N6O9P2', 'C26H52O13P1', 'C26H55N1O13P1', 'C29H43N6O8', 'C30H52O13', 'C31H52N1O10', 'C37H51N4P1', 'C41H48N3', 'C43H41N1O2', 'C43H44N2O2']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.17232741, 0.20391096, 0.20391096, 0.21831298, 0.22627369, 0.23218737, 0.24558297, 0.26171341, 0.28780633, 0.28780633]"},{"Metabolite":"IMF1615","adduct":"['39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '14N1+1H4', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C42H88K1N4O22P3', 'C43H77N6Na1O27', 'C44H85N3O24P3', 'C44H85N3O24P3', 'C45H84N4Na1O21P3', 'C45H81N7O20P3', 'C46H85K1N3O22P2', 'C46H87O25P3', 'C48H82N2O24P2', 'C48H82N2O24P2', 'C48H87K1O23P2', 'C49H81N3Na1O21P2', 'C49H78N6O20P2', 'C49H78N6O20P2', 'C50H82K1N2O22P1', 'C51H78K1N6O18P1', 'C51H83Na1O22P2', 'C52H79N1O24P1', 'C52H79N1O24P1', 'C53H78N2Na1O21P1', 'C53H75N5O20P1', 'C53H75N5O20P1', 'C54H79K1N1O22', 'C54H74N6Na1O17P1', 'C55H75K1N5O18', 'C55H80K1N6O11P3', 'C57H75N1Na1O21', 'C57H82K1N3O12P3', 'C57H72N4O20', 'C57H72N4O20', 'C57H77N5O13P3', 'C57H77N5O13P3', 'C58H71N5Na1O17', 'C58H76N6Na1O10P3', 'C59H79N2O14P3', 'C59H79N2O14P3', 'C59H77K1N5O11P2', 'C60H78N3Na1O11P3', 'C61H79K1N2O12P2', 'C61H74N4O13P2', 'C62H73N5Na1O10P2', 'C63H76N1O14P2', 'C63H76N1O14P2', 'C63H74K1N4O11P1', 'C64H75N2Na1O11P2', 'C65H76K1N1O12P1', 'C66H67N7O9P1', 'C67H73O14P1', 'C68H72N1Na1O11P1', 'C68H69N4O10P1', 'C68H69N4O10P1', 'C69H73K1O12', 'C70H64N6O9', 'C70H64N6O9', 'C72H66N3O10', 'C72H66N3O10', 'C72H69Na1O11', 'C73H65N4Na1O7', 'C73H70N5Na1P3', 'C77H67N4Na1P2', 'C81H64N3Na1P1', 'C82H65K1N2O1', 'C84H62N1O3', 'C84H62N1O3', 'C85H61N2Na1']","adducted_isotopic_formula":"['12C42+14N4+16O22+1H88+31P3+39K1', '12C43+14N6+16O27+1H77+23Na1', '12C44+14N3+16O24+1H85+31P3', '12C44+14N3+16O24+1H85+31P3', '12C45+14N4+16O21+1H84+23Na1+31P3', '12C45+14N7+16O20+1H81+31P3', '12C46+14N3+16O22+1H85+31P2+39K1', '12C46+16O25+1H87+31P3', '12C48+14N2+16O24+1H82+31P2', '12C48+14N2+16O24+1H82+31P2', '12C48+16O23+1H87+31P2+39K1', '12C49+14N3+16O21+1H81+23Na1+31P2', '12C49+14N6+16O20+1H78+31P2', '12C49+14N6+16O20+1H78+31P2', '12C50+14N2+16O22+1H82+31P1+39K1', '12C51+14N6+16O18+1H78+31P1+39K1', '12C51+16O22+1H83+23Na1+31P2', '12C52+14N1+16O24+1H79+31P1', '12C52+14N1+16O24+1H79+31P1', '12C53+14N2+16O21+1H78+23Na1+31P1', '12C53+14N5+16O20+1H75+31P1', '12C53+14N5+16O20+1H75+31P1', '12C54+14N1+16O22+1H79+39K1', '12C54+14N6+16O17+1H74+23Na1+31P1', '12C55+14N5+16O18+1H75+39K1', '12C55+14N6+16O11+1H80+31P3+39K1', '12C57+14N1+16O21+1H75+23Na1', '12C57+14N3+16O12+1H82+31P3+39K1', '12C57+14N4+16O20+1H72', '12C57+14N4+16O20+1H72', '12C57+14N5+16O13+1H77+31P3', '12C57+14N5+16O13+1H77+31P3', '12C58+14N5+16O17+1H71+23Na1', '12C58+14N6+16O10+1H76+23Na1+31P3', '12C59+14N2+16O14+1H79+31P3', '12C59+14N2+16O14+1H79+31P3', '12C59+14N5+16O11+1H77+31P2+39K1', '12C60+14N3+16O11+1H78+23Na1+31P3', '12C61+14N2+16O12+1H79+31P2+39K1', '12C61+14N4+16O13+1H74+31P2', '12C62+14N5+16O10+1H73+23Na1+31P2', '12C63+14N1+16O14+1H76+31P2', '12C63+14N1+16O14+1H76+31P2', '12C63+14N4+16O11+1H74+31P1+39K1', '12C64+14N2+16O11+1H75+23Na1+31P2', '12C65+14N1+16O12+1H76+31P1+39K1', '12C66+14N7+16O9+1H67+31P1', '12C67+16O14+1H73+31P1', '12C68+14N1+16O11+1H72+23Na1+31P1', '12C68+14N4+16O10+1H69+31P1', '12C68+14N4+16O10+1H69+31P1', '12C69+16O12+1H73+39K1', '12C70+14N6+16O9+1H64', '12C70+14N6+16O9+1H64', '12C72+14N3+16O10+1H66', '12C72+14N3+16O10+1H66', '12C72+16O11+1H69+23Na1', '12C73+14N4+16O7+1H65+23Na1', '12C73+14N5+1H70+23Na1+31P3', '12C77+14N4+1H67+23Na1+31P2', '12C81+14N3+1H64+23Na1+31P1', '12C82+14N2+16O1+1H65+39K1', '12C84+14N1+16O3+1H62', '12C84+14N1+16O3+1H62', '12C85+14N2+1H61+23Na1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C42H88N4O22P3', 'C43H77N6O27', 'C44H81N2O24P3', 'C44H84N3O24P3', 'C45H84N4O21P3', 'C45H77N6O20P3', 'C46H85N3O22P2', 'C46H86O25P3', 'C48H78N1O24P2', 'C48H81N2O24P2', 'C48H87O23P2', 'C49H81N3O21P2', 'C49H74N5O20P2', 'C49H77N6O20P2', 'C50H82N2O22P1', 'C51H78N6O18P1', 'C51H83O22P2', 'C52H75O24P1', 'C52H78N1O24P1', 'C53H78N2O21P1', 'C53H71N4O20P1', 'C53H74N5O20P1', 'C54H79N1O22', 'C54H74N6O17P1', 'C55H75N5O18', 'C55H80N6O11P3', 'C57H75N1O21', 'C57H82N3O12P3', 'C57H68N3O20', 'C57H71N4O20', 'C57H73N4O13P3', 'C57H76N5O13P3', 'C58H71N5O17', 'C58H76N6O10P3', 'C59H75N1O14P3', 'C59H78N2O14P3', 'C59H77N5O11P2', 'C60H78N3O11P3', 'C61H79N2O12P2', 'C61H70N3O13P2', 'C62H73N5O10P2', 'C63H72O14P2', 'C63H75N1O14P2', 'C63H74N4O11P1', 'C64H75N2O11P2', 'C65H76N1O12P1', 'C66H63N6O9P1', 'C67H72O14P1', 'C68H72N1O11P1', 'C68H65N3O10P1', 'C68H68N4O10P1', 'C69H73O12', 'C70H60N5O9', 'C70H63N6O9', 'C72H62N2O10', 'C72H65N3O10', 'C72H69O11', 'C73H65N4O7', 'C73H70N5P3', 'C77H67N4P2', 'C81H64N3P1', 'C82H65N2O1', 'C84H58O3', 'C84H61N1O3', 'C85H61N2']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', 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0.44157332, 0.44519216, 0.4384973, 0.44415015, 0.42714508, 0.41079107, 0.37941345, 0.39783454, 0.39783454, 0.39506321]"},{"Metabolite":"IMF1616","adduct":"['39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '14N1+1H4', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C42H88K1N4O22P3', 'C43H77N6Na1O27', 'C44H85N3O24P3', 'C44H85N3O24P3', 'C45H84N4Na1O21P3', 'C45H81N7O20P3', 'C46H85K1N3O22P2', 'C46H87O25P3', 'C48H82N2O24P2', 'C48H82N2O24P2', 'C48H87K1O23P2', 'C49H81N3Na1O21P2', 'C49H78N6O20P2', 'C49H78N6O20P2', 'C50H82K1N2O22P1', 'C51H78K1N6O18P1', 'C51H83Na1O22P2', 'C52H79N1O24P1', 'C52H79N1O24P1', 'C53H78N2Na1O21P1', 'C53H75N5O20P1', 'C53H75N5O20P1', 'C54H79K1N1O22', 'C54H74N6Na1O17P1', 'C55H75K1N5O18', 'C55H80K1N6O11P3', 'C57H75N1Na1O21', 'C57H82K1N3O12P3', 'C57H72N4O20', 'C57H72N4O20', 'C57H77N5O13P3', 'C57H77N5O13P3', 'C58H71N5Na1O17', 'C58H76N6Na1O10P3', 'C59H79N2O14P3', 'C59H79N2O14P3', 'C59H77K1N5O11P2', 'C60H78N3Na1O11P3', 'C61H79K1N2O12P2', 'C61H74N4O13P2', 'C62H73N5Na1O10P2', 'C63H76N1O14P2', 'C63H76N1O14P2', 'C63H74K1N4O11P1', 'C64H75N2Na1O11P2', 'C65H76K1N1O12P1', 'C66H67N7O9P1', 'C67H73O14P1', 'C68H72N1Na1O11P1', 'C68H69N4O10P1', 'C68H69N4O10P1', 'C69H73K1O12', 'C70H64N6O9', 'C70H64N6O9', 'C72H66N3O10', 'C72H66N3O10', 'C72H69Na1O11', 'C73H65N4Na1O7', 'C73H70N5Na1P3', 'C77H67N4Na1P2', 'C81H64N3Na1P1', 'C82H65K1N2O1', 'C84H62N1O3', 'C84H62N1O3', 'C85H61N2Na1']","adducted_isotopic_formula":"['12C41+13C1+14N4+16O22+1H88+31P3+39K1', '12C42+13C1+14N6+16O27+1H77+23Na1', '12C43+13C1+14N3+16O24+1H85+31P3', '12C43+13C1+14N3+16O24+1H85+31P3', '12C44+13C1+14N4+16O21+1H84+23Na1+31P3', '12C44+13C1+14N7+16O20+1H81+31P3', '12C45+13C1+14N3+16O22+1H85+31P2+39K1', '12C45+13C1+16O25+1H87+31P3', '12C47+13C1+14N2+16O24+1H82+31P2', '12C47+13C1+14N2+16O24+1H82+31P2', '12C47+13C1+16O23+1H87+31P2+39K1', '12C48+13C1+14N3+16O21+1H81+23Na1+31P2', '12C48+13C1+14N6+16O20+1H78+31P2', '12C48+13C1+14N6+16O20+1H78+31P2', '12C49+13C1+14N2+16O22+1H82+31P1+39K1', '12C50+13C1+14N6+16O18+1H78+31P1+39K1', '12C50+13C1+16O22+1H83+23Na1+31P2', '12C51+13C1+14N1+16O24+1H79+31P1', '12C51+13C1+14N1+16O24+1H79+31P1', '12C52+13C1+14N2+16O21+1H78+23Na1+31P1', '12C52+13C1+14N5+16O20+1H75+31P1', '12C52+13C1+14N5+16O20+1H75+31P1', '12C53+13C1+14N1+16O22+1H79+39K1', '12C53+13C1+14N6+16O17+1H74+23Na1+31P1', '12C54+13C1+14N5+16O18+1H75+39K1', '12C54+13C1+14N6+16O11+1H80+31P3+39K1', '12C56+13C1+14N1+16O21+1H75+23Na1', '12C56+13C1+14N3+16O12+1H82+31P3+39K1', '12C56+13C1+14N4+16O20+1H72', '12C56+13C1+14N4+16O20+1H72', '12C56+13C1+14N5+16O13+1H77+31P3', '12C56+13C1+14N5+16O13+1H77+31P3', '12C57+13C1+14N5+16O17+1H71+23Na1', '12C57+13C1+14N6+16O10+1H76+23Na1+31P3', '12C58+13C1+14N2+16O14+1H79+31P3', '12C58+13C1+14N2+16O14+1H79+31P3', '12C58+13C1+14N5+16O11+1H77+31P2+39K1', '12C59+13C1+14N3+16O11+1H78+23Na1+31P3', '12C60+13C1+14N2+16O12+1H79+31P2+39K1', '12C60+13C1+14N4+16O13+1H74+31P2', '12C61+13C1+14N5+16O10+1H73+23Na1+31P2', '12C62+13C1+14N1+16O14+1H76+31P2', '12C62+13C1+14N1+16O14+1H76+31P2', '12C62+13C1+14N4+16O11+1H74+31P1+39K1', '12C63+13C1+14N2+16O11+1H75+23Na1+31P2', '12C64+13C1+14N1+16O12+1H76+31P1+39K1', '12C65+13C1+14N7+16O9+1H67+31P1', '12C66+13C1+16O14+1H73+31P1', '12C67+13C1+14N1+16O11+1H72+23Na1+31P1', '12C67+13C1+14N4+16O10+1H69+31P1', '12C67+13C1+14N4+16O10+1H69+31P1', '12C68+13C1+16O12+1H73+39K1', '12C69+13C1+14N6+16O9+1H64', '12C69+13C1+14N6+16O9+1H64', '12C71+13C1+14N3+16O10+1H66', '12C71+13C1+14N3+16O10+1H66', '12C71+13C1+16O11+1H69+23Na1', '12C72+13C1+14N4+16O7+1H65+23Na1', '12C72+13C1+14N5+1H70+23Na1+31P3', '12C76+13C1+14N4+1H67+23Na1+31P2', '12C80+13C1+14N3+1H64+23Na1+31P1', '12C81+13C1+14N2+16O1+1H65+39K1', '12C83+13C1+14N1+16O3+1H62', '12C83+13C1+14N1+16O3+1H62', '12C84+13C1+14N2+1H61+23Na1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C42H88N4O22P3', 'C43H77N6O27', 'C44H81N2O24P3', 'C44H84N3O24P3', 'C45H84N4O21P3', 'C45H77N6O20P3', 'C46H85N3O22P2', 'C46H86O25P3', 'C48H78N1O24P2', 'C48H81N2O24P2', 'C48H87O23P2', 'C49H81N3O21P2', 'C49H74N5O20P2', 'C49H77N6O20P2', 'C50H82N2O22P1', 'C51H78N6O18P1', 'C51H83O22P2', 'C52H75O24P1', 'C52H78N1O24P1', 'C53H78N2O21P1', 'C53H71N4O20P1', 'C53H74N5O20P1', 'C54H79N1O22', 'C54H74N6O17P1', 'C55H75N5O18', 'C55H80N6O11P3', 'C57H75N1O21', 'C57H82N3O12P3', 'C57H68N3O20', 'C57H71N4O20', 'C57H73N4O13P3', 'C57H76N5O13P3', 'C58H71N5O17', 'C58H76N6O10P3', 'C59H75N1O14P3', 'C59H78N2O14P3', 'C59H77N5O11P2', 'C60H78N3O11P3', 'C61H79N2O12P2', 'C61H70N3O13P2', 'C62H73N5O10P2', 'C63H72O14P2', 'C63H75N1O14P2', 'C63H74N4O11P1', 'C64H75N2O11P2', 'C65H76N1O12P1', 'C66H63N6O9P1', 'C67H72O14P1', 'C68H72N1O11P1', 'C68H65N3O10P1', 'C68H68N4O10P1', 'C69H73O12', 'C70H60N5O9', 'C70H63N6O9', 'C72H62N2O10', 'C72H65N3O10', 'C72H69O11', 'C73H65N4O7', 'C73H70N5P3', 'C77H67N4P2', 'C81H64N3P1', 'C82H65N2O1', 'C84H58O3', 'C84H61N1O3', 'C85H61N2']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.24934013, 0.26592042, 0.27389578, 0.27389578, 0.27816935, 0.27590819, 0.2626312, 0.28257983, 0.28735549, 0.28735549, 0.27044589, 0.29129863, 0.28893074, 0.28893074, 0.27453903, 0.27581868, 0.2992011, 0.29938304, 0.29938304, 0.30301479, 0.30055166, 0.30055166, 0.28515004, 0.30408929, 0.28606306, 0.28975082, 0.31340679, 0.2963381, 0.31085919, 0.31085919, 0.31486661, 0.31486661, 0.31410941, 0.31815873, 0.32162842, 0.32162842, 0.29892317, 0.32480129, 0.30499173, 0.3240613, 0.32707935, 0.33028477, 0.33028477, 0.30696843, 0.33319008, 0.31254832, 0.3321286, 0.3378068, 0.34046039, 0.33769289, 0.33769289, 0.3190792, 0.33877081, 0.33877081, 0.34386746, 0.34386746, 0.34668558, 0.34621474, 0.35067793, 0.35573115, 0.35988337, 0.33649788, 0.36144111, 0.36144111, 0.36319619]"},{"Metabolite":"IMF1617","adduct":"['39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '14N1+1H4', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C42H88K1N4O22P3', 'C43H77N6Na1O27', 'C44H85N3O24P3', 'C44H85N3O24P3', 'C45H84N4Na1O21P3', 'C45H81N7O20P3', 'C46H85K1N3O22P2', 'C46H87O25P3', 'C48H82N2O24P2', 'C48H82N2O24P2', 'C48H87K1O23P2', 'C49H81N3Na1O21P2', 'C49H78N6O20P2', 'C49H78N6O20P2', 'C50H82K1N2O22P1', 'C51H78K1N6O18P1', 'C51H83Na1O22P2', 'C52H79N1O24P1', 'C52H79N1O24P1', 'C53H78N2Na1O21P1', 'C53H75N5O20P1', 'C53H75N5O20P1', 'C54H79K1N1O22', 'C54H74N6Na1O17P1', 'C55H75K1N5O18', 'C55H80K1N6O11P3', 'C57H75N1Na1O21', 'C57H82K1N3O12P3', 'C57H72N4O20', 'C57H72N4O20', 'C57H77N5O13P3', 'C57H77N5O13P3', 'C58H71N5Na1O17', 'C58H76N6Na1O10P3', 'C59H79N2O14P3', 'C59H79N2O14P3', 'C59H77K1N5O11P2', 'C60H78N3Na1O11P3', 'C61H79K1N2O12P2', 'C61H74N4O13P2', 'C62H73N5Na1O10P2', 'C63H76N1O14P2', 'C63H76N1O14P2', 'C63H74K1N4O11P1', 'C64H75N2Na1O11P2', 'C65H76K1N1O12P1', 'C66H67N7O9P1', 'C67H73O14P1', 'C68H72N1Na1O11P1', 'C68H69N4O10P1', 'C69H73K1O12', 'C70H64N6O9', 'C70H64N6O9', 'C72H66N3O10', 'C72H66N3O10', 'C72H69Na1O11', 'C73H65N4Na1O7', 'C73H70N5Na1P3', 'C77H67N4Na1P2', 'C81H64N3Na1P1', 'C82H65K1N2O1', 'C84H62N1O3', 'C84H62N1O3', 'C85H61N2Na1']","adducted_isotopic_formula":"['12C40+13C2+14N4+16O22+1H88+31P3+39K1', '12C41+13C2+14N6+16O27+1H77+23Na1', '12C42+13C2+14N3+16O24+1H85+31P3', '12C42+13C2+14N3+16O24+1H85+31P3', '12C43+13C2+14N4+16O21+1H84+23Na1+31P3', '12C43+13C2+14N7+16O20+1H81+31P3', '12C44+13C2+14N3+16O22+1H85+31P2+39K1', '12C44+13C2+16O25+1H87+31P3', '12C46+13C2+14N2+16O24+1H82+31P2', '12C46+13C2+14N2+16O24+1H82+31P2', '12C46+13C2+16O23+1H87+31P2+39K1', '12C47+13C2+14N3+16O21+1H81+23Na1+31P2', '12C47+13C2+14N6+16O20+1H78+31P2', '12C47+13C2+14N6+16O20+1H78+31P2', '12C48+13C2+14N2+16O22+1H82+31P1+39K1', '12C49+13C2+14N6+16O18+1H78+31P1+39K1', '12C49+13C2+16O22+1H83+23Na1+31P2', '12C50+13C2+14N1+16O24+1H79+31P1', 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'14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C35H71N1Na1O25', 'C35H68N4O24', 'C35H68N4O24', 'C35H73N5O17P3', 'C35H73N5O17P3', 'C36H72N6Na1O14P3', 'C37H73K1N5O15P2', 'C40H69N5Na1O14P2', 'C41H72N1O18P2', 'C41H72N1O18P2', 'C41H70K1N4O15P1', 'C43H72K1N1O16P1', 'C44H63N7O13P1', 'C45H69O18P1', 'C46H68N1Na1O15P1', 'C47H69K1O16', 'C48H60N6O13', 'C48H60N6O13', 'C50H65Na1O15', 'C54H64N3O7P2', 'C54H64N3O7P2', 'C56H64K1N3O5P1', 'C58H61N2O7P1', 'C58H61N2O7P1', 'C59H60N3Na1O4P1', 'C60H61K1N2O5', 'C62H58N1O7', 'C62H58N1O7', 'C63H57N2Na1O4', 'C63H54N5O3', 'C63H54N5O3']","adducted_isotopic_formula":"['12C35+14N1+16O25+1H71+23Na1', '12C35+14N4+16O24+1H68', '12C35+14N4+16O24+1H68', '12C35+14N5+16O17+1H73+31P3', '12C35+14N5+16O17+1H73+31P3', '12C36+14N6+16O14+1H72+23Na1+31P3', '12C37+14N5+16O15+1H73+31P2+39K1', '12C40+14N5+16O14+1H69+23Na1+31P2', '12C41+14N1+16O18+1H72+31P2', '12C41+14N1+16O18+1H72+31P2', '12C41+14N4+16O15+1H70+31P1+39K1', '12C43+14N1+16O16+1H72+31P1+39K1', '12C44+14N7+16O13+1H63+31P1', '12C45+16O18+1H69+31P1', '12C46+14N1+16O15+1H68+23Na1+31P1', '12C47+16O16+1H69+39K1', '12C48+14N6+16O13+1H60', '12C48+14N6+16O13+1H60', '12C50+16O15+1H65+23Na1', '12C54+14N3+16O7+1H64+31P2', '12C54+14N3+16O7+1H64+31P2', '12C56+14N3+16O5+1H64+31P1+39K1', '12C58+14N2+16O7+1H61+31P1', '12C58+14N2+16O7+1H61+31P1', '12C59+14N3+16O4+1H60+23Na1+31P1', '12C60+14N2+16O5+1H61+39K1', '12C62+14N1+16O7+1H58', '12C62+14N1+16O7+1H58', '12C63+14N2+16O4+1H57+23Na1', '12C63+14N5+16O3+1H54', '12C63+14N5+16O3+1H54']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C35H71N1O25', 'C35H64N3O24', 'C35H67N4O24', 'C35H69N4O17P3', 'C35H72N5O17P3', 'C36H72N6O14P3', 'C37H73N5O15P2', 'C40H69N5O14P2', 'C41H68O18P2', 'C41H71N1O18P2', 'C41H70N4O15P1', 'C43H72N1O16P1', 'C44H59N6O13P1', 'C45H68O18P1', 'C46H68N1O15P1', 'C47H69O16', 'C48H56N5O13', 'C48H59N6O13', 'C50H65O15', 'C54H60N2O7P2', 'C54H63N3O7P2', 'C56H64N3O5P1', 'C58H57N1O7P1', 'C58H60N2O7P1', 'C59H60N3O4P1', 'C60H61N2O5', 'C62H54O7', 'C62H57N1O7', 'C63H57N2O4', 'C63H50N4O3', 'C63H53N5O3']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.6381678, 0.63298031, 0.63298031, 0.64114032, 0.64114032, 0.63667411, 0.58804276, 0.61229791, 0.60848424, 0.60848424, 0.56552851, 0.55809117, 0.58406836, 0.58518734, 0.5811109, 0.53672367, 0.56170628, 0.56170628, 0.55886205, 0.53996848, 0.53996848, 0.49524971, 0.51929484, 0.51929484, 0.51567741, 0.4762882, 0.49941272, 0.49941272, 0.49593379, 0.49190248, 0.49190248]"},{"Metabolite":"IMF2988","adduct":"['23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C35H71N1Na1O25', 'C35H68N4O24', 'C35H68N4O24', 'C35H73N5O17P3', 'C35H73N5O17P3', 'C36H72N6Na1O14P3', 'C37H73K1N5O15P2', 'C40H69N5Na1O14P2', 'C41H72N1O18P2', 'C41H72N1O18P2', 'C41H70K1N4O15P1', 'C43H72K1N1O16P1', 'C44H63N7O13P1', 'C45H69O18P1', 'C46H68N1Na1O15P1', 'C47H69K1O16', 'C48H60N6O13', 'C48H60N6O13', 'C50H65Na1O15', 'C54H64N3O7P2', 'C54H64N3O7P2', 'C56H64K1N3O5P1', 'C58H61N2O7P1', 'C58H61N2O7P1', 'C59H60N3Na1O4P1', 'C60H61K1N2O5', 'C62H58N1O7', 'C62H58N1O7', 'C63H57N2Na1O4', 'C63H54N5O3', 'C63H54N5O3']","adducted_isotopic_formula":"['12C34+13C1+14N1+16O25+1H71+23Na1', '12C34+13C1+14N4+16O24+1H68', '12C34+13C1+14N4+16O24+1H68', '12C34+13C1+14N5+16O17+1H73+31P3', '12C34+13C1+14N5+16O17+1H73+31P3', '12C35+13C1+14N6+16O14+1H72+23Na1+31P3', '12C36+13C1+14N5+16O15+1H73+31P2+39K1', '12C39+13C1+14N5+16O14+1H69+23Na1+31P2', '12C40+13C1+14N1+16O18+1H72+31P2', '12C40+13C1+14N1+16O18+1H72+31P2', '12C40+13C1+14N4+16O15+1H70+31P1+39K1', '12C42+13C1+14N1+16O16+1H72+31P1+39K1', '12C43+13C1+14N7+16O13+1H63+31P1', '12C44+13C1+16O18+1H69+31P1', '12C45+13C1+14N1+16O15+1H68+23Na1+31P1', '12C46+13C1+16O16+1H69+39K1', '12C47+13C1+14N6+16O13+1H60', '12C47+13C1+14N6+16O13+1H60', '12C49+13C1+16O15+1H65+23Na1', '12C53+13C1+14N3+16O7+1H64+31P2', '12C53+13C1+14N3+16O7+1H64+31P2', '12C55+13C1+14N3+16O5+1H64+31P1+39K1', '12C57+13C1+14N2+16O7+1H61+31P1', '12C57+13C1+14N2+16O7+1H61+31P1', '12C58+13C1+14N3+16O4+1H60+23Na1+31P1', '12C59+13C1+14N2+16O5+1H61+39K1', '12C61+13C1+14N1+16O7+1H58', '12C61+13C1+14N1+16O7+1H58', '12C62+13C1+14N2+16O4+1H57+23Na1', '12C62+13C1+14N5+16O3+1H54', '12C62+13C1+14N5+16O3+1H54']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C35H71N1O25', 'C35H64N3O24', 'C35H67N4O24', 'C35H69N4O17P3', 'C35H72N5O17P3', 'C36H72N6O14P3', 'C37H73N5O15P2', 'C40H69N5O14P2', 'C41H68O18P2', 'C41H71N1O18P2', 'C41H70N4O15P1', 'C43H72N1O16P1', 'C44H59N6O13P1', 'C45H68O18P1', 'C46H68N1O15P1', 'C47H69O16', 'C48H56N5O13', 'C48H59N6O13', 'C50H65O15', 'C54H60N2O7P2', 'C54H63N3O7P2', 'C56H64N3O5P1', 'C58H57N1O7P1', 'C58H60N2O7P1', 'C59H60N3O4P1', 'C60H61N2O5', 'C62H54O7', 'C62H57N1O7', 'C63H57N2O4', 'C63H50N4O3', 'C63H53N5O3']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.24157873, 0.23961501, 0.23961501, 0.24270398, 0.24270398, 0.24789939, 0.2353241, 0.26489791, 0.26982921, 0.26982921, 0.25078071, 0.25955499, 0.27795349, 0.28481523, 0.28911633, 0.2728377, 0.2916126, 0.2916126, 0.302225, 0.31536823, 0.31536823, 0.29996323, 0.32576001, 0.32576001, 0.32906818, 0.30908423, 0.33489376, 0.33489376, 0.33792476, 0.33517786, 0.33517786]"},{"Metabolite":"IMF2989","adduct":"['23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C35H71N1Na1O25', 'C35H68N4O24', 'C35H68N4O24', 'C35H73N5O17P3', 'C35H73N5O17P3', 'C36H72N6Na1O14P3', 'C37H73K1N5O15P2', 'C40H69N5Na1O14P2', 'C41H72N1O18P2', 'C41H72N1O18P2', 'C41H70K1N4O15P1', 'C43H72K1N1O16P1', 'C44H63N7O13P1', 'C45H69O18P1', 'C46H68N1Na1O15P1', 'C47H69K1O16', 'C48H60N6O13', 'C48H60N6O13', 'C50H65Na1O15', 'C54H64N3O7P2', 'C54H64N3O7P2', 'C56H64K1N3O5P1', 'C58H61N2O7P1', 'C58H61N2O7P1', 'C59H60N3Na1O4P1', 'C60H61K1N2O5', 'C62H58N1O7', 'C62H58N1O7', 'C63H57N2Na1O4', 'C63H54N5O3', 'C63H54N5O3']","adducted_isotopic_formula":"['12C33+13C2+14N1+16O25+1H71+23Na1', '12C33+13C2+14N4+16O24+1H68', '12C33+13C2+14N4+16O24+1H68', '12C33+13C2+14N5+16O17+1H73+31P3', '12C33+13C2+14N5+16O17+1H73+31P3', '12C34+13C2+14N6+16O14+1H72+23Na1+31P3', '12C35+13C2+14N5+16O15+1H73+31P2+39K1', '12C38+13C2+14N5+16O14+1H69+23Na1+31P2', '12C39+13C2+14N1+16O18+1H72+31P2', '12C39+13C2+14N1+16O18+1H72+31P2', '12C39+13C2+14N4+16O15+1H70+31P1+39K1', '12C41+13C2+14N1+16O16+1H72+31P1+39K1', '12C42+13C2+14N7+16O13+1H63+31P1', '12C43+13C2+16O18+1H69+31P1', '12C44+13C2+14N1+16O15+1H68+23Na1+31P1', '12C45+13C2+16O16+1H69+39K1', '12C46+13C2+14N6+16O13+1H60', '12C46+13C2+14N6+16O13+1H60', '12C48+13C2+16O15+1H65+23Na1', '12C52+13C2+14N3+16O7+1H64+31P2', '12C52+13C2+14N3+16O7+1H64+31P2', '12C54+13C2+14N3+16O5+1H64+31P1+39K1', '12C56+13C2+14N2+16O7+1H61+31P1', '12C56+13C2+14N2+16O7+1H61+31P1', '12C57+13C2+14N3+16O4+1H60+23Na1+31P1', '12C58+13C2+14N2+16O5+1H61+39K1', '12C60+13C2+14N1+16O7+1H58', '12C60+13C2+14N1+16O7+1H58', '12C61+13C2+14N2+16O4+1H57+23Na1', '12C61+13C2+14N5+16O3+1H54', '12C61+13C2+14N5+16O3+1H54']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', 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'12C33+13C2+14N4+16O16+1H64+23Na1+31P1', '12C33+13C2+14N7+16O15+1H61+31P1', '12C34+13C2+14N3+16O17+1H65+39K1', '12C34+13C2+16O20+1H67+31P1', '12C36+13C2+14N1+16O11+1H72+31P3+39K1', '12C36+13C2+16O18+1H67+39K1', '12C37+13C2+14N6+16O15+1H58', '12C37+13C2+14N6+16O15+1H58', '12C38+13C2+16O13+1H69+31P3', '12C39+13C2+14N1+16O10+1H68+23Na1+31P3', '12C39+13C2+16O17+1H63+23Na1', '12C40+13C2+16O11+1H69+31P2+39K1', '12C43+13C2+14N3+16O9+1H62+31P2', '12C43+13C2+14N3+16O9+1H62+31P2', '12C43+13C2+16O10+1H65+23Na1+31P2', '12C45+13C2+14N3+16O7+1H62+31P1+39K1', '12C47+13C2+14N2+16O9+1H59+31P1', '12C47+13C2+14N2+16O9+1H59+31P1', '12C48+13C2+14N3+16O6+1H58+23Na1+31P1', '12C49+13C2+14N2+16O7+1H59+39K1', '12C49+13C2+14N3+1H64+31P3+39K1', '12C51+13C2+14N1+16O9+1H56', '12C51+13C2+14N1+16O9+1H56', '12C52+13C2+14N2+16O6+1H55+23Na1', '12C54+13C2+1H62+23Na1+31P3']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', 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0.09792736]"},{"Metabolite":"IMF346","adduct":"39K1","adducted_elemental_formula":"C54H109K1N4O3","adducted_isotopic_formula":"12C53+13C1+14N4+16O3+1H109+39K1","charge":"1","elemental_formula":"C54H109N4O3","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.29437415"},{"Metabolite":"IMF3460","adduct":"39K1","adducted_elemental_formula":"C43H65K1N4O7P2","adducted_isotopic_formula":"12C43+14N4+16O7+1H65+31P2+39K1","charge":"1","elemental_formula":"C43H65N4O7P2","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.56469405"},{"Metabolite":"IMF3461","adduct":"39K1","adducted_elemental_formula":"C43H65K1N4O7P2","adducted_isotopic_formula":"12C42+13C1+14N4+16O7+1H65+31P2+39K1","charge":"1","elemental_formula":"C43H65N4O7P2","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.26262583"},{"Metabolite":"IMF3462","adduct":"['14N1+1H4', '1H1']","adducted_elemental_formula":"['C51H101N6O2', 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0.52055135]"},{"Metabolite":"IMF3467","adduct":"['23Na1', '23Na1']","adducted_elemental_formula":"['C48H86N6Na1O27P3', 'C52H83N5Na1O27P2']","adducted_isotopic_formula":"['12C47+13C1+14N6+16O27+1H86+23Na1+31P3', '12C51+13C1+14N5+16O27+1H83+23Na1+31P2']","charge":"['1', '1']","elemental_formula":"['C48H86N6O27P3', 'C52H83N5O27P2']","isotopologue":"['13C1', '13C1']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.28100561, 0.29276738]"},{"Metabolite":"IMF3468","adduct":"['23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1', '23Na1']","adducted_elemental_formula":"['C62H75N6Na1O21P1', 'C65H76N1Na1O25', 'C66H72N5Na1O21', 'C66H77N6Na1O14P3', 'C68H79N3Na1O15P3', 'C70H74N5Na1O14P2', 'C72H76N2Na1O15P2', 'C74H71N4Na1O14P1', 'C76H73N1Na1O15P1', 'C78H68N3Na1O14', 'C80H70Na1O15', 'C81H66N4Na1O11', 'C84H72Na1O8P2', 'C89H65N3Na1O4P1', 'C91H67Na1O5P1']","adducted_isotopic_formula":"['12C61+13C1+14N6+16O21+1H75+23Na1+31P1', '12C64+13C1+14N1+16O25+1H76+23Na1', '12C65+13C1+14N5+16O21+1H72+23Na1', '12C65+13C1+14N6+16O14+1H77+23Na1+31P3', '12C67+13C1+14N3+16O15+1H79+23Na1+31P3', '12C69+13C1+14N5+16O14+1H74+23Na1+31P2', '12C71+13C1+14N2+16O15+1H76+23Na1+31P2', '12C73+13C1+14N4+16O14+1H71+23Na1+31P1', '12C75+13C1+14N1+16O15+1H73+23Na1+31P1', '12C77+13C1+14N3+16O14+1H68+23Na1', '12C79+13C1+16O15+1H70+23Na1', '12C80+13C1+14N4+16O11+1H66+23Na1', '12C83+13C1+16O8+1H72+23Na1+31P2', '12C88+13C1+14N3+16O4+1H65+23Na1+31P1', '12C90+13C1+16O5+1H67+23Na1+31P1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C62H75N6O21P1', 'C65H76N1O25', 'C66H72N5O21', 'C66H77N6O14P3', 'C68H79N3O15P3', 'C70H74N5O14P2', 'C72H76N2O15P2', 'C74H71N4O14P1', 'C76H73N1O15P1', 'C78H68N3O14', 'C80H70O15', 'C81H66N4O11', 'C84H72O8P2', 'C89H65N3O4P1', 'C91H67O5P1']","isotopologue":"['13C1', '13C1', 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'C75H67N2Na1O7P1', 'C75H64N5O6P1', 'C75H64N5O6P1', 'C76H68K1N1O8', 'C77H64K1N5O4', 'C77H59N7O5', 'C78H65O10', 'C79H64N1Na1O7', 'C79H61N4O6', 'C79H61N4O6', 'C80H60N5Na1O3', 'C81H68N2P3', 'C81H68N2P3', 'C85H65N1P2', 'C85H65N1P2']","adducted_isotopic_formula":"['12C39+14N6+16O27+1H84+31P3', '12C39+14N6+16O27+1H84+31P3', '12C51+14N2+16O19+1H85+31P3+39K1', '12C51+14N3+16O27+1H75', '12C51+14N3+16O27+1H75', '12C51+14N4+16O20+1H80+31P3', '12C51+14N4+16O20+1H80+31P3', '12C52+14N4+16O24+1H74+23Na1', '12C52+14N5+16O17+1H79+23Na1+31P3', '12C53+14N1+16O21+1H82+31P3', '12C53+14N1+16O21+1H82+31P3', '12C53+14N4+16O18+1H80+31P2+39K1', '12C54+14N2+16O18+1H81+23Na1+31P3', '12C55+14N1+16O19+1H82+31P2+39K1', '12C55+14N3+16O20+1H77+31P2', '12C55+14N3+16O20+1H77+31P2', '12C56+14N4+16O17+1H76+23Na1+31P2', '12C56+14N7+16O16+1H73+31P2', '12C57+14N3+16O18+1H77+31P1+39K1', '12C57+16O21+1H79+31P2', '12C58+14N1+16O18+1H78+23Na1+31P2', '12C59+16O19+1H79+31P1+39K1', '12C60+14N3+16O17+1H73+23Na1+31P1', '12C60+14N6+16O16+1H70+31P1', '12C60+14N6+16O16+1H70+31P1', '12C62+14N6+16O14+1H70+39K1', '12C62+16O18+1H75+23Na1+31P1', '12C63+16O12+1H81+31P3+39K1', '12C64+14N5+16O16+1H67', '12C64+14N5+16O16+1H67', '12C65+14N6+16O13+1H66+23Na1', '12C66+14N2+16O17+1H69', '12C66+14N2+16O17+1H69', '12C66+14N3+16O10+1H74+31P3', '12C66+14N3+16O10+1H74+31P3', '12C66+16O11+1H77+23Na1+31P3', '12C68+14N3+16O8+1H74+31P2+39K1', '12C70+14N2+16O10+1H71+31P2', '12C70+14N2+16O10+1H71+31P2', '12C71+14N3+16O7+1H70+23Na1+31P2', '12C72+14N2+16O8+1H71+31P1+39K1', '12C74+14N1+16O10+1H68+31P1', '12C74+14N1+16O10+1H68+31P1', '12C75+14N2+16O7+1H67+23Na1+31P1', '12C75+14N5+16O6+1H64+31P1', '12C75+14N5+16O6+1H64+31P1', '12C76+14N1+16O8+1H68+39K1', '12C77+14N5+16O4+1H64+39K1', '12C77+14N7+16O5+1H59', '12C78+16O10+1H65', '12C79+14N1+16O7+1H64+23Na1', '12C79+14N4+16O6+1H61', '12C79+14N4+16O6+1H61', '12C80+14N5+16O3+1H60+23Na1', '12C81+14N2+1H68+31P3', '12C81+14N2+1H68+31P3', '12C85+14N1+1H65+31P2', '12C85+14N1+1H65+31P2']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C39H80N5O27P3', 'C39H83N6O27P3', 'C51H85N2O19P3', 'C51H71N2O27', 'C51H74N3O27', 'C51H76N3O20P3', 'C51H79N4O20P3', 'C52H74N4O24', 'C52H79N5O17P3', 'C53H78O21P3', 'C53H81N1O21P3', 'C53H80N4O18P2', 'C54H81N2O18P3', 'C55H82N1O19P2', 'C55H73N2O20P2', 'C55H76N3O20P2', 'C56H76N4O17P2', 'C56H69N6O16P2', 'C57H77N3O18P1', 'C57H78O21P2', 'C58H78N1O18P2', 'C59H79O19P1', 'C60H73N3O17P1', 'C60H66N5O16P1', 'C60H69N6O16P1', 'C62H70N6O14', 'C62H75O18P1', 'C63H81O12P3', 'C64H63N4O16', 'C64H66N5O16', 'C65H66N6O13', 'C66H65N1O17', 'C66H68N2O17', 'C66H70N2O10P3', 'C66H73N3O10P3', 'C66H77O11P3', 'C68H74N3O8P2', 'C70H67N1O10P2', 'C70H70N2O10P2', 'C71H70N3O7P2', 'C72H71N2O8P1', 'C74H64O10P1', 'C74H67N1O10P1', 'C75H67N2O7P1', 'C75H60N4O6P1', 'C75H63N5O6P1', 'C76H68N1O8', 'C77H64N5O4', 'C77H55N6O5', 'C78H64O10', 'C79H64N1O7', 'C79H57N3O6', 'C79H60N4O6', 'C80H60N5O3', 'C81H64N1P3', 'C81H67N2P3', 'C85H61P2', 'C85H64N1P2']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.59643867, 0.59643867, 0.50573888, 0.53052099, 0.53052099, 0.53736016, 0.53736016, 0.52682536, 0.53361688, 0.53029327, 0.53029327, 0.4928574, 0.52659922, 0.48637577, 0.51678637, 0.51678637, 0.51318642, 0.50901487, 0.47398749, 0.50999005, 0.50643744, 0.46775402, 0.49353817, 0.48952633, 0.48952633, 0.44898505, 0.48704759, 0.45564437, 0.47078395, 0.47078395, 0.46750445, 0.46459262, 0.46459262, 0.47058187, 0.47058187, 0.47443845, 0.43160952, 0.45256481, 0.45256481, 0.44941223, 0.41508459, 0.43523757, 0.43523757, 0.43220569, 0.42869241, 0.42869241, 0.39919234, 0.39318923, 0.41777335, 0.41857373, 0.41565793, 0.41227916, 0.41227916, 0.40940721, 0.41210219, 0.41210219, 0.39632413, 0.39632413]"},{"Metabolite":"IMF3514","adduct":"['14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '23Na1', '39K1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C39H84N6O27P3', 'C39H84N6O27P3', 'C51H85K1N2O19P3', 'C51H75N3O27', 'C51H75N3O27', 'C51H80N4O20P3', 'C51H80N4O20P3', 'C52H74N4Na1O24', 'C52H79N5Na1O17P3', 'C53H82N1O21P3', 'C53H82N1O21P3', 'C53H80K1N4O18P2', 'C54H81N2Na1O18P3', 'C55H82K1N1O19P2', 'C55H77N3O20P2', 'C55H77N3O20P2', 'C56H76N4Na1O17P2', 'C56H73N7O16P2', 'C57H77K1N3O18P1', 'C57H79O21P2', 'C58H78N1Na1O18P2', 'C59H79K1O19P1', 'C60H73N3Na1O17P1', 'C60H70N6O16P1', 'C60H70N6O16P1', 'C62H70K1N6O14', 'C62H75Na1O18P1', 'C63H81K1O12P3', 'C64H67N5O16', 'C64H67N5O16', 'C65H66N6Na1O13', 'C66H69N2O17', 'C66H69N2O17', 'C66H74N3O10P3', 'C66H74N3O10P3', 'C66H77Na1O11P3', 'C68H74K1N3O8P2', 'C70H71N2O10P2', 'C70H71N2O10P2', 'C71H70N3Na1O7P2', 'C72H71K1N2O8P1', 'C74H68N1O10P1', 'C74H68N1O10P1', 'C75H67N2Na1O7P1', 'C75H64N5O6P1', 'C75H64N5O6P1', 'C76H68K1N1O8', 'C77H64K1N5O4', 'C77H59N7O5', 'C78H65O10', 'C79H64N1Na1O7', 'C79H61N4O6', 'C79H61N4O6', 'C80H60N5Na1O3', 'C81H68N2P3', 'C81H68N2P3', 'C85H65N1P2', 'C85H65N1P2']","adducted_isotopic_formula":"['12C38+13C1+14N6+16O27+1H84+31P3', '12C38+13C1+14N6+16O27+1H84+31P3', '12C50+13C1+14N2+16O19+1H85+31P3+39K1', '12C50+13C1+14N3+16O27+1H75', '12C50+13C1+14N3+16O27+1H75', '12C50+13C1+14N4+16O20+1H80+31P3', '12C50+13C1+14N4+16O20+1H80+31P3', '12C51+13C1+14N4+16O24+1H74+23Na1', '12C51+13C1+14N5+16O17+1H79+23Na1+31P3', '12C52+13C1+14N1+16O21+1H82+31P3', '12C52+13C1+14N1+16O21+1H82+31P3', '12C52+13C1+14N4+16O18+1H80+31P2+39K1', '12C53+13C1+14N2+16O18+1H81+23Na1+31P3', 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'1H1']","adducted_elemental_formula":"['C39H84N6O27P3', 'C39H84N6O27P3', 'C51H85K1N2O19P3', 'C51H75N3O27', 'C51H75N3O27', 'C51H80N4O20P3', 'C51H80N4O20P3', 'C52H74N4Na1O24', 'C52H79N5Na1O17P3', 'C53H82N1O21P3', 'C53H82N1O21P3', 'C53H80K1N4O18P2', 'C54H81N2Na1O18P3', 'C55H82K1N1O19P2', 'C55H77N3O20P2', 'C55H77N3O20P2', 'C56H76N4Na1O17P2', 'C56H73N7O16P2', 'C57H77K1N3O18P1', 'C57H79O21P2', 'C58H78N1Na1O18P2', 'C59H79K1O19P1', 'C60H73N3Na1O17P1', 'C60H70N6O16P1', 'C60H70N6O16P1', 'C62H70K1N6O14', 'C62H75Na1O18P1', 'C63H81K1O12P3', 'C64H67N5O16', 'C64H67N5O16', 'C65H66N6Na1O13', 'C66H69N2O17', 'C66H69N2O17', 'C66H74N3O10P3', 'C66H74N3O10P3', 'C66H77Na1O11P3', 'C68H74K1N3O8P2', 'C70H71N2O10P2', 'C70H71N2O10P2', 'C71H70N3Na1O7P2', 'C72H71K1N2O8P1', 'C74H68N1O10P1', 'C74H68N1O10P1', 'C75H67N2Na1O7P1', 'C75H64N5O6P1', 'C75H64N5O6P1', 'C76H68K1N1O8', 'C77H64K1N5O4', 'C77H59N7O5', 'C78H65O10', 'C79H64N1Na1O7', 'C79H61N4O6', 'C79H61N4O6', 'C80H60N5Na1O3', 'C81H68N2P3', 'C81H68N2P3', 'C85H65N1P2', 'C85H65N1P2']","adducted_isotopic_formula":"['12C37+13C2+14N6+16O27+1H84+31P3', '12C37+13C2+14N6+16O27+1H84+31P3', '12C49+13C2+14N2+16O19+1H85+31P3+39K1', '12C49+13C2+14N3+16O27+1H75', '12C49+13C2+14N3+16O27+1H75', '12C49+13C2+14N4+16O20+1H80+31P3', '12C49+13C2+14N4+16O20+1H80+31P3', '12C50+13C2+14N4+16O24+1H74+23Na1', '12C50+13C2+14N5+16O17+1H79+23Na1+31P3', '12C51+13C2+14N1+16O21+1H82+31P3', '12C51+13C2+14N1+16O21+1H82+31P3', '12C51+13C2+14N4+16O18+1H80+31P2+39K1', '12C52+13C2+14N2+16O18+1H81+23Na1+31P3', '12C53+13C2+14N1+16O19+1H82+31P2+39K1', '12C53+13C2+14N3+16O20+1H77+31P2', '12C53+13C2+14N3+16O20+1H77+31P2', '12C54+13C2+14N4+16O17+1H76+23Na1+31P2', '12C54+13C2+14N7+16O16+1H73+31P2', '12C55+13C2+14N3+16O18+1H77+31P1+39K1', '12C55+13C2+16O21+1H79+31P2', '12C56+13C2+14N1+16O18+1H78+23Na1+31P2', '12C57+13C2+16O19+1H79+31P1+39K1', '12C58+13C2+14N3+16O17+1H73+23Na1+31P1', '12C58+13C2+14N6+16O16+1H70+31P1', '12C58+13C2+14N6+16O16+1H70+31P1', '12C60+13C2+14N6+16O14+1H70+39K1', 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0.63393867, 0.58551627, 0.61394397, 0.61394397, 0.60966721, 0.56309874, 0.57035788, 0.59043804, 0.59043804, 0.56285704, 0.58632502, 0.58155895, 0.58155895, 0.58905606, 0.58905606, 0.54027199, 0.58607335, 0.56650301, 0.56650301, 0.56255673, 0.55905286, 0.55905286, 0.51958672, 0.54481344, 0.54481344, 0.54101825, 0.53764854, 0.53764854, 0.49969343, 0.53390325, 0.4931219, 0.5239543, 0.5239543, 0.52030441, 0.516075, 0.51706371, 0.51346183, 0.4803555, 0.45884197, 0.45884197, 0.45564566]"},{"Metabolite":"IMF3533","adduct":"['23Na1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C31H79N5Na1O23P3', 'C34H77N3O26P2', 'C34H77N3O26P2', 'C35H76N4Na1O23P2', 'C36H77K1N3O24P1', 'C38H74N2O26P1', 'C38H74N2O26P1', 'C39H73N3Na1O23P1', 'C40H74K1N2O24', 'C40H79K1N3O17P3', 'C42H71N1O26', 'C42H71N1O26', 'C42H81K1O18P3', 'C43H70N2Na1O23', 'C43H67N5O22', 'C43H67N5O22', 'C43H72N6O15P3', 'C43H72N6O15P3', 'C45H72K1N6O13P2', 'C45H77Na1O17P3', 'C47H69N5O15P2', 'C47H69N5O15P2', 'C48H68N6Na1O12P2', 'C49H71N2O16P2', 'C49H71N2O16P2', 'C49H69K1N5O13P1', 'C51H66N4O15P1', 'C51H66N4O15P1', 'C52H65N5Na1O12P1', 'C53H68N1O16P1', 'C53H68N1O16P1', 'C53H66K1N4O13', 'C54H67N2Na1O13P1', 'C55H68K1N1O14', 'C55H63N3O15', 'C55H63N3O15', 'C56H62N4Na1O12', 'C56H59N7O11', 'C57H65O16', 'C58H64N1Na1O13', 'C59H70K1N1O7P2', 'C70H57N2O5', 'C70H57N2O5', 'C71H56N3Na1O2']","adducted_isotopic_formula":"['12C30+13C1+14N5+16O23+1H79+23Na1+31P3', '12C33+13C1+14N3+16O26+1H77+31P2', '12C33+13C1+14N3+16O26+1H77+31P2', '12C34+13C1+14N4+16O23+1H76+23Na1+31P2', '12C35+13C1+14N3+16O24+1H77+31P1+39K1', '12C37+13C1+14N2+16O26+1H74+31P1', '12C37+13C1+14N2+16O26+1H74+31P1', '12C38+13C1+14N3+16O23+1H73+23Na1+31P1', '12C39+13C1+14N2+16O24+1H74+39K1', '12C39+13C1+14N3+16O17+1H79+31P3+39K1', '12C41+13C1+14N1+16O26+1H71', '12C41+13C1+14N1+16O26+1H71', '12C41+13C1+16O18+1H81+31P3+39K1', '12C42+13C1+14N2+16O23+1H70+23Na1', '12C42+13C1+14N5+16O22+1H67', '12C42+13C1+14N5+16O22+1H67', '12C42+13C1+14N6+16O15+1H72+31P3', '12C42+13C1+14N6+16O15+1H72+31P3', '12C44+13C1+14N6+16O13+1H72+31P2+39K1', '12C44+13C1+16O17+1H77+23Na1+31P3', '12C46+13C1+14N5+16O15+1H69+31P2', '12C46+13C1+14N5+16O15+1H69+31P2', '12C47+13C1+14N6+16O12+1H68+23Na1+31P2', '12C48+13C1+14N2+16O16+1H71+31P2', '12C48+13C1+14N2+16O16+1H71+31P2', '12C48+13C1+14N5+16O13+1H69+31P1+39K1', '12C50+13C1+14N4+16O15+1H66+31P1', '12C50+13C1+14N4+16O15+1H66+31P1', '12C51+13C1+14N5+16O12+1H65+23Na1+31P1', '12C52+13C1+14N1+16O16+1H68+31P1', '12C52+13C1+14N1+16O16+1H68+31P1', '12C52+13C1+14N4+16O13+1H66+39K1', '12C53+13C1+14N2+16O13+1H67+23Na1+31P1', '12C54+13C1+14N1+16O14+1H68+39K1', '12C54+13C1+14N3+16O15+1H63', '12C54+13C1+14N3+16O15+1H63', '12C55+13C1+14N4+16O12+1H62+23Na1', '12C55+13C1+14N7+16O11+1H59', '12C56+13C1+16O16+1H65', '12C57+13C1+14N1+16O13+1H64+23Na1', '12C58+13C1+14N1+16O7+1H70+31P2+39K1', '12C69+13C1+14N2+16O5+1H57', '12C69+13C1+14N2+16O5+1H57', '12C70+13C1+14N3+16O2+1H56+23Na1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C31H79N5O23P3', 'C34H73N2O26P2', 'C34H76N3O26P2', 'C35H76N4O23P2', 'C36H77N3O24P1', 'C38H70N1O26P1', 'C38H73N2O26P1', 'C39H73N3O23P1', 'C40H74N2O24', 'C40H79N3O17P3', 'C42H67O26', 'C42H70N1O26', 'C42H81O18P3', 'C43H70N2O23', 'C43H63N4O22', 'C43H66N5O22', 'C43H68N5O15P3', 'C43H71N6O15P3', 'C45H72N6O13P2', 'C45H77O17P3', 'C47H65N4O15P2', 'C47H68N5O15P2', 'C48H68N6O12P2', 'C49H67N1O16P2', 'C49H70N2O16P2', 'C49H69N5O13P1', 'C51H62N3O15P1', 'C51H65N4O15P1', 'C52H65N5O12P1', 'C53H64O16P1', 'C53H67N1O16P1', 'C53H66N4O13', 'C54H67N2O13P1', 'C55H68N1O14', 'C55H59N2O15', 'C55H62N3O15', 'C56H62N4O12', 'C56H55N6O11', 'C57H64O16', 'C58H64N1O13', 'C59H70N1O7P2', 'C70H53N1O5', 'C70H56N2O5', 'C71H56N3O2']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.22101366, 0.23475661, 0.23475661, 0.23997779, 0.22798025, 0.25232954, 0.25232954, 0.2571658, 0.24361292, 0.24675344, 0.26821273, 0.26821273, 0.25568377, 0.27268588, 0.27046929, 0.27046929, 0.27395602, 0.27395602, 0.26295458, 0.28524645, 0.2879757, 0.2879757, 0.29205411, 0.29628163, 0.29628163, 0.27536573, 0.30052026, 0.30052026, 0.30427833, 0.30819821, 0.30819821, 0.28644106, 0.31182584, 0.29334099, 0.3116821, 0.3116821, 0.31513838, 0.31257671, 0.31876798, 0.32210089, 0.30652828, 0.34738971, 0.34738971, 0.34989792]"},{"Metabolite":"IMF3534","adduct":"['23Na1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C31H79N5Na1O23P3', 'C34H77N3O26P2', 'C34H77N3O26P2', 'C35H76N4Na1O23P2', 'C36H77K1N3O24P1', 'C38H74N2O26P1', 'C38H74N2O26P1', 'C39H73N3Na1O23P1', 'C40H74K1N2O24', 'C40H79K1N3O17P3', 'C42H71N1O26', 'C42H71N1O26', 'C42H81K1O18P3', 'C43H70N2Na1O23', 'C43H67N5O22', 'C43H67N5O22', 'C43H72N6O15P3', 'C43H72N6O15P3', 'C45H72K1N6O13P2', 'C45H77Na1O17P3', 'C47H69N5O15P2', 'C47H69N5O15P2', 'C48H68N6Na1O12P2', 'C49H71N2O16P2', 'C49H71N2O16P2', 'C49H69K1N5O13P1', 'C51H66N4O15P1', 'C51H66N4O15P1', 'C52H65N5Na1O12P1', 'C53H68N1O16P1', 'C53H68N1O16P1', 'C53H66K1N4O13', 'C54H67N2Na1O13P1', 'C55H68K1N1O14', 'C55H63N3O15', 'C55H63N3O15', 'C56H62N4Na1O12', 'C56H59N7O11', 'C57H65O16', 'C58H64N1Na1O13', 'C59H70K1N1O7P2', 'C70H57N2O5', 'C70H57N2O5', 'C71H56N3Na1O2']","adducted_isotopic_formula":"['12C29+13C2+14N5+16O23+1H79+23Na1+31P3', '12C32+13C2+14N3+16O26+1H77+31P2', '12C32+13C2+14N3+16O26+1H77+31P2', '12C33+13C2+14N4+16O23+1H76+23Na1+31P2', '12C34+13C2+14N3+16O24+1H77+31P1+39K1', '12C36+13C2+14N2+16O26+1H74+31P1', '12C36+13C2+14N2+16O26+1H74+31P1', '12C37+13C2+14N3+16O23+1H73+23Na1+31P1', '12C38+13C2+14N2+16O24+1H74+39K1', '12C38+13C2+14N3+16O17+1H79+31P3+39K1', '12C40+13C2+14N1+16O26+1H71', '12C40+13C2+14N1+16O26+1H71', '12C40+13C2+16O18+1H81+31P3+39K1', '12C41+13C2+14N2+16O23+1H70+23Na1', '12C41+13C2+14N5+16O22+1H67', '12C41+13C2+14N5+16O22+1H67', '12C41+13C2+14N6+16O15+1H72+31P3', '12C41+13C2+14N6+16O15+1H72+31P3', '12C43+13C2+14N6+16O13+1H72+31P2+39K1', '12C43+13C2+16O17+1H77+23Na1+31P3', '12C45+13C2+14N5+16O15+1H69+31P2', '12C45+13C2+14N5+16O15+1H69+31P2', '12C46+13C2+14N6+16O12+1H68+23Na1+31P2', '12C47+13C2+14N2+16O16+1H71+31P2', '12C47+13C2+14N2+16O16+1H71+31P2', '12C47+13C2+14N5+16O13+1H69+31P1+39K1', '12C49+13C2+14N4+16O15+1H66+31P1', '12C49+13C2+14N4+16O15+1H66+31P1', '12C50+13C2+14N5+16O12+1H65+23Na1+31P1', '12C51+13C2+14N1+16O16+1H68+31P1', '12C51+13C2+14N1+16O16+1H68+31P1', '12C51+13C2+14N4+16O13+1H66+39K1', '12C52+13C2+14N2+16O13+1H67+23Na1+31P1', '12C53+13C2+14N1+16O14+1H68+39K1', '12C53+13C2+14N3+16O15+1H63', '12C53+13C2+14N3+16O15+1H63', '12C54+13C2+14N4+16O12+1H62+23Na1', '12C54+13C2+14N7+16O11+1H59', '12C55+13C2+16O16+1H65', '12C56+13C2+14N1+16O13+1H64+23Na1', '12C57+13C2+14N1+16O7+1H70+31P2+39K1', '12C68+13C2+14N2+16O5+1H57', '12C68+13C2+14N2+16O5+1H57', '12C69+13C2+14N3+16O2+1H56+23Na1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C31H79N5O23P3', 'C34H73N2O26P2', 'C34H76N3O26P2', 'C35H76N4O23P2', 'C36H77N3O24P1', 'C38H70N1O26P1', 'C38H73N2O26P1', 'C39H73N3O23P1', 'C40H74N2O24', 'C40H79N3O17P3', 'C42H67O26', 'C42H70N1O26', 'C42H81O18P3', 'C43H70N2O23', 'C43H63N4O22', 'C43H66N5O22', 'C43H68N5O15P3', 'C43H71N6O15P3', 'C45H72N6O13P2', 'C45H77O17P3', 'C47H65N4O15P2', 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'C37H75N2O20P2', 'C38H71N6O16P2', 'C38H76O20P3', 'C40H64N4O18P2', 'C40H67N5O18P2', 'C41H67N6O15P2', 'C42H68N5O16P1', 'C44H61N3O18P1', 'C44H64N4O18P1', 'C45H64N5O15P1', 'C46H65N4O16', 'C48H72N2O10P3', 'C48H58N2O18', 'C48H61N3O18']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.62765711, 0.6357485, 0.63058067, 0.63058067, 0.58718785, 0.57835764, 0.62738769, 0.60643778, 0.60643778, 0.6022133, 0.55621419, 0.58321924, 0.58321924, 0.5791565, 0.53491855, 0.53468894, 0.56088966, 0.56088966]"},{"Metabolite":"IMF3559","adduct":"['23Na1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C36H69N2Na1O26', 'C36H74N3Na1O19P3', 'C36H71N6O18P3', 'C36H71N6O18P3', 'C37H75K1N2O20P2', 'C38H71K1N6O16P2', 'C38H76Na1O20P3', 'C40H68N5O18P2', 'C40H68N5O18P2', 'C41H67N6Na1O15P2', 'C42H68K1N5O16P1', 'C44H65N4O18P1', 'C44H65N4O18P1', 'C45H64N5Na1O15P1', 'C46H65K1N4O16', 'C48H72K1N2O10P3', 'C48H62N3O18', 'C48H62N3O18']","adducted_isotopic_formula":"['12C35+13C1+14N2+16O26+1H69+23Na1', '12C35+13C1+14N3+16O19+1H74+23Na1+31P3', '12C35+13C1+14N6+16O18+1H71+31P3', '12C35+13C1+14N6+16O18+1H71+31P3', '12C36+13C1+14N2+16O20+1H75+31P2+39K1', '12C37+13C1+14N6+16O16+1H71+31P2+39K1', '12C37+13C1+16O20+1H76+23Na1+31P3', '12C39+13C1+14N5+16O18+1H68+31P2', '12C39+13C1+14N5+16O18+1H68+31P2', '12C40+13C1+14N6+16O15+1H67+23Na1+31P2', '12C41+13C1+14N5+16O16+1H68+31P1+39K1', '12C43+13C1+14N4+16O18+1H65+31P1', '12C43+13C1+14N4+16O18+1H65+31P1', '12C44+13C1+14N5+16O15+1H64+23Na1+31P1', '12C45+13C1+14N4+16O16+1H65+39K1', '12C47+13C1+14N2+16O10+1H72+31P3+39K1', '12C47+13C1+14N3+16O18+1H62', '12C47+13C1+14N3+16O18+1H62']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C36H69N2O26', 'C36H74N3O19P3', 'C36H67N5O18P3', 'C36H70N6O18P3', 'C37H75N2O20P2', 'C38H71N6O16P2', 'C38H76O20P3', 'C40H64N4O18P2', 'C40H67N5O18P2', 'C41H67N6O15P2', 'C42H68N5O16P1', 'C44H61N3O18P1', 'C44H64N4O18P1', 'C45H64N5O15P1', 'C46H65N4O16', 'C48H72N2O10P3', 'C48H58N2O18', 'C48H61N3O18']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.24438848, 0.24753899, 0.24552681, 0.24552681, 0.23498198, 0.23770364, 0.25785488, 0.26236265, 0.26236265, 0.26704839, 0.25266619, 0.27754939, 0.27754939, 0.28187997, 0.26613455, 0.27758642, 0.29118865, 0.29118865]"},{"Metabolite":"IMF3560","adduct":"['23Na1', '23Na1', '14N1+1H4', '1H1', '39K1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '39K1', '14N1+1H4', '1H1']","adducted_elemental_formula":"['C36H69N2Na1O26', 'C36H74N3Na1O19P3', 'C36H71N6O18P3', 'C36H71N6O18P3', 'C37H75K1N2O20P2', 'C38H71K1N6O16P2', 'C38H76Na1O20P3', 'C40H68N5O18P2', 'C40H68N5O18P2', 'C41H67N6Na1O15P2', 'C42H68K1N5O16P1', 'C44H65N4O18P1', 'C44H65N4O18P1', 'C45H64N5Na1O15P1', 'C46H65K1N4O16', 'C48H72K1N2O10P3', 'C48H62N3O18', 'C48H62N3O18']","adducted_isotopic_formula":"['12C34+13C2+14N2+16O26+1H69+23Na1', '12C34+13C2+14N3+16O19+1H74+23Na1+31P3', '12C34+13C2+14N6+16O18+1H71+31P3', '12C34+13C2+14N6+16O18+1H71+31P3', '12C35+13C2+14N2+16O20+1H75+31P2+39K1', '12C36+13C2+14N6+16O16+1H71+31P2+39K1', '12C36+13C2+16O20+1H76+23Na1+31P3', '12C38+13C2+14N5+16O18+1H68+31P2', '12C38+13C2+14N5+16O18+1H68+31P2', '12C39+13C2+14N6+16O15+1H67+23Na1+31P2', '12C40+13C2+14N5+16O16+1H68+31P1+39K1', '12C42+13C2+14N4+16O18+1H65+31P1', '12C42+13C2+14N4+16O18+1H65+31P1', '12C43+13C2+14N5+16O15+1H64+23Na1+31P1', '12C44+13C2+14N4+16O16+1H65+39K1', '12C46+13C2+14N2+16O10+1H72+31P3+39K1', '12C46+13C2+14N3+16O18+1H62', '12C46+13C2+14N3+16O18+1H62']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C36H69N2O26', 'C36H74N3O19P3', 'C36H67N5O18P3', 'C36H70N6O18P3', 'C37H75N2O20P2', 'C38H71N6O16P2', 'C38H76O20P3', 'C40H64N4O18P2', 'C40H67N5O18P2', 'C41H67N6O15P2', 'C42H68N5O16P1', 'C44H61N3O18P1', 'C44H64N4O18P1', 'C45H64N5O15P1', 'C46H65N4O16', 'C48H72N2O10P3', 'C48H58N2O18', 'C48H61N3O18']","isotopologue":"['13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.04625669, 0.046853, 0.04647215, 0.04647215, 0.04574702, 0.04756235, 0.05159443, 0.05533404, 0.05533404, 0.05776646, 0.05602176, 0.06454083, 0.06454083, 0.06707222, 0.06476488, 0.07055403, 0.07401131, 0.07401131]"},{"Metabolite":"IMF3561","adduct":"39K1","adducted_elemental_formula":"C67H63K1P2","adducted_isotopic_formula":"12C67+1H63+31P2+39K1","charge":"1","elemental_formula":"C67H63P2","isotopologue":"13C0","isotopologue%type":"13C","natural_abundance_probability":"0.45031512"},{"Metabolite":"IMF3562","adduct":"39K1","adducted_elemental_formula":"C67H63K1P2","adducted_isotopic_formula":"12C66+13C1+1H63+31P2+39K1","charge":"1","elemental_formula":"C67H63P2","isotopologue":"13C1","isotopologue%type":"13C","natural_abundance_probability":"0.32632256"},{"Metabolite":"IMF3563","adduct":"['14N1+1H4', '23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '39K1', '14N1+1H4', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C29H62N7O23P1', 'C31H67N1Na1O25P1', 'C35H61N3O24', 'C35H61N3O24', 'C35H66N4O17P3', 'C35H66N4O17P3', 'C35H64Na1O25', 'C36H65N5Na1O14P3', 'C37H66K1N4O15P2', 'C39H63N3O17P2', 'C39H63N3O17P2', 'C40H62N4Na1O14P2', 'C40H59N7O13P2', 'C41H63K1N3O15P1', 'C41H65O18P2', 'C43H65K1O16P1', 'C44H56N6O13P1', 'C44H56N6O13P1', 'C46H56K1N6O11', 'C46H61Na1O15P1', 'C48H53N5O13', 'C48H53N5O13', 'C49H52N6Na1O10', 'C54H57N2O7P2', 'C54H57N2O7P2', 'C56H57K1N2O5P1', 'C58H54N1O7P1', 'C58H54N1O7P1', 'C59H53N2Na1O4P1', 'C60H54K1N1O5', 'C61H45N7O2', 'C62H51O7', 'C63H50N1Na1O4']","adducted_isotopic_formula":"['12C29+14N7+16O23+1H62+31P1', '12C31+14N1+16O25+1H67+23Na1+31P1', '12C35+14N3+16O24+1H61', '12C35+14N3+16O24+1H61', '12C35+14N4+16O17+1H66+31P3', '12C35+14N4+16O17+1H66+31P3', '12C35+16O25+1H64+23Na1', '12C36+14N5+16O14+1H65+23Na1+31P3', '12C37+14N4+16O15+1H66+31P2+39K1', '12C39+14N3+16O17+1H63+31P2', '12C39+14N3+16O17+1H63+31P2', '12C40+14N4+16O14+1H62+23Na1+31P2', '12C40+14N7+16O13+1H59+31P2', '12C41+14N3+16O15+1H63+31P1+39K1', '12C41+16O18+1H65+31P2', '12C43+16O16+1H65+31P1+39K1', '12C44+14N6+16O13+1H56+31P1', '12C44+14N6+16O13+1H56+31P1', '12C46+14N6+16O11+1H56+39K1', '12C46+16O15+1H61+23Na1+31P1', '12C48+14N5+16O13+1H53', '12C48+14N5+16O13+1H53', '12C49+14N6+16O10+1H52+23Na1', '12C54+14N2+16O7+1H57+31P2', '12C54+14N2+16O7+1H57+31P2', '12C56+14N2+16O5+1H57+31P1+39K1', '12C58+14N1+16O7+1H54+31P1', '12C58+14N1+16O7+1H54+31P1', '12C59+14N2+16O4+1H53+23Na1+31P1', '12C60+14N1+16O5+1H54+39K1', '12C61+14N7+16O2+1H45', '12C62+16O7+1H51', '12C63+14N1+16O4+1H50+23Na1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C29H58N6O23P1', 'C31H67N1O25P1', 'C35H57N2O24', 'C35H60N3O24', 'C35H62N3O17P3', 'C35H65N4O17P3', 'C35H64O25', 'C36H65N5O14P3', 'C37H66N4O15P2', 'C39H59N2O17P2', 'C39H62N3O17P2', 'C40H62N4O14P2', 'C40H55N6O13P2', 'C41H63N3O15P1', 'C41H64O18P2', 'C43H65O16P1', 'C44H52N5O13P1', 'C44H55N6O13P1', 'C46H56N6O11', 'C46H61O15P1', 'C48H49N4O13', 'C48H52N5O13', 'C49H52N6O10', 'C54H53N1O7P2', 'C54H56N2O7P2', 'C56H57N2O5P1', 'C58H50O7P1', 'C58H53N1O7P1', 'C59H53N2O4P1', 'C60H54N1O5', 'C61H41N6O2', 'C62H50O7', 'C63H50N1O4']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.66992671, 0.6665345, 0.63580442, 0.63580442, 0.64400084, 0.64400084, 0.64101505, 0.6395147, 0.59066638, 0.61934413, 0.61934413, 0.61502975, 0.61003034, 0.56805167, 0.61119906, 0.56058116, 0.58667425, 0.58667425, 0.53808743, 0.58370359, 0.56421239, 0.56421239, 0.56028206, 0.54237761, 0.54237761, 0.49745932, 0.52161173, 0.52161173, 0.51797816, 0.47841322, 0.50068168, 0.5016409, 0.49814645]"},{"Metabolite":"IMF3564","adduct":"['14N1+1H4', '23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '39K1', '14N1+1H4', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C29H62N7O23P1', 'C31H67N1Na1O25P1', 'C35H61N3O24', 'C35H61N3O24', 'C35H66N4O17P3', 'C35H66N4O17P3', 'C35H64Na1O25', 'C36H65N5Na1O14P3', 'C37H66K1N4O15P2', 'C39H63N3O17P2', 'C39H63N3O17P2', 'C40H62N4Na1O14P2', 'C40H59N7O13P2', 'C41H63K1N3O15P1', 'C41H65O18P2', 'C43H65K1O16P1', 'C44H56N6O13P1', 'C44H56N6O13P1', 'C46H56K1N6O11', 'C46H61Na1O15P1', 'C48H53N5O13', 'C48H53N5O13', 'C49H52N6Na1O10', 'C54H57N2O7P2', 'C54H57N2O7P2', 'C56H57K1N2O5P1', 'C58H54N1O7P1', 'C58H54N1O7P1', 'C59H53N2Na1O4P1', 'C60H54K1N1O5', 'C61H45N7O2', 'C62H51O7', 'C63H50N1Na1O4']","adducted_isotopic_formula":"['12C28+13C1+14N7+16O23+1H62+31P1', '12C30+13C1+14N1+16O25+1H67+23Na1+31P1', '12C34+13C1+14N3+16O24+1H61', '12C34+13C1+14N3+16O24+1H61', '12C34+13C1+14N4+16O17+1H66+31P3', '12C34+13C1+14N4+16O17+1H66+31P3', '12C34+13C1+16O25+1H64+23Na1', '12C35+13C1+14N5+16O14+1H65+23Na1+31P3', '12C36+13C1+14N4+16O15+1H66+31P2+39K1', '12C38+13C1+14N3+16O17+1H63+31P2', '12C38+13C1+14N3+16O17+1H63+31P2', '12C39+13C1+14N4+16O14+1H62+23Na1+31P2', '12C39+13C1+14N7+16O13+1H59+31P2', '12C40+13C1+14N3+16O15+1H63+31P1+39K1', '12C40+13C1+16O18+1H65+31P2', '12C42+13C1+16O16+1H65+31P1+39K1', '12C43+13C1+14N6+16O13+1H56+31P1', '12C43+13C1+14N6+16O13+1H56+31P1', '12C45+13C1+14N6+16O11+1H56+39K1', '12C45+13C1+16O15+1H61+23Na1+31P1', '12C47+13C1+14N5+16O13+1H53', '12C47+13C1+14N5+16O13+1H53', '12C48+13C1+14N6+16O10+1H52+23Na1', '12C53+13C1+14N2+16O7+1H57+31P2', '12C53+13C1+14N2+16O7+1H57+31P2', '12C55+13C1+14N2+16O5+1H57+31P1+39K1', '12C57+13C1+14N1+16O7+1H54+31P1', '12C57+13C1+14N1+16O7+1H54+31P1', '12C58+13C1+14N2+16O4+1H53+23Na1+31P1', '12C59+13C1+14N1+16O5+1H54+39K1', '12C60+13C1+14N7+16O2+1H45', '12C61+13C1+16O7+1H51', '12C62+13C1+14N1+16O4+1H50+23Na1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C29H58N6O23P1', 'C31H67N1O25P1', 'C35H57N2O24', 'C35H60N3O24', 'C35H62N3O17P3', 'C35H65N4O17P3', 'C35H64O25', 'C36H65N5O14P3', 'C37H66N4O15P2', 'C39H59N2O17P2', 'C39H62N3O17P2', 'C40H62N4O14P2', 'C40H55N6O13P2', 'C41H63N3O15P1', 'C41H64O18P2', 'C43H65O16P1', 'C44H52N5O13P1', 'C44H55N6O13P1', 'C46H56N6O11', 'C46H61O15P1', 'C48H49N4O13', 'C48H52N5O13', 'C49H52N6O10', 'C54H53N1O7P2', 'C54H56N2O7P2', 'C56H57N2O5P1', 'C58H50O7P1', 'C58H53N1O7P1', 'C59H53N2O4P1', 'C60H54N1O5', 'C61H41N6O2', 'C62H50O7', 'C63H50N1O4']","isotopologue":"['13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1', '13C1']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.21012661, 0.22348074, 0.24068407, 0.24068407, 0.24378683, 0.24378683, 0.24265656, 0.24900542, 0.23637402, 0.26124765, 0.26124765, 0.26607979, 0.2639169, 0.2518996, 0.27103308, 0.26071302, 0.27919361, 0.27919361, 0.26771114, 0.29040626, 0.29291366, 0.29291366, 0.29693307, 0.31677528, 0.31677528, 0.30130155, 0.32721342, 0.32721342, 0.33053635, 0.31046324, 0.33032946, 0.33638793, 0.33943245]"},{"Metabolite":"IMF3565","adduct":"['14N1+1H4', '23Na1', '14N1+1H4', '1H1', '14N1+1H4', '1H1', '23Na1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '39K1', '1H1', '39K1', '14N1+1H4', '1H1', '39K1', '23Na1', '14N1+1H4', '1H1', '23Na1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1', '39K1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C29H62N7O23P1', 'C31H67N1Na1O25P1', 'C35H61N3O24', 'C35H61N3O24', 'C35H66N4O17P3', 'C35H66N4O17P3', 'C35H64Na1O25', 'C36H65N5Na1O14P3', 'C37H66K1N4O15P2', 'C39H63N3O17P2', 'C39H63N3O17P2', 'C40H62N4Na1O14P2', 'C40H59N7O13P2', 'C41H63K1N3O15P1', 'C41H65O18P2', 'C43H65K1O16P1', 'C44H56N6O13P1', 'C44H56N6O13P1', 'C46H56K1N6O11', 'C46H61Na1O15P1', 'C48H53N5O13', 'C48H53N5O13', 'C49H52N6Na1O10', 'C54H57N2O7P2', 'C54H57N2O7P2', 'C56H57K1N2O5P1', 'C58H54N1O7P1', 'C58H54N1O7P1', 'C59H53N2Na1O4P1', 'C60H54K1N1O5', 'C61H45N7O2', 'C62H51O7', 'C63H50N1Na1O4']","adducted_isotopic_formula":"['12C27+13C2+14N7+16O23+1H62+31P1', '12C29+13C2+14N1+16O25+1H67+23Na1+31P1', '12C33+13C2+14N3+16O24+1H61', '12C33+13C2+14N3+16O24+1H61', '12C33+13C2+14N4+16O17+1H66+31P3', '12C33+13C2+14N4+16O17+1H66+31P3', '12C33+13C2+16O25+1H64+23Na1', '12C34+13C2+14N5+16O14+1H65+23Na1+31P3', '12C35+13C2+14N4+16O15+1H66+31P2+39K1', '12C37+13C2+14N3+16O17+1H63+31P2', '12C37+13C2+14N3+16O17+1H63+31P2', '12C38+13C2+14N4+16O14+1H62+23Na1+31P2', '12C38+13C2+14N7+16O13+1H59+31P2', '12C39+13C2+14N3+16O15+1H63+31P1+39K1', '12C39+13C2+16O18+1H65+31P2', '12C41+13C2+16O16+1H65+31P1+39K1', '12C42+13C2+14N6+16O13+1H56+31P1', '12C42+13C2+14N6+16O13+1H56+31P1', '12C44+13C2+14N6+16O11+1H56+39K1', '12C44+13C2+16O15+1H61+23Na1+31P1', '12C46+13C2+14N5+16O13+1H53', '12C46+13C2+14N5+16O13+1H53', '12C47+13C2+14N6+16O10+1H52+23Na1', '12C52+13C2+14N2+16O7+1H57+31P2', '12C52+13C2+14N2+16O7+1H57+31P2', '12C54+13C2+14N2+16O5+1H57+31P1+39K1', '12C56+13C2+14N1+16O7+1H54+31P1', '12C56+13C2+14N1+16O7+1H54+31P1', '12C57+13C2+14N2+16O4+1H53+23Na1+31P1', '12C58+13C2+14N1+16O5+1H54+39K1', '12C59+13C2+14N7+16O2+1H45', '12C60+13C2+16O7+1H51', '12C61+13C2+14N1+16O4+1H50+23Na1']","charge":"['1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C29H58N6O23P1', 'C31H67N1O25P1', 'C35H57N2O24', 'C35H60N3O24', 'C35H62N3O17P3', 'C35H65N4O17P3', 'C35H64O25', 'C36H65N5O14P3', 'C37H66N4O15P2', 'C39H59N2O17P2', 'C39H62N3O17P2', 'C40H62N4O14P2', 'C40H55N6O13P2', 'C41H63N3O15P1', 'C41H64O18P2', 'C43H65O16P1', 'C44H52N5O13P1', 'C44H55N6O13P1', 'C46H56N6O11', 'C46H61O15P1', 'C48H49N4O13', 'C48H52N5O13', 'C49H52N6O10', 'C54H53N1O7P2', 'C54H56N2O7P2', 'C56H57N2O5P1', 'C58H50O7P1', 'C58H53N1O7P1', 'C59H53N2O4P1', 'C60H54N1O5', 'C61H41N6O2', 'C62H50O7', 'C63H50N1O4']","isotopologue":"['13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2', '13C2']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.03181741, 0.0362566, 0.04425395, 0.04425395, 0.04482445, 0.04482445, 0.04461663, 0.04713056, 0.04601803, 0.05368609, 0.05368609, 0.05611801, 0.05566184, 0.05448955, 0.0586284, 0.05921583, 0.06492317, 0.06492317, 0.06514855, 0.07067149, 0.07444975, 0.07444975, 0.07707714, 0.09079312, 0.09079312, 0.08961688, 0.10086297, 0.10086297, 0.10367475, 0.09905764, 0.10718261, 0.11096755, 0.11380748]"},{"Metabolite":"IMF3566","adduct":"['14N1+1H4', '1H1']","adducted_elemental_formula":"['C63H47N4O3', 'C63H47N4O3']","adducted_isotopic_formula":"['12C63+14N4+16O3+1H47', '12C63+14N4+16O3+1H47']","charge":"['1', '1']","elemental_formula":"['C63H43N3O3', 'C63H46N4O3']","isotopologue":"['13C0', '13C0']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.49409715, 0.49409715]"},{"Metabolite":"IMF3567","adduct":"['14N1+1H4', '1H1']","adducted_elemental_formula":"['C63H47N4O3', 'C63H47N4O3']","adducted_isotopic_formula":"['12C62+13C1+14N4+16O3+1H47', '12C62+13C1+14N4+16O3+1H47']","charge":"['1', '1']","elemental_formula":"['C63H43N3O3', 'C63H46N4O3']","isotopologue":"['13C1', '13C1']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.3366733, 0.3366733]"},{"Metabolite":"IMF357","adduct":"['14N1+1H4', '1H1']","adducted_elemental_formula":"['C16H34N1O4', 'C16H34N1O4']","adducted_isotopic_formula":"['12C16+14N1+16O4+1H34', '12C16+14N1+16O4+1H34']","charge":"['1', '1']","elemental_formula":"['C16H30O4', 'C16H33N1O4']","isotopologue":"['13C0', '13C0']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.82744619, 0.82744619]"},{"Metabolite":"IMF358","adduct":"['14N1+1H4', '1H1']","adducted_elemental_formula":"['C16H34N1O4', 'C16H34N1O4']","adducted_isotopic_formula":"['12C15+13C1+14N1+16O4+1H34', '12C15+13C1+14N1+16O4+1H34']","charge":"['1', '1']","elemental_formula":"['C16H30O4', 'C16H33N1O4']","isotopologue":"['13C1', '13C1']","isotopologue%type":"['13C', '13C']","natural_abundance_probability":"[0.14319093, 0.14319093]"},{"Metabolite":"IMF3588","adduct":"['39K1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C37H81K1N3O4P1', 'C39H78N2O6P1', 'C39H78N2O6P1', 'C41H78K1N2O4', 'C43H75N1O6', 'C43H75N1O6', 'C44H74N2Na1O3']","adducted_isotopic_formula":"['12C37+14N3+16O4+1H81+31P1+39K1', '12C39+14N2+16O6+1H78+31P1', '12C39+14N2+16O6+1H78+31P1', '12C41+14N2+16O4+1H78+39K1', '12C43+14N1+16O6+1H75', '12C43+14N1+16O6+1H75', '12C44+14N2+16O3+1H74+23Na1']","charge":"['1', '1', '1', '1', '1', '1', '1']","elemental_formula":"['C37H81N3O4P1', 'C39H74N1O6P1', 'C39H77N2O6P1', 'C41H78N2O4', 'C43H71O6', 'C43H74N1O6', 'C44H74N2O3']","isotopologue":"['13C0', '13C0', '13C0', '13C0', '13C0', '13C0', '13C0']","isotopologue%type":"['13C', '13C', '13C', '13C', '13C', '13C', '13C']","natural_abundance_probability":"[0.60785443, 0.63736668, 0.63736668, 0.58458165, 0.61296397, 0.61296397, 0.60869404]"},{"Metabolite":"IMF3589","adduct":"['39K1', '14N1+1H4', '1H1', '39K1', '14N1+1H4', '1H1', '23Na1']","adducted_elemental_formula":"['C37H81K1N3O4P1', 'C39H78N2O6P1', 'C39H78N2O6P1', 'C41H78K1N2O4', 'C43H75N1O6', 'C43H75N1O6', 'C44H74N2Na1O3']","adducted_isotopic_formula":"['12C36+13C1+14N3+16O4+1H81+31P1+39K1', 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}

}