#METABOLOMICS WORKBENCH SinaiMetabolomics_20230409_004239 DATATRACK_ID:3852 STUDY_ID:ST002576 ANALYSIS_ID:AN005610 PROJECT_ID:PR001661 VERSION 1 CREATED_ON August 19, 2024, 6:17 pm #PROJECT PR:PROJECT_TITLE Role of environmental toxicants in obesity-related cardiovascular disease PR:PROJECT_SUMMARY This project utilizes samples from a cohort of patients undergoing bariatric PR:PROJECT_SUMMARY surgery. Plasma and adipose tissue samples were collected before and after PR:PROJECT_SUMMARY bariatric surgery. Both subcutaneous and visceral adipose tissue were collected. PR:PROJECT_SUMMARY Lipophilic pollutants, particularly persistent organic pollutants (POPs), PR:PROJECT_SUMMARY bioaccumulate in adipose tissue. Therefore, we performed untargeted analysis PR:PROJECT_SUMMARY with LC and GC-HRMS to measure chemicals and metabolites in the samples. These PR:PROJECT_SUMMARY pollutant measures can then be linked to clinical and vascular parameters of PR:PROJECT_SUMMARY cardiometabolic risk and to study the impact of weight loss on chemical levels PR:PROJECT_SUMMARY following marked (20-30%) weight loss. PR:INSTITUTE Icahn School of Medicine at Mount Sinai PR:LAST_NAME Petrick PR:FIRST_NAME Lauren PR:ADDRESS 1428 Madison Avenue, Atran Building PR:EMAIL lauren.petrick@mssm.edu PR:PHONE 9739976141 #STUDY ST:STUDY_TITLE Role of environmental toxicants in obesity-related cardiovascular disease: ST:STUDY_TITLE Plasma untargeted LC-HRMS analysis (part 1 of 3) ST:STUDY_SUMMARY 146 plasma samples were analyzed with untargeted LC-HRMS using HILIC and RP ST:STUDY_SUMMARY chromatography in negative and positive ionization modes. 1031 metabolites were ST:STUDY_SUMMARY annotated ST:INSTITUTE Boston University ST:LAST_NAME Noyan ST:FIRST_NAME Gocke ST:ADDRESS Boston University Medical Center ST:EMAIL Noyan.Gokce@bmc.org ST:PHONE 617414 1565 #SUBJECT SU:SUBJECT_TYPE Human SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS - Water_blank_01_1 Sample type:Blank_H2O Biospecimen=Matrix; Run_Order=1; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_001; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_001; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_001; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_001; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_001.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_001.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_001.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_001.mzML SUBJECT_SAMPLE_FACTORS - NIST_P_1950_01_1 Sample type:NIST Biospecimen=Plasma; Run_Order=2; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_002; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_002; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_002; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_002; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_002.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_002.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_002.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_002.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P1_20_01_1 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=3; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_003; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_003; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_003; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_003; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_003.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_003.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_003.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_003.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P2_50_01_1 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=4; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_004; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_004; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_004; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_004; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_004.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_004.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_004.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_004.mzML SUBJECT_SAMPLE_FACTORS - H-2K694-PH-00 Sample type:HHEAR_H-2K694-PH-00 Biospecimen=Plasma; Run_Order=5; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_005; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_005; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_005; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_005; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_005.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_005.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_005.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_005.mzML SUBJECT_SAMPLE_FACTORS - H-2JXX3-PH-00 Sample type:HHEAR_H-2JXX3-PH-00 Biospecimen=Plasma; Run_Order=6; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_006; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_006; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_006; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_006; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_006.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_006.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_006.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_006.mzML SUBJECT_SAMPLE_FACTORS - H-2JX43-PH-00 Sample type:HHEAR_H-2JX43-PH-00 Biospecimen=Plasma; Run_Order=7; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_007; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_007; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_007; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_007; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_007.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_007.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_007.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_007.mzML SUBJECT_SAMPLE_FACTORS - H-2K3H4-PH-00 Sample type:HHEAR_H-2K3H4-PH-00 Biospecimen=Plasma; Run_Order=8; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_008; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_008; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_008; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_008; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_008.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_008.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_008.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_008.mzML SUBJECT_SAMPLE_FACTORS - H-2K7M9-PH-00 Sample type:HHEAR_H-2K7M9-PH-00 Biospecimen=Plasma; Run_Order=9; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_009; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_009; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_009; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_009; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_009.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_009.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_009.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_009.mzML SUBJECT_SAMPLE_FACTORS - H-2K2B8-PH-00 Sample type:HHEAR_H-2K2B8-PH-00 Biospecimen=Plasma; Run_Order=10; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_010; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_010; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_010; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_010; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_010.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_010.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_010.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_010.mzML SUBJECT_SAMPLE_FACTORS - H-2K363-PH-00 Sample type:HHEAR_H-2K363-PH-00 Biospecimen=Plasma; Run_Order=11; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_011; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_011; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_011; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_011; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_011.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_011.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_011.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_011.mzML SUBJECT_SAMPLE_FACTORS - H-2JZN3-PH-00 Sample type:HHEAR_H-2JZN3-PH-00 Biospecimen=Plasma; Run_Order=12; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_012; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_012; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_012; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_012; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_012.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_012.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_012.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_012.mzML SUBJECT_SAMPLE_FACTORS - H-2K5Y4-PH-00 Sample type:HHEAR_H-2K5Y4-PH-00 Biospecimen=Plasma; Run_Order=13; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_013; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_013; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_013; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_013; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_013.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_013.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_013.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_013.mzML SUBJECT_SAMPLE_FACTORS - H-6EPB7-PH-00 Sample type:HHEAR_H-6EPB7-PH-00 Biospecimen=Plasma; Run_Order=14; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_014; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_014; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_014; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_014; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_014.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_014.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_014.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_014.mzML SUBJECT_SAMPLE_FACTORS - H-2K2G7-PH-00 Sample type:HHEAR_H-2K2G7-PH-00 Biospecimen=Plasma; Run_Order=15; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_015; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_015; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_015; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_015; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_015.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_015.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_015.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_015.mzML SUBJECT_SAMPLE_FACTORS - H-2K5W9-PH-00 Sample type:HHEAR_H-2K5W9-PH-00 Biospecimen=Plasma; Run_Order=16; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_016; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_016; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_016; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_016; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_016.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_016.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_016.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_016.mzML SUBJECT_SAMPLE_FACTORS - H-2K082-PH-00 Sample type:HHEAR_H-2K082-PH-00 Biospecimen=Plasma; Run_Order=17; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_017; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_017; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_017; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_017; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_017.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_017.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_017.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_017.mzML SUBJECT_SAMPLE_FACTORS - H-2K3G6-PH-00 Sample type:HHEAR_H-2K3G6-PH-00 Biospecimen=Plasma; Run_Order=18; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_018; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_018; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_018; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_018; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_018.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_018.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_018.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_018.mzML SUBJECT_SAMPLE_FACTORS - H-6EDR4-PH-00 Sample type:HHEAR_H-6EDR4-PH-00 Biospecimen=Plasma; Run_Order=19; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_019; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_019; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_019; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_019; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_019.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_019.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_019.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_019.mzML SUBJECT_SAMPLE_FACTORS - H-2K7V9-PH-00 Sample type:HHEAR_H-2K7V9-PH-00 Biospecimen=Plasma; Run_Order=20; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_020; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_020; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_020; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_020; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_020.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_020.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_020.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_020.mzML SUBJECT_SAMPLE_FACTORS - H-2K6Q1-PH-00 Sample type:HHEAR_H-2K6Q1-PH-00 Biospecimen=Plasma; Run_Order=21; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_021; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_021; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_021; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_021; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_021.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_021.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_021.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_021.mzML SUBJECT_SAMPLE_FACTORS - H-2K6L2-PH-00 Sample type:HHEAR_H-2K6L2-PH-00 Biospecimen=Plasma; Run_Order=22; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_022; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_022; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_022; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_022; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_022.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_022.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_022.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_022.mzML SUBJECT_SAMPLE_FACTORS - H-2K3L5-PH-00 Sample type:HHEAR_H-2K3L5-PH-00 Biospecimen=Plasma; Run_Order=23; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_023; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_023; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_023; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_023; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_023.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_023.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_023.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_023.mzML SUBJECT_SAMPLE_FACTORS - H-2K1B9-PH-00 Sample type:HHEAR_H-2K1B9-PH-00 Biospecimen=Plasma; Run_Order=24; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_024; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_024; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_024; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_024; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_024.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_024.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_024.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_024.mzML SUBJECT_SAMPLE_FACTORS - H-2K3Q4-PH-00 Sample type:HHEAR_H-2K3Q4-PH-00 Biospecimen=Plasma; Run_Order=25; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_025; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_025; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_025; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_025; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_025.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_025.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_025.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_025.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P1_20_01_2 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=26; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_026; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_026; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_026; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_026; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_026.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_026.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_026.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_026.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P2_50_01_2 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=27; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_027; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_027; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_027; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_027; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_027.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_027.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_027.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_027.mzML SUBJECT_SAMPLE_FACTORS - H-2K678-PH-00 Sample type:HHEAR_H-2K678-PH-00 Biospecimen=Plasma; Run_Order=28; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_028; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_028; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_028; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_028; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_028.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_028.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_028.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_028.mzML SUBJECT_SAMPLE_FACTORS - H-2K5B5-PH-00 Sample type:HHEAR_H-2K5B5-PH-00 Biospecimen=Plasma; Run_Order=29; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_029; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_029; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_029; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_029; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_029.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_029.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_029.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_029.mzML SUBJECT_SAMPLE_FACTORS - H-2JZM6-PH-00 Sample type:HHEAR_H-2JZM6-PH-00 Biospecimen=Plasma; Run_Order=30; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_030; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_030; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_030; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_030; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_030.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_030.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_030.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_030.mzML SUBJECT_SAMPLE_FACTORS - H-2K1V5-PH-00 Sample type:HHEAR_H-2K1V5-PH-00 Biospecimen=Plasma; Run_Order=31; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_031; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_031; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_031; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_031; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_031.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_031.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_031.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_031.mzML SUBJECT_SAMPLE_FACTORS - H-2K0G9-PH-00 Sample type:HHEAR_H-2K0G9-PH-00 Biospecimen=Plasma; Run_Order=32; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_032; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_032; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_032; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_032; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_032.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_032.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_032.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_032.mzML SUBJECT_SAMPLE_FACTORS - H-2K215-PH-00 Sample type:HHEAR_H-2K215-PH-00 Biospecimen=Plasma; Run_Order=33; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_033; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_033; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_033; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_033; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_033.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_033.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_033.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_033.mzML SUBJECT_SAMPLE_FACTORS - H-2K5V1-PH-00 Sample type:HHEAR_H-2K5V1-PH-00 Biospecimen=Plasma; Run_Order=34; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_034; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_034; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_034; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_034; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_034.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_034.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_034.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_034.mzML SUBJECT_SAMPLE_FACTORS - H-2K7T3-PH-00 Sample type:HHEAR_H-2K7T3-PH-00 Biospecimen=Plasma; Run_Order=35; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_035; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_035; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_035; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_035; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_035.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_035.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_035.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_035.mzML SUBJECT_SAMPLE_FACTORS - H-2K4T6-PH-00 Sample type:HHEAR_H-2K4T6-PH-00 Biospecimen=Plasma; Run_Order=36; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_036; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_036; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_036; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_036; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_036.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_036.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_036.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_036.mzML SUBJECT_SAMPLE_FACTORS - H-2K7B3-PH-00 Sample type:HHEAR_H-2K7B3-PH-00 Biospecimen=Plasma; Run_Order=37; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_037; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_037; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_037; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_037; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_037.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_037.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_037.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_037.mzML SUBJECT_SAMPLE_FACTORS - H-2K1L7-PH-00 Sample type:HHEAR_H-2K1L7-PH-00 Biospecimen=Plasma; Run_Order=38; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_038; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_038; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_038; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_038; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_038.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_038.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_038.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_038.mzML SUBJECT_SAMPLE_FACTORS - H-2K595-PH-00 Sample type:HHEAR_H-2K595-PH-00 Biospecimen=Plasma; Run_Order=39; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_039; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_039; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_039; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_039; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_039.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_039.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_039.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_039.mzML SUBJECT_SAMPLE_FACTORS - H-2K777-PH-00 Sample type:HHEAR_H-2K777-PH-00 Biospecimen=Plasma; Run_Order=40; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_040; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_040; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_040; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_040; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_040.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_040.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_040.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_040.mzML SUBJECT_SAMPLE_FACTORS - H-2K7P2-PH-00 Sample type:HHEAR_H-2K7P2-PH-00 Biospecimen=Plasma; Run_Order=41; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_041; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_041; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_041; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_041; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_041.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_041.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_041.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_041.mzML SUBJECT_SAMPLE_FACTORS - H-2K3W1-PH-00 Sample type:HHEAR_H-2K3W1-PH-00 Biospecimen=Plasma; Run_Order=42; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_042; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_042; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_042; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_042; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_042.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_042.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_042.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_042.mzML SUBJECT_SAMPLE_FACTORS - H-2K4U4-PH-00 Sample type:HHEAR_H-2K4U4-PH-00 Biospecimen=Plasma; Run_Order=43; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_043; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_043; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_043; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_043; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_043.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_043.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_043.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_043.mzML SUBJECT_SAMPLE_FACTORS - H-2K3U5-PH-00 Sample type:HHEAR_H-2K3U5-PH-00 Biospecimen=Plasma; Run_Order=44; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_044; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_044; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_044; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_044; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_044.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_044.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_044.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_044.mzML SUBJECT_SAMPLE_FACTORS - H-6EE15-PH-00 Sample type:HHEAR_H-6EE15-PH-00 Biospecimen=Plasma; Run_Order=45; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_045; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_045; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_045; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_045; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_045.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_045.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_045.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_045.mzML SUBJECT_SAMPLE_FACTORS - H-2K7J5-PH-00 Sample type:HHEAR_H-2K7J5-PH-00 Biospecimen=Plasma; Run_Order=46; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_046; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_046; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_046; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_046; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_046.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_046.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_046.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_046.mzML SUBJECT_SAMPLE_FACTORS - H-2K124-PH-00 Sample type:HHEAR_H-2K124-PH-00 Biospecimen=Plasma; Run_Order=47; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_047; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_047; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_047; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_047; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_047.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_047.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_047.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_047.mzML SUBJECT_SAMPLE_FACTORS - H-2K0M6-PH-00 Sample type:HHEAR_H-2K0M6-PH-00 Biospecimen=Plasma; Run_Order=48; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_048; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_048; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_048; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_048; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_048.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_048.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_048.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_048.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P1_20_01_3 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=49; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_049; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_049; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_049; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_049; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_049.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_049.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_049.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_049.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P2_50_01_3 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=50; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_050; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_050; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_050; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_050; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_050.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_050.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_050.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_050.mzML SUBJECT_SAMPLE_FACTORS - H-2K7W7-PH-00 Sample type:HHEAR_H-2K7W7-PH-00 Biospecimen=Plasma; Run_Order=51; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_051; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_051; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_051; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_051; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_051.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_051.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_051.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_051.mzML SUBJECT_SAMPLE_FACTORS - H-2K5X6-PH-00 Sample type:HHEAR_H-2K5X6-PH-00 Biospecimen=Plasma; Run_Order=52; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_052; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_052; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_052; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_052; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_052.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_052.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_052.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_052.mzML SUBJECT_SAMPLE_FACTORS - H-2K140-PH-00 Sample type:HHEAR_H-2K140-PH-00 Biospecimen=Plasma; Run_Order=53; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_053; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_053; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_053; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_053; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_053.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_053.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_053.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_053.mzML SUBJECT_SAMPLE_FACTORS - H-2K4P5-PH-00 Sample type:HHEAR_H-2K4P5-PH-00 Biospecimen=Plasma; Run_Order=54; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_054; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_054; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_054; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_054; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_054.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_054.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_054.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_054.mzML SUBJECT_SAMPLE_FACTORS - H-2K066-PH-00 Sample type:HHEAR_H-2K066-PH-00 Biospecimen=Plasma; Run_Order=55; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_055; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_055; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_055; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_055; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_055.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_055.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_055.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_055.mzML SUBJECT_SAMPLE_FACTORS - H-2K561-PH-00 Sample type:HHEAR_H-2K561-PH-00 Biospecimen=Plasma; Run_Order=56; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_056; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_056; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_056; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_056; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_056.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_056.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_056.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_056.mzML SUBJECT_SAMPLE_FACTORS - H-2K538-PH-00 Sample type:HHEAR_H-2K538-PH-00 Biospecimen=Plasma; Run_Order=57; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_057; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_057; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_057; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_057; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_057.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_057.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_057.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_057.mzML SUBJECT_SAMPLE_FACTORS - H-2K2A0-PH-00 Sample type:HHEAR_H-2K2A0-PH-00 Biospecimen=Plasma; Run_Order=58; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_058; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_058; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_058; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_058; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_058.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_058.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_058.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_058.mzML SUBJECT_SAMPLE_FACTORS - H-2K0W4-PH-00 Sample type:HHEAR_H-2K0W4-PH-00 Biospecimen=Plasma; Run_Order=59; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_059; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_059; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_059; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_059; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_059.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_059.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_059.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_059.mzML SUBJECT_SAMPLE_FACTORS - H-2K058-PH-00 Sample type:HHEAR_H-2K058-PH-00 Biospecimen=Plasma; Run_Order=60; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_060; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_060; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_060; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_060; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_060.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_060.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_060.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_060.mzML SUBJECT_SAMPLE_FACTORS - H-2K2C6-PH-00 Sample type:HHEAR_H-2K2C6-PH-00 Biospecimen=Plasma; Run_Order=61; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_061; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_061; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_061; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_061; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_061.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_061.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_061.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_061.mzML SUBJECT_SAMPLE_FACTORS - H-2JZR5-PH-00 Sample type:HHEAR_H-2JZR5-PH-00 Biospecimen=Plasma; Run_Order=62; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_062; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_062; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_062; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_062; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_062.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_062.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_062.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_062.mzML SUBJECT_SAMPLE_FACTORS - H-2K4H3-PH-00 Sample type:HHEAR_H-2K4H3-PH-00 Biospecimen=Plasma; Run_Order=63; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_063; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_063; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_063; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_063; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_063.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_063.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_063.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_063.mzML SUBJECT_SAMPLE_FACTORS - H-2K264-PH-00 Sample type:HHEAR_H-2K264-PH-00 Biospecimen=Plasma; Run_Order=64; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_064; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_064; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_064; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_064; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_064.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_064.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_064.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_064.mzML SUBJECT_SAMPLE_FACTORS - H-2K6C2-PH-00 Sample type:HHEAR_H-2K6C2-PH-00 Biospecimen=Plasma; Run_Order=65; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_065; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_065; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_065; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_065; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_065.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_065.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_065.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_065.mzML SUBJECT_SAMPLE_FACTORS - H-2JZQ7-PH-00 Sample type:HHEAR_H-2JZQ7-PH-00 Biospecimen=Plasma; Run_Order=66; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_066; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_066; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_066; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_066; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_066.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_066.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_066.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_066.mzML SUBJECT_SAMPLE_FACTORS - H-2JZ25-PH-00 Sample type:HHEAR_H-2JZ25-PH-00 Biospecimen=Plasma; Run_Order=67; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_067; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_067; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_067; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_067; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_067.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_067.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_067.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_067.mzML SUBJECT_SAMPLE_FACTORS - H-2K2U6-PH-00 Sample type:HHEAR_H-2K2U6-PH-00 Biospecimen=Plasma; Run_Order=68; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_068; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_068; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_068; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_068; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_068.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_068.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_068.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_068.mzML SUBJECT_SAMPLE_FACTORS - H-2JYR6-PH-00 Sample type:HHEAR_H-2JYR6-PH-00 Biospecimen=Plasma; Run_Order=69; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_069; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_069; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_069; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_069; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_069.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_069.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_069.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_069.mzML SUBJECT_SAMPLE_FACTORS - H-2JYK1-PH-00 Sample type:HHEAR_H-2JYK1-PH-00 Biospecimen=Plasma; Run_Order=70; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_070; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_070; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_070; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_070; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_070.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_070.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_070.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_070.mzML SUBJECT_SAMPLE_FACTORS - H-2K223-PH-00 Sample type:HHEAR_H-2K223-PH-00 Biospecimen=Plasma; Run_Order=71; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_071; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_071; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_071; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_071; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_071.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_071.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_071.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_071.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P1_20_01_4 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=72; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_072; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_072; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_072; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_072; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_072.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_072.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_072.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_072.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P2_50_01_4 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=73; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_073; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_073; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_073; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_073; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_073.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_073.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_073.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_073.mzML SUBJECT_SAMPLE_FACTORS - H-2K0V6-PH-00 Sample type:HHEAR_H-2K0V6-PH-00 Biospecimen=Plasma; Run_Order=74; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_074; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_074; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_074; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_074; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_074.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_074.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_074.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_074.mzML SUBJECT_SAMPLE_FACTORS - H-2JWX4-PH-00 Sample type:HHEAR_H-2JWX4-PH-00 Biospecimen=Plasma; Run_Order=75; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_075; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_075; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_075; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_075; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_075.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_075.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_075.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_075.mzML SUBJECT_SAMPLE_FACTORS - H-2K454-PH-00 Sample type:HHEAR_H-2K454-PH-00 Biospecimen=Plasma; Run_Order=76; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_076; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_076; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_076; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_076; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_076.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_076.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_076.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_076.mzML SUBJECT_SAMPLE_FACTORS - H-2K462-PH-00 Sample type:HHEAR_H-2K462-PH-00 Biospecimen=Plasma; Run_Order=77; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_077; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_077; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_077; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_077; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_077.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_077.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_077.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_077.mzML SUBJECT_SAMPLE_FACTORS - H-2JWW7-PH-00 Sample type:HHEAR_H-2JWW7-PH-00 Biospecimen=Plasma; Run_Order=78; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_078; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_078; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_078; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_078; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_078.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_078.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_078.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_078.mzML SUBJECT_SAMPLE_FACTORS - H-2K157-PH-00 Sample type:HHEAR_H-2K157-PH-00 Biospecimen=Plasma; Run_Order=79; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_079; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_079; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_079; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_079; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_079.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_079.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_079.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_079.mzML SUBJECT_SAMPLE_FACTORS - H-2K6A6-PH-00 Sample type:HHEAR_H-2K6A6-PH-00 Biospecimen=Plasma; Run_Order=80; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_080; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_080; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_080; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_080; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_080.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_080.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_080.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_080.mzML SUBJECT_SAMPLE_FACTORS - H-2K298-PH-00 Sample type:HHEAR_H-2K298-PH-00 Biospecimen=Plasma; Run_Order=81; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_081; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_081; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_081; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_081; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_081.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_081.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_081.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_081.mzML SUBJECT_SAMPLE_FACTORS - H-2K6R9-PH-00 Sample type:HHEAR_H-2K6R9-PH-00 Biospecimen=Plasma; Run_Order=82; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_082; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_082; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_082; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_082; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_082.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_082.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_082.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_082.mzML SUBJECT_SAMPLE_FACTORS - H-2JX01-PH-00 Sample type:HHEAR_H-2JX01-PH-00 Biospecimen=Plasma; Run_Order=83; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_083; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_083; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_083; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_083; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_083.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_083.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_083.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_083.mzML SUBJECT_SAMPLE_FACTORS - H-2K5G4-PH-00 Sample type:HHEAR_H-2K5G4-PH-00 Biospecimen=Plasma; Run_Order=84; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_084; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_084; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_084; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_084; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_084.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_084.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_084.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_084.mzML SUBJECT_SAMPLE_FACTORS - H-2K0L8-PH-00 Sample type:HHEAR_H-2K0L8-PH-00 Biospecimen=Plasma; Run_Order=85; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_085; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_085; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_085; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_085; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_085.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_085.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_085.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_085.mzML SUBJECT_SAMPLE_FACTORS - H-2JYY0-PH-00 Sample type:HHEAR_H-2JYY0-PH-00 Biospecimen=Plasma; Run_Order=86; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_086; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_086; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_086; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_086; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_086.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_086.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_086.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_086.mzML SUBJECT_SAMPLE_FACTORS - H-2K132-PH-00 Sample type:HHEAR_H-2K132-PH-00 Biospecimen=Plasma; Run_Order=87; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_087; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_087; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_087; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_087; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_087.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_087.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_087.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_087.mzML SUBJECT_SAMPLE_FACTORS - H-2K439-PH-00 Sample type:HHEAR_H-2K439-PH-00 Biospecimen=Plasma; Run_Order=88; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_088; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_088; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_088; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_088; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_088.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_088.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_088.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_088.mzML SUBJECT_SAMPLE_FACTORS - H-2K801-PH-00 Sample type:HHEAR_H-2K801-PH-00 Biospecimen=Plasma; Run_Order=89; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_089; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_089; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_089; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_089; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_089.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_089.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_089.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_089.mzML SUBJECT_SAMPLE_FACTORS - H-2K4D1-PH-00 Sample type:HHEAR_H-2K4D1-PH-00 Biospecimen=Plasma; Run_Order=90; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_090; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_090; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_090; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_090; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_090.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_090.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_090.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_090.mzML SUBJECT_SAMPLE_FACTORS - H-2K025-PH-00 Sample type:HHEAR_H-2K025-PH-00 Biospecimen=Plasma; Run_Order=91; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_091; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_091; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_091; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_091; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_091.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_091.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_091.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_091.mzML SUBJECT_SAMPLE_FACTORS - H-2K7Q0-PH-00 Sample type:HHEAR_H-2K7Q0-PH-00 Biospecimen=Plasma; Run_Order=92; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_092; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_092; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_092; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_092; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_092.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_092.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_092.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_092.mzML SUBJECT_SAMPLE_FACTORS - H-2JZ66-PH-00 Sample type:HHEAR_H-2JZ66-PH-00 Biospecimen=Plasma; Run_Order=93; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_093; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_093; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_093; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_093; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_093.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_093.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_093.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_093.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P1_20_01_5 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=94; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_094; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_094; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_094; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_094; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_094.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_094.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_094.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_094.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P2_50_01_5 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=95; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_095; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_095; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_095; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_095; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_095.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_095.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_095.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_095.mzML SUBJECT_SAMPLE_FACTORS - Water_blank_01_2 Sample type:Blank_H2O Biospecimen=Matrix; Run_Order=96; Batch=1; FileNameZHN=HRE_HFX_221011_HRE0047_HILICneg_096; FileNameRPP=HRE_HFX_221004_HRE0047_C18pos_096; FileNameZHP=HRE_HFX_221011_HRE0047_HILICpos_096; FileNameRPN=HRE_HFX_221004_HRE0047_C18neg_096; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICneg_096.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18pos_096.mzML; RAW_FILE_NAME=HRE_HFX_221011_HRE0047_HILICpos_096.mzML; RAW_FILE_NAME=HRE_HFX_221004_HRE0047_C18neg_096.mzML SUBJECT_SAMPLE_FACTORS - Water_blank_02_1 Sample type:Blank_H2O Biospecimen=Matrix; Run_Order=1; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_001; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_001; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_001; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_001; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_001.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_001.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_001.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_001.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P1_20_02_1 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=2; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_002; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_002; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_002; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_002; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_002.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_002.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_002.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_002.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P2_50_02_1 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=3; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_003; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_003; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_003; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_003; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_003.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_003.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_003.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_003.mzML SUBJECT_SAMPLE_FACTORS - H-6EF89-PH-00 Sample type:HHEAR_H-6EF89-PH-00 Biospecimen=Plasma; Run_Order=4; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_004; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_004; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_004; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_004; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_004.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_004.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_004.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_004.mzML SUBJECT_SAMPLE_FACTORS - H-BU6E9-PH-00 Sample type:HHEAR_H-BU6E9-PH-00 Biospecimen=Plasma; Run_Order=5; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_005; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_005; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_005; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_005; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_005.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_005.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_005.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_005.mzML SUBJECT_SAMPLE_FACTORS - H-9K5J0-PH-00 Sample type:HHEAR_H-9K5J0-PH-00 Biospecimen=Plasma; Run_Order=6; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_006; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_006; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_006; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_006; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_006.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_006.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_006.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_006.mzML SUBJECT_SAMPLE_FACTORS - H-6EJL1-PH-00 Sample type:HHEAR_H-6EJL1-PH-00 Biospecimen=Plasma; Run_Order=7; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_007; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_007; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_007; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_007; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_007.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_007.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_007.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_007.mzML SUBJECT_SAMPLE_FACTORS - H-6DS21-PH-00 Sample type:HHEAR_H-6DS21-PH-00 Biospecimen=Plasma; Run_Order=8; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_008; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_008; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_008; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_008; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_008.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_008.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_008.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_008.mzML SUBJECT_SAMPLE_FACTORS - H-6EMA2-PH-00 Sample type:HHEAR_H-6EMA2-PH-00 Biospecimen=Plasma; Run_Order=9; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_009; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_009; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_009; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_009; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_009.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_009.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_009.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_009.mzML SUBJECT_SAMPLE_FACTORS - H-6ED08-PH-00 Sample type:HHEAR_H-6ED08-PH-00 Biospecimen=Plasma; Run_Order=10; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_010; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_010; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_010; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_010; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_010.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_010.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_010.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_010.mzML SUBJECT_SAMPLE_FACTORS - H-6E4G4-PH-00 Sample type:HHEAR_H-6E4G4-PH-00 Biospecimen=Plasma; Run_Order=11; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_011; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_011; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_011; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_011; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_011.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_011.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_011.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_011.mzML SUBJECT_SAMPLE_FACTORS - H-6EBL9-PH-00 Sample type:HHEAR_H-6EBL9-PH-00 Biospecimen=Plasma; Run_Order=12; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_012; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_012; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_012; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_012; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_012.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_012.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_012.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_012.mzML SUBJECT_SAMPLE_FACTORS - H-BGRT9-PH-00 Sample type:HHEAR_H-BGRT9-PH-00 Biospecimen=Plasma; Run_Order=13; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_013; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_013; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_013; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_013; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_013.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_013.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_013.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_013.mzML SUBJECT_SAMPLE_FACTORS - H-6EHT5-PH-00 Sample type:HHEAR_H-6EHT5-PH-00 Biospecimen=Plasma; Run_Order=14; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_014; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_014; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_014; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_014; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_014.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_014.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_014.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_014.mzML SUBJECT_SAMPLE_FACTORS - H-6DNJ3-PH-00 Sample type:HHEAR_H-6DNJ3-PH-00 Biospecimen=Plasma; Run_Order=15; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_015; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_015; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_015; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_015; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_015.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_015.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_015.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_015.mzML SUBJECT_SAMPLE_FACTORS - H-JDQC6-PH-00 Sample type:HHEAR_H-JDQC6-PH-00 Biospecimen=Plasma; Run_Order=16; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_016; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_016; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_016; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_016; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_016.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_016.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_016.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_016.mzML SUBJECT_SAMPLE_FACTORS - H-6EAW6-PH-00 Sample type:HHEAR_H-6EAW6-PH-00 Biospecimen=Plasma; Run_Order=17; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_017; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_017; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_017; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_017; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_017.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_017.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_017.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_017.mzML SUBJECT_SAMPLE_FACTORS - H-6DK52-PH-00 Sample type:HHEAR_H-6DK52-PH-00 Biospecimen=Plasma; Run_Order=18; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_018; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_018; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_018; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_018; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_018.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_018.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_018.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_018.mzML SUBJECT_SAMPLE_FACTORS - H-8CZF1-PH-00 Sample type:HHEAR_H-8CZF1-PH-00 Biospecimen=Plasma; Run_Order=19; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_019; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_019; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_019; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_019; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_019.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_019.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_019.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_019.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P1_20_02_2 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=20; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_020; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_020; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_020; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_020; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_020.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_020.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_020.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_020.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P2_50_02_2 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=21; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_021; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_021; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_021; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_021; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_021.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_021.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_021.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_021.mzML SUBJECT_SAMPLE_FACTORS - H-6EK76-PH-00 Sample type:HHEAR_H-6EK76-PH-00 Biospecimen=Plasma; Run_Order=22; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_022; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_022; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_022; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_022; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_022.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_022.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_022.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_022.mzML SUBJECT_SAMPLE_FACTORS - H-YTAE7-PH-00 Sample type:HHEAR_H-YTAE7-PH-00 Biospecimen=Plasma; Run_Order=23; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_023; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_023; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_023; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_023; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_023.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_023.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_023.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_023.mzML SUBJECT_SAMPLE_FACTORS - H-6E0X0-PH-00 Sample type:HHEAR_H-6E0X0-PH-00 Biospecimen=Plasma; Run_Order=24; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_024; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_024; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_024; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_024; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_024.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_024.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_024.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_024.mzML SUBJECT_SAMPLE_FACTORS - H-UE817-PH-00 Sample type:HHEAR_H-UE817-PH-00 Biospecimen=Plasma; Run_Order=25; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_025; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_025; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_025; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_025; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_025.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_025.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_025.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_025.mzML SUBJECT_SAMPLE_FACTORS - H-6DR89-PH-00 Sample type:HHEAR_H-6DR89-PH-00 Biospecimen=Plasma; Run_Order=26; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_026; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_026; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_026; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_026; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_026.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_026.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_026.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_026.mzML SUBJECT_SAMPLE_FACTORS - H-S0393-PH-00 Sample type:HHEAR_H-S0393-PH-00 Biospecimen=Plasma; Run_Order=27; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_027; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_027; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_027; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_027; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_027.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_027.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_027.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_027.mzML SUBJECT_SAMPLE_FACTORS - H-6DW19-PH-00 Sample type:HHEAR_H-6DW19-PH-00 Biospecimen=Plasma; Run_Order=28; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_028; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_028; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_028; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_028; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_028.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_028.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_028.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_028.mzML SUBJECT_SAMPLE_FACTORS - H-6DQH5-PH-00 Sample type:HHEAR_H-6DQH5-PH-00 Biospecimen=Plasma; Run_Order=29; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_029; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_029; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_029; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_029; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_029.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_029.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_029.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_029.mzML SUBJECT_SAMPLE_FACTORS - H-D2R10-PH-00 Sample type:HHEAR_H-D2R10-PH-00 Biospecimen=Plasma; Run_Order=30; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_030; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_030; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_030; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_030; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_030.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_030.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_030.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_030.mzML SUBJECT_SAMPLE_FACTORS - H-WPVY3-PH-00 Sample type:HHEAR_H-WPVY3-PH-00 Biospecimen=Plasma; Run_Order=31; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_031; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_031; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_031; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_031; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_031.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_031.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_031.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_031.mzML SUBJECT_SAMPLE_FACTORS - H-6DVA5-PH-00 Sample type:HHEAR_H-6DVA5-PH-00 Biospecimen=Plasma; Run_Order=32; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_032; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_032; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_032; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_032; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_032.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_032.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_032.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_032.mzML SUBJECT_SAMPLE_FACTORS - H-6ELQ8-PH-00 Sample type:HHEAR_H-6ELQ8-PH-00 Biospecimen=Plasma; Run_Order=33; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_033; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_033; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_033; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_033; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_033.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_033.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_033.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_033.mzML SUBJECT_SAMPLE_FACTORS - H-P5AX2-PH-00 Sample type:HHEAR_H-P5AX2-PH-00 Biospecimen=Plasma; Run_Order=34; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_034; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_034; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_034; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_034; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_034.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_034.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_034.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_034.mzML SUBJECT_SAMPLE_FACTORS - H-2K843-PH-00 Sample type:HHEAR_H-2K843-PH-00 Biospecimen=Plasma; Run_Order=35; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_035; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_035; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_035; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_035; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_035.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_035.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_035.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_035.mzML SUBJECT_SAMPLE_FACTORS - H-6EK01-PH-00 Sample type:HHEAR_H-6EK01-PH-00 Biospecimen=Plasma; Run_Order=36; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_036; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_036; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_036; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_036; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_036.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_036.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_036.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_036.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P1_20_02_3 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=37; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_037; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_037; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_037; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_037; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_037.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_037.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_037.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_037.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P2_50_02_3 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=38; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_038; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_038; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_038; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_038; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_038.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_038.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_038.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_038.mzML SUBJECT_SAMPLE_FACTORS - H-YEZ27-PH-00 Sample type:HHEAR_H-YEZ27-PH-00 Biospecimen=Plasma; Run_Order=39; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_039; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_039; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_039; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_039; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_039.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_039.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_039.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_039.mzML SUBJECT_SAMPLE_FACTORS - H-4M3Q8-PH-00 Sample type:HHEAR_H-4M3Q8-PH-00 Biospecimen=Plasma; Run_Order=40; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_040; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_040; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_040; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_040; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_040.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_040.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_040.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_040.mzML SUBJECT_SAMPLE_FACTORS - H-MUPA1-PH-00 Sample type:HHEAR_H-MUPA1-PH-00 Biospecimen=Plasma; Run_Order=41; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_041; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_041; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_041; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_041; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_041.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_041.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_041.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_041.mzML SUBJECT_SAMPLE_FACTORS - H-6DUV0-PH-00 Sample type:HHEAR_H-6DUV0-PH-00 Biospecimen=Plasma; Run_Order=42; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_042; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_042; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_042; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_042; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_042.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_042.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_042.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_042.mzML SUBJECT_SAMPLE_FACTORS - H-6DXR6-PH-00 Sample type:HHEAR_H-6DXR6-PH-00 Biospecimen=Plasma; Run_Order=43; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_043; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_043; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_043; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_043; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_043.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_043.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_043.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_043.mzML SUBJECT_SAMPLE_FACTORS - H-SSV91-PH-00 Sample type:HHEAR_H-SSV91-PH-00 Biospecimen=Plasma; Run_Order=44; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_044; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_044; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_044; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_044; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_044.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_044.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_044.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_044.mzML SUBJECT_SAMPLE_FACTORS - H-CJMW0-PH-00 Sample type:HHEAR_H-CJMW0-PH-00 Biospecimen=Plasma; Run_Order=45; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_045; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_045; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_045; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_045; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_045.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_045.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_045.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_045.mzML SUBJECT_SAMPLE_FACTORS - H-K00C2-PH-00 Sample type:HHEAR_H-K00C2-PH-00 Biospecimen=Plasma; Run_Order=46; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_046; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_046; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_046; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_046; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_046.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_046.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_046.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_046.mzML SUBJECT_SAMPLE_FACTORS - H-CG704-PH-00 Sample type:HHEAR_H-CG704-PH-00 Biospecimen=Plasma; Run_Order=47; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_047; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_047; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_047; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_047; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_047.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_047.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_047.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_047.mzML SUBJECT_SAMPLE_FACTORS - H-6ECY9-PH-00 Sample type:HHEAR_H-6ECY9-PH-00 Biospecimen=Plasma; Run_Order=48; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_048; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_048; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_048; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_048; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_048.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_048.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_048.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_048.mzML SUBJECT_SAMPLE_FACTORS - H-6E4J7-PH-00 Sample type:HHEAR_H-6E4J7-PH-00 Biospecimen=Plasma; Run_Order=49; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_049; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_049; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_049; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_049; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_049.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_049.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_049.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_049.mzML SUBJECT_SAMPLE_FACTORS - H-6DP16-PH-00 Sample type:HHEAR_H-6DP16-PH-00 Biospecimen=Plasma; Run_Order=50; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_050; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_050; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_050; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_050; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_050.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_050.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_050.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_050.mzML SUBJECT_SAMPLE_FACTORS - H-6EJ85-PH-00 Sample type:HHEAR_H-6EJ85-PH-00 Biospecimen=Plasma; Run_Order=51; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_051; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_051; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_051; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_051; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_051.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_051.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_051.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_051.mzML SUBJECT_SAMPLE_FACTORS - H-6DZY8-PH-00 Sample type:HHEAR_H-6DZY8-PH-00 Biospecimen=Plasma; Run_Order=52; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_052; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_052; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_052; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_052; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_052.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_052.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_052.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_052.mzML SUBJECT_SAMPLE_FACTORS - H-6DSF7-PH-00 Sample type:HHEAR_H-6DSF7-PH-00 Biospecimen=Plasma; Run_Order=53; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_053; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_053; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_053; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_053; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_053.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_053.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_053.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_053.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P1_20_02_4 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=54; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_054; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_054; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_054; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_054; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_054.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_054.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_054.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_054.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P2_50_02_4 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=55; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_055; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_055; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_055; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_055; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_055.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_055.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_055.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_055.mzML SUBJECT_SAMPLE_FACTORS - H-6ELB1-PH-00 Sample type:HHEAR_H-6ELB1-PH-00 Biospecimen=Plasma; Run_Order=56; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_056; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_056; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_056; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_056; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_056.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_056.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_056.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_056.mzML SUBJECT_SAMPLE_FACTORS - H-2K884-PH-00 Sample type:HHEAR_H-2K884-PH-00 Biospecimen=Plasma; Run_Order=57; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_057; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_057; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_057; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_057; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_057.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_057.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_057.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_057.mzML SUBJECT_SAMPLE_FACTORS - H-6E2G6-PH-00 Sample type:HHEAR_H-6E2G6-PH-00 Biospecimen=Plasma; Run_Order=58; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_058; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_058; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_058; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_058; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_058.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_058.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_058.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_058.mzML SUBJECT_SAMPLE_FACTORS - H-6E537-PH-00 Sample type:HHEAR_H-6E537-PH-00 Biospecimen=Plasma; Run_Order=59; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_059; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_059; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_059; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_059; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_059.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_059.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_059.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_059.mzML SUBJECT_SAMPLE_FACTORS - H-VTVD1-PH-00 Sample type:HHEAR_H-VTVD1-PH-00 Biospecimen=Plasma; Run_Order=60; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_060; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_060; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_060; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_060; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_060.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_060.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_060.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_060.mzML SUBJECT_SAMPLE_FACTORS - H-6E958-PH-00 Sample type:HHEAR_H-6E958-PH-00 Biospecimen=Plasma; Run_Order=61; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_061; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_061; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_061; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_061; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_061.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_061.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_061.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_061.mzML SUBJECT_SAMPLE_FACTORS - H-K3CQ6-PH-00 Sample type:HHEAR_H-K3CQ6-PH-00 Biospecimen=Plasma; Run_Order=62; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_062; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_062; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_062; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_062; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_062.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_062.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_062.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_062.mzML SUBJECT_SAMPLE_FACTORS - H-XM2W0-PH-00 Sample type:HHEAR_H-XM2W0-PH-00 Biospecimen=Plasma; Run_Order=63; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_063; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_063; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_063; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_063; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_063.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_063.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_063.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_063.mzML SUBJECT_SAMPLE_FACTORS - H-6DLS5-PH-00 Sample type:HHEAR_H-6DLS5-PH-00 Biospecimen=Plasma; Run_Order=64; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_064; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_064; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_064; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_064; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_064.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_064.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_064.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_064.mzML SUBJECT_SAMPLE_FACTORS - H-2K850-PH-00 Sample type:HHEAR_H-2K850-PH-00 Biospecimen=Plasma; Run_Order=65; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_065; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_065; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_065; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_065; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_065.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_065.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_065.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_065.mzML SUBJECT_SAMPLE_FACTORS - H-6EG88-PH-00 Sample type:HHEAR_H-6EG88-PH-00 Biospecimen=Plasma; Run_Order=66; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_066; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_066; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_066; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_066; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_066.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_066.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_066.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_066.mzML SUBJECT_SAMPLE_FACTORS - H-6DWU0-PH-00 Sample type:HHEAR_H-6DWU0-PH-00 Biospecimen=Plasma; Run_Order=67; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_067; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_067; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_067; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_067; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_067.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_067.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_067.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_067.mzML SUBJECT_SAMPLE_FACTORS - H-6DX67-PH-00 Sample type:HHEAR_H-6DX67-PH-00 Biospecimen=Plasma; Run_Order=68; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_068; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_068; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_068; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_068; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_068.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_068.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_068.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_068.mzML SUBJECT_SAMPLE_FACTORS - H-6DU11-PH-00 Sample type:HHEAR_H-6DU11-PH-00 Biospecimen=Plasma; Run_Order=69; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_069; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_069; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_069; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_069; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_069.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_069.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_069.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_069.mzML SUBJECT_SAMPLE_FACTORS - H-6DT79-PH-00 Sample type:HHEAR_H-6DT79-PH-00 Biospecimen=Plasma; Run_Order=70; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_070; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_070; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_070; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_070; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_070.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_070.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_070.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_070.mzML SUBJECT_SAMPLE_FACTORS - H-FLQM1-PH-00 Sample type:HHEAR_H-FLQM1-PH-00 Biospecimen=Plasma; Run_Order=71; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_071; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_071; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_071; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_071; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_071.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_071.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_071.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_071.mzML SUBJECT_SAMPLE_FACTORS - H-6DK03-PH-00 Sample type:HHEAR_H-6DK03-PH-00 Biospecimen=Plasma; Run_Order=72; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_072; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_072; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_072; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_072; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_072.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_072.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_072.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_072.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P1_20_02_5 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=73; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_073; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_073; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_073; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_073; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_073.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_073.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_073.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_073.mzML SUBJECT_SAMPLE_FACTORS - HHEAR_P2_50_02_5 Sample type:HHEAR_ref Biospecimen=Plasma; Run_Order=74; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_074; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_074; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_074; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_074; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_074.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_074.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_074.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_074.mzML SUBJECT_SAMPLE_FACTORS - NIST_P_1950_02_1 Sample type:NIST Biospecimen=Plasma; Run_Order=75; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_075; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_075; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_075; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_075; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_075.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_075.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_075.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_075.mzML SUBJECT_SAMPLE_FACTORS - Water_blank_02_2 Sample type:Blank_H2O Biospecimen=Matrix; Run_Order=76; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_076; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_076; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_076; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_076; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_076.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_076.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_076.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_076.mzML SUBJECT_SAMPLE_FACTORS - Water_blank_02_3 Sample type:Blank_H2O Biospecimen=Matrix; Run_Order=77; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_077; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_077; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_077; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_077; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_077.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_077.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_077.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_077.mzML SUBJECT_SAMPLE_FACTORS - Water_blank_02_4 Sample type:Blank_H2O Biospecimen=Matrix; Run_Order=78; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_078; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_078; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_078; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_078; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_078.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_078.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_078.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_078.mzML SUBJECT_SAMPLE_FACTORS - Water_blank_02_5 Sample type:Blank_H2O Biospecimen=Matrix; Run_Order=79; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_079; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_079; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_079; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_079; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_079.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_079.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_079.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_079.mzML SUBJECT_SAMPLE_FACTORS - Water_blank_02_6 Sample type:Blank_H2O Biospecimen=Matrix; Run_Order=80; Batch=2; FileNameZHN=HRE_HFX_221013_HRE0047_HILICneg_080; FileNameRPP=HRE_HFX_221006_HRE0047_C18pos_080; FileNameZHP=HRE_HFX_221013_HRE0047_HILICpos_080; FileNameRPN=HRE_HFX_221006_HRE0047_C18neg_080; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICneg_080.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18pos_080.mzML; RAW_FILE_NAME=HRE_HFX_221013_HRE0047_HILICpos_080.mzML; RAW_FILE_NAME=HRE_HFX_221006_HRE0047_C18neg_080.mzML #COLLECTION CO:COLLECTION_SUMMARY plasma heparin, fasting CO:SAMPLE_TYPE Blood (plasma) #TREATMENT TR:TREATMENT_SUMMARY repeated measures following bariatric surgery. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY In allocated randomized order, plasma samples were thawed on ice. Samples were SP:SAMPLEPREP_SUMMARY analyzed in two analytical batches. Each batch contained additional QA/QC SP:SAMPLEPREP_SUMMARY samples including HHEAR untargeted plasma pool 1 and 2, NIST standard reference SP:SAMPLEPREP_SUMMARY material, and procedural blanks. All samples were prepared for analysis by SP:SAMPLEPREP_SUMMARY adding 2.50μL of an internal standard solution to 30μL of plasma (or QA/QC SP:SAMPLEPREP_SUMMARY sample), followed by 80μL of ice-cold acetonitrile to precipitate proteins. SP:SAMPLEPREP_SUMMARY Treated samples were vortexed, equilibrated on ice for 30 mins, and then SP:SAMPLEPREP_SUMMARY centrifuged for 45 min at 4680 rpm at 4 °C. The resulting supernatant was SP:SAMPLEPREP_SUMMARY diluted 2:1 with LC-MS grade water and placed in a refrigerated autosampler for SP:SAMPLEPREP_SUMMARY analysis with LC-HRMS #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY RPN CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Thermo Vanquish CH:COLUMN_NAME Higgins Analytical TARGA C18 (50 x 2.1mm,5um) CH:SOLVENT_A 97.5% acetonitrile/2.5% water CH:SOLVENT_B 100% water; 10mM ammonium acetate CH:FLOW_GRADIENT 82.50% of B until 1.50min; then from 82.50% to 2.50% of B until 5.00 min; ending CH:FLOW_GRADIENT with 2.50% of B at 7.50 min. CH:FLOW_RATE 0.400 to 0.500 mL/min CH:COLUMN_TEMPERATURE 30 #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive HF-X Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS Mass spectral data was collected using negative and positive mode over the scan MS:MS_COMMENTS range 85-1275 at 120,000 (FWHM) resolution. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS abundance MS_METABOLITE_DATA_START Samples Water_blank_01_1 NIST_P_1950_01_1 HHEAR_P1_20_01_1 HHEAR_P2_50_01_1 H-2K694-PH-00 H-2JXX3-PH-00 H-2JX43-PH-00 H-2K3H4-PH-00 H-2K7M9-PH-00 H-2K2B8-PH-00 H-2K363-PH-00 H-2JZN3-PH-00 H-2K5Y4-PH-00 H-6EPB7-PH-00 H-2K2G7-PH-00 H-2K5W9-PH-00 H-2K082-PH-00 H-2K3G6-PH-00 H-6EDR4-PH-00 H-2K7V9-PH-00 H-2K6Q1-PH-00 H-2K6L2-PH-00 H-2K3L5-PH-00 H-2K1B9-PH-00 H-2K3Q4-PH-00 HHEAR_P1_20_01_2 HHEAR_P2_50_01_2 H-2K678-PH-00 H-2K5B5-PH-00 H-2JZM6-PH-00 H-2K1V5-PH-00 H-2K0G9-PH-00 H-2K215-PH-00 H-2K5V1-PH-00 H-2K7T3-PH-00 H-2K4T6-PH-00 H-2K7B3-PH-00 H-2K1L7-PH-00 H-2K595-PH-00 H-2K777-PH-00 H-2K7P2-PH-00 H-2K3W1-PH-00 H-2K4U4-PH-00 H-2K3U5-PH-00 H-6EE15-PH-00 H-2K7J5-PH-00 H-2K124-PH-00 H-2K0M6-PH-00 HHEAR_P1_20_01_3 HHEAR_P2_50_01_3 H-2K7W7-PH-00 H-2K5X6-PH-00 H-2K140-PH-00 H-2K4P5-PH-00 H-2K066-PH-00 H-2K561-PH-00 H-2K538-PH-00 H-2K2A0-PH-00 H-2K0W4-PH-00 H-2K058-PH-00 H-2K2C6-PH-00 H-2JZR5-PH-00 H-2K4H3-PH-00 H-2K264-PH-00 H-2K6C2-PH-00 H-2JZQ7-PH-00 H-2JZ25-PH-00 H-2K2U6-PH-00 H-2JYR6-PH-00 H-2JYK1-PH-00 H-2K223-PH-00 HHEAR_P1_20_01_4 HHEAR_P2_50_01_4 H-2K0V6-PH-00 H-2JWX4-PH-00 H-2K454-PH-00 H-2K462-PH-00 H-2JWW7-PH-00 H-2K157-PH-00 H-2K6A6-PH-00 H-2K298-PH-00 H-2K6R9-PH-00 H-2JX01-PH-00 H-2K5G4-PH-00 H-2K0L8-PH-00 H-2JYY0-PH-00 H-2K132-PH-00 H-2K439-PH-00 H-2K801-PH-00 H-2K4D1-PH-00 H-2K025-PH-00 H-2K7Q0-PH-00 H-2JZ66-PH-00 HHEAR_P1_20_01_5 HHEAR_P2_50_01_5 Water_blank_01_2 Water_blank_02_1 HHEAR_P1_20_02_1 HHEAR_P2_50_02_1 H-6EF89-PH-00 H-BU6E9-PH-00 H-9K5J0-PH-00 H-6EJL1-PH-00 H-6DS21-PH-00 H-6EMA2-PH-00 H-6ED08-PH-00 H-6E4G4-PH-00 H-6EBL9-PH-00 H-BGRT9-PH-00 H-6EHT5-PH-00 H-6DNJ3-PH-00 H-JDQC6-PH-00 H-6EAW6-PH-00 H-6DK52-PH-00 H-8CZF1-PH-00 HHEAR_P1_20_02_2 HHEAR_P2_50_02_2 H-6EK76-PH-00 H-YTAE7-PH-00 H-6E0X0-PH-00 H-UE817-PH-00 H-6DR89-PH-00 H-S0393-PH-00 H-6DW19-PH-00 H-6DQH5-PH-00 H-D2R10-PH-00 H-WPVY3-PH-00 H-6DVA5-PH-00 H-6ELQ8-PH-00 H-P5AX2-PH-00 H-2K843-PH-00 H-6EK01-PH-00 HHEAR_P1_20_02_3 HHEAR_P2_50_02_3 H-YEZ27-PH-00 H-4M3Q8-PH-00 H-MUPA1-PH-00 H-6DUV0-PH-00 H-6DXR6-PH-00 H-SSV91-PH-00 H-CJMW0-PH-00 H-K00C2-PH-00 H-CG704-PH-00 H-6ECY9-PH-00 H-6E4J7-PH-00 H-6DP16-PH-00 H-6EJ85-PH-00 H-6DZY8-PH-00 H-6DSF7-PH-00 HHEAR_P1_20_02_4 HHEAR_P2_50_02_4 H-6ELB1-PH-00 H-2K884-PH-00 H-6E2G6-PH-00 H-6E537-PH-00 H-VTVD1-PH-00 H-6E958-PH-00 H-K3CQ6-PH-00 H-XM2W0-PH-00 H-6DLS5-PH-00 H-2K850-PH-00 H-6EG88-PH-00 H-6DWU0-PH-00 H-6DX67-PH-00 H-6DU11-PH-00 H-6DT79-PH-00 H-FLQM1-PH-00 H-6DK03-PH-00 HHEAR_P1_20_02_5 HHEAR_P2_50_02_5 NIST_P_1950_02_1 Water_blank_02_2 Water_blank_02_3 Water_blank_02_4 Water_blank_02_5 Water_blank_02_6 Factors Sample type:Blank_H2O Sample type:NIST Sample type:HHEAR_ref Sample type:HHEAR_ref Sample type:HHEAR_H-2K694-PH-00 Sample type:HHEAR_H-2JXX3-PH-00 Sample type:HHEAR_H-2JX43-PH-00 Sample type:HHEAR_H-2K3H4-PH-00 Sample type:HHEAR_H-2K7M9-PH-00 Sample type:HHEAR_H-2K2B8-PH-00 Sample type:HHEAR_H-2K363-PH-00 Sample type:HHEAR_H-2JZN3-PH-00 Sample type:HHEAR_H-2K5Y4-PH-00 Sample type:HHEAR_H-6EPB7-PH-00 Sample type:HHEAR_H-2K2G7-PH-00 Sample type:HHEAR_H-2K5W9-PH-00 Sample type:HHEAR_H-2K082-PH-00 Sample type:HHEAR_H-2K3G6-PH-00 Sample type:HHEAR_H-6EDR4-PH-00 Sample type:HHEAR_H-2K7V9-PH-00 Sample type:HHEAR_H-2K6Q1-PH-00 Sample type:HHEAR_H-2K6L2-PH-00 Sample type:HHEAR_H-2K3L5-PH-00 Sample type:HHEAR_H-2K1B9-PH-00 Sample type:HHEAR_H-2K3Q4-PH-00 Sample type:HHEAR_ref Sample type:HHEAR_ref Sample type:HHEAR_H-2K678-PH-00 Sample type:HHEAR_H-2K5B5-PH-00 Sample type:HHEAR_H-2JZM6-PH-00 Sample type:HHEAR_H-2K1V5-PH-00 Sample type:HHEAR_H-2K0G9-PH-00 Sample type:HHEAR_H-2K215-PH-00 Sample type:HHEAR_H-2K5V1-PH-00 Sample type:HHEAR_H-2K7T3-PH-00 Sample type:HHEAR_H-2K4T6-PH-00 Sample type:HHEAR_H-2K7B3-PH-00 Sample type:HHEAR_H-2K1L7-PH-00 Sample type:HHEAR_H-2K595-PH-00 Sample type:HHEAR_H-2K777-PH-00 Sample type:HHEAR_H-2K7P2-PH-00 Sample type:HHEAR_H-2K3W1-PH-00 Sample type:HHEAR_H-2K4U4-PH-00 Sample type:HHEAR_H-2K3U5-PH-00 Sample type:HHEAR_H-6EE15-PH-00 Sample type:HHEAR_H-2K7J5-PH-00 Sample type:HHEAR_H-2K124-PH-00 Sample type:HHEAR_H-2K0M6-PH-00 Sample type:HHEAR_ref Sample type:HHEAR_ref Sample type:HHEAR_H-2K7W7-PH-00 Sample type:HHEAR_H-2K5X6-PH-00 Sample type:HHEAR_H-2K140-PH-00 Sample type:HHEAR_H-2K4P5-PH-00 Sample type:HHEAR_H-2K066-PH-00 Sample type:HHEAR_H-2K561-PH-00 Sample type:HHEAR_H-2K538-PH-00 Sample type:HHEAR_H-2K2A0-PH-00 Sample type:HHEAR_H-2K0W4-PH-00 Sample type:HHEAR_H-2K058-PH-00 Sample type:HHEAR_H-2K2C6-PH-00 Sample type:HHEAR_H-2JZR5-PH-00 Sample type:HHEAR_H-2K4H3-PH-00 Sample type:HHEAR_H-2K264-PH-00 Sample type:HHEAR_H-2K6C2-PH-00 Sample type:HHEAR_H-2JZQ7-PH-00 Sample type:HHEAR_H-2JZ25-PH-00 Sample type:HHEAR_H-2K2U6-PH-00 Sample type:HHEAR_H-2JYR6-PH-00 Sample type:HHEAR_H-2JYK1-PH-00 Sample type:HHEAR_H-2K223-PH-00 Sample type:HHEAR_ref Sample type:HHEAR_ref Sample type:HHEAR_H-2K0V6-PH-00 Sample type:HHEAR_H-2JWX4-PH-00 Sample type:HHEAR_H-2K454-PH-00 Sample type:HHEAR_H-2K462-PH-00 Sample type:HHEAR_H-2JWW7-PH-00 Sample type:HHEAR_H-2K157-PH-00 Sample type:HHEAR_H-2K6A6-PH-00 Sample type:HHEAR_H-2K298-PH-00 Sample type:HHEAR_H-2K6R9-PH-00 Sample type:HHEAR_H-2JX01-PH-00 Sample type:HHEAR_H-2K5G4-PH-00 Sample type:HHEAR_H-2K0L8-PH-00 Sample type:HHEAR_H-2JYY0-PH-00 Sample type:HHEAR_H-2K132-PH-00 Sample type:HHEAR_H-2K439-PH-00 Sample type:HHEAR_H-2K801-PH-00 Sample type:HHEAR_H-2K4D1-PH-00 Sample type:HHEAR_H-2K025-PH-00 Sample type:HHEAR_H-2K7Q0-PH-00 Sample type:HHEAR_H-2JZ66-PH-00 Sample type:HHEAR_ref Sample type:HHEAR_ref Sample type:Blank_H2O Sample type:Blank_H2O Sample type:HHEAR_ref Sample type:HHEAR_ref Sample type:HHEAR_H-6EF89-PH-00 Sample type:HHEAR_H-BU6E9-PH-00 Sample type:HHEAR_H-9K5J0-PH-00 Sample type:HHEAR_H-6EJL1-PH-00 Sample type:HHEAR_H-6DS21-PH-00 Sample type:HHEAR_H-6EMA2-PH-00 Sample type:HHEAR_H-6ED08-PH-00 Sample type:HHEAR_H-6E4G4-PH-00 Sample type:HHEAR_H-6EBL9-PH-00 Sample type:HHEAR_H-BGRT9-PH-00 Sample type:HHEAR_H-6EHT5-PH-00 Sample type:HHEAR_H-6DNJ3-PH-00 Sample type:HHEAR_H-JDQC6-PH-00 Sample type:HHEAR_H-6EAW6-PH-00 Sample type:HHEAR_H-6DK52-PH-00 Sample type:HHEAR_H-8CZF1-PH-00 Sample type:HHEAR_ref Sample type:HHEAR_ref Sample type:HHEAR_H-6EK76-PH-00 Sample type:HHEAR_H-YTAE7-PH-00 Sample type:HHEAR_H-6E0X0-PH-00 Sample type:HHEAR_H-UE817-PH-00 Sample type:HHEAR_H-6DR89-PH-00 Sample type:HHEAR_H-S0393-PH-00 Sample type:HHEAR_H-6DW19-PH-00 Sample type:HHEAR_H-6DQH5-PH-00 Sample type:HHEAR_H-D2R10-PH-00 Sample type:HHEAR_H-WPVY3-PH-00 Sample type:HHEAR_H-6DVA5-PH-00 Sample type:HHEAR_H-6ELQ8-PH-00 Sample type:HHEAR_H-P5AX2-PH-00 Sample type:HHEAR_H-2K843-PH-00 Sample type:HHEAR_H-6EK01-PH-00 Sample type:HHEAR_ref Sample type:HHEAR_ref Sample type:HHEAR_H-YEZ27-PH-00 Sample type:HHEAR_H-4M3Q8-PH-00 Sample type:HHEAR_H-MUPA1-PH-00 Sample type:HHEAR_H-6DUV0-PH-00 Sample type:HHEAR_H-6DXR6-PH-00 Sample type:HHEAR_H-SSV91-PH-00 Sample type:HHEAR_H-CJMW0-PH-00 Sample type:HHEAR_H-K00C2-PH-00 Sample type:HHEAR_H-CG704-PH-00 Sample type:HHEAR_H-6ECY9-PH-00 Sample type:HHEAR_H-6E4J7-PH-00 Sample type:HHEAR_H-6DP16-PH-00 Sample type:HHEAR_H-6EJ85-PH-00 Sample type:HHEAR_H-6DZY8-PH-00 Sample type:HHEAR_H-6DSF7-PH-00 Sample type:HHEAR_ref Sample type:HHEAR_ref Sample type:HHEAR_H-6ELB1-PH-00 Sample type:HHEAR_H-2K884-PH-00 Sample type:HHEAR_H-6E2G6-PH-00 Sample type:HHEAR_H-6E537-PH-00 Sample type:HHEAR_H-VTVD1-PH-00 Sample type:HHEAR_H-6E958-PH-00 Sample type:HHEAR_H-K3CQ6-PH-00 Sample type:HHEAR_H-XM2W0-PH-00 Sample type:HHEAR_H-6DLS5-PH-00 Sample type:HHEAR_H-2K850-PH-00 Sample type:HHEAR_H-6EG88-PH-00 Sample type:HHEAR_H-6DWU0-PH-00 Sample type:HHEAR_H-6DX67-PH-00 Sample type:HHEAR_H-6DU11-PH-00 Sample type:HHEAR_H-6DT79-PH-00 Sample type:HHEAR_H-FLQM1-PH-00 Sample type:HHEAR_H-6DK03-PH-00 Sample type:HHEAR_ref Sample type:HHEAR_ref Sample type:NIST Sample type:Blank_H2O Sample type:Blank_H2O Sample type:Blank_H2O Sample type:Blank_H2O Sample type:Blank_H2O (−)-phenylethyl-8-O-α-L-rhamnopyranoside 60687.86251 3799241.497 3868984.472 4109279.765 3763115.449 1884641.691 3864672.834 4249674.101 1126053.289 4408912.812 5770660.522 3995426.934 2502506.342 3734688.276 4919227.342 4431413.727 5427514.683 5714165.863 1435294.686 3646648.265 6149401.912 2201969.544 4226991.721 4935531.892 4417145.045 3517040.621 4118736.803 2182243.431 1610128.94 4266158.71 5027437.789 3704583.987 1731629.136 2339910.963 2762633.068 3568987.417 2345721.791 2468099.608 2875987.77 3467865.27 5102597.988 4320963.76 2366312.885 3437501.996 2786824.145 5507851.581 2463514.137 2652189.973 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55015.87554 49466.42312 41857.74517 43334.97444 51186.06615 (4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate1 30941.31015 35893479.55 43866142.86 53397306.13 24506679.19 88433621.04 69483232.88 53715496.79 52143645.53 53893262.3 82068288.53 89655126.72 57899975.57 117618973.3 58206811.42 110268347.5 131888074.7 53818580.04 82999132.85 71510062.81 59811951.1 47438005 36157508.26 95383300.12 33212735 36937870.65 44270822.83 51075226.46 52622441.26 94947025.52 86699155.41 104594188.1 121793854.3 71105456.77 62999717.9 57907537.35 52851324.72 63017481.1 109653788.8 54967765.16 121976385.8 90384271.78 63188224.2 109955053.6 104564086.6 94046669.17 114823606 20592845.08 33051088.08 53141887.13 51969462.58 50096242.75 78320394.78 44086197.02 46659512.76 55040684.62 122374533.9 115544843.9 62266169.24 45808241.85 96963425.85 88838993.55 116098180.7 80718560.34 53482358.31 59164162.56 63450145.43 201199121.1 69717830.76 94333019.17 65609034.7 38328803.18 45951202.54 93520586.57 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1795831.134 1105069.751 940977.5728 3685257.899 1192481.269 1090834.608 2638655.851 2662698.761 2406318.265 3102556.603 1979553.223 1170507.489 5457178.897 2113582.762 4786728.397 2632369.581 4749698.828 2065798.136 2854974.84 1701783.947 3318039.918 3995001.426 2180782.73 1208127.835 1187110.924 1809123.493 56203.29514 59331.81609 26112.34969 58682.55244 83060.45804 (R)-Norcoclaurine 72062.91948 1062044.057 1134748.388 1565399.666 51702.58189 60397.51622 100529.7613 259928.7263 395405.2363 5989575.412 400515.2607 3506185.98 1425417.389 3383172.832 154686.6222 5065329.928 1384974.392 5868752.121 1659587.696 48226.90859 3814203.168 7289434.135 186188.9475 480025.9213 94738.34794 1293770.653 1849297.686 681298.3171 43554.89906 2982396.57 12910955.59 2276937.79 569302.3543 69916.98873 46135.30926 3180044.446 611128.6663 48594.60916 58579.20467 3206350.253 9898373.529 60937.10848 231932.3181 88084.18716 53135.73408 475126.186 1306982.29 144749.7301 1275506.182 2066087.898 2061666.353 979150.6167 360693.1026 4107673.354 165904.8239 525484.0882 427573.0037 535218.7683 63616.73754 8018428.414 3678776.499 3750332.072 2336566.353 49403.07657 16094805.47 7435097.795 251646.619 4999106.483 381802.0914 54447.78098 51703.4331 1486896.004 2230081.253 64982.10862 1543768.981 1107141.589 60175.11601 498912.5103 509614.3431 75826.34545 59816.87468 3276644.52 213886.3395 58966.06204 6038675.231 540463.9383 285918.0319 10395419.76 273901.1189 61619.51434 57510.45875 472850.8526 46583.92587 1263617.077 2141840.936 52930.92897 51230.05805 1454082.908 1774306.453 41116.77789 829097.5251 126477.0963 1886572.604 85156.27219 1235602.404 962995.1326 720284.2526 548075.4224 42506.56055 373271.4917 1232541.271 3905804.478 1042712.362 54083.43148 1734987.089 1704688.721 2378548.723 788709.057 104566.4342 43692.00265 87333.03225 170852.1761 1240886.034 56346.85104 2637096.007 11391117.96 1357386.625 535983.9254 669611.2614 500293.7248 1194367.761 57586.91434 1285696.055 1871634.977 780582.3467 2482773.798 4959291.813 403460.6495 1971889.725 9867706.192 4332816.684 1896843.254 137484.6812 658735.9579 7293417.817 81278.95375 56752.11433 124996.4082 193425.583 1498149.629 1719510.905 878907.7144 379570.1424 108751.8716 286404.5329 66631.4295 2224271.157 1052023.183 5097903.463 413700.6976 1275612.92 2185913.206 2157570.376 884865.6811 5855838.483 506818.8153 54823.15257 672422.0715 1637953.151 2318676.345 1507933.624 51242.21739 52120.72395 48016.72719 49314.34892 41150.72712 (S)-Abscisicacid 43007.35435 443546.7978 409869.0056 418720.9767 237497.85 786103.7903 376447.7576 298810.9501 95481.8068 191188.5688 683425.1881 504995.0317 585287.8938 307133.2249 499898.7242 469467.7596 924108.6807 263278.9668 210677.7328 746594.7141 395631.6425 259714.8045 263218.1439 796076.0368 313509.5179 393387.8564 410474.796 303965.6791 585761.8134 338454.177 391611.4323 599607.9347 343194.3627 456811.0447 784742.8846 658850.0399 372750.3316 648073.943 671329.9425 506550.6369 234270.2825 866621.931 233514.2602 905054.0735 700211.8359 584958.7103 314918.8141 286300.8558 459142.3957 471043.6694 1020790.465 241670.2828 348442.6872 441617.0813 235949.7732 871470.5932 603050.0449 960473.3094 1516807.663 651473.122 448857.9076 369120.1211 798308.5368 461540.7584 254103.6942 68052.82491 465005.538 469289.1198 391836.3385 711640.8496 800175.2784 440976.8606 506833.0048 1298891.833 157474.1778 252786.3671 422860.7096 624125.5815 621719.619 637881.4545 562389.5836 988478.0034 1210905.838 229126.7562 278563.4484 203236.2903 178839.9397 199706.4068 1173882.666 531460.3019 264107.8942 713982.3659 384565.4422 489290.8972 506234.6983 38823.72649 43868.6819 390178.0729 452146.2606 797911.4591 366239.3932 415649.6535 870633.8354 429106.6814 809966.7393 626460.5988 388204.3567 555213.3996 446120.6716 606881.9838 442285.6233 349177.1564 281170.9681 278353.0113 289024.5772 499239.9068 589148.1866 100667.7312 318093.9577 274469.7654 1087464.866 495150.629 101149.0515 390434.2252 452117.4218 145591.0161 275110.8402 495464.2797 281471.9002 230155.0531 786401.4813 209276.4128 401115.6813 482995.172 613087.0832 364079.7301 522311.2006 208173.5966 698691.8323 507107.0783 273717.7648 145576.0287 483099.0907 510936.908 222503.6546 457371.3842 1029198.378 511986.7671 227460.1871 505110.9518 500214.6724 504298.5748 727086.3355 458815.1058 142888.5345 833069.3631 377806.6558 841108.461 465174.3087 654710.4676 313634.9611 842336.1544 529722.0085 802346.4711 408870.4768 471637.2903 327257.8057 521126.9561 514634.1987 532514.8801 588230.2578 43135.15022 35585.52138 33193.9729 36627.32545 35129.28581 (S)-Carnitine 245747.4292 109211195.2 52103879.35 54908487.85 115720414.2 94360033.38 81379772.51 112217678 105948995.4 86591882.08 131111503.7 108441410.4 108449353.6 128509373.7 96412045.12 98065301.5 91175229.47 132218740.4 118636863.9 88739179.23 133118140.8 123537771.5 100822764.6 116528004.9 115650757.2 57082514.46 54933195.3 87652196.27 93380166.07 123527219.6 113920412.9 164796261 111256620.8 103278124.3 107093290.4 100669005.6 87813005.59 116827619.1 91379132.6 130933463.2 146529722.3 92816239.35 114868825.4 109630747.3 114644801.3 98173056.86 114407585.7 73669099.17 46793666.95 57493268.21 77984641.88 98915146.81 97578410.08 115925457.5 86971196.6 134907687.4 127345571.7 115818630 110258772.9 98295463.82 98104836.27 62775206.71 107339130.5 74276916.46 86566076.04 123938472.8 86107489.82 87137845.22 122961574.7 138881694.2 116437690.3 46894894.33 53418429.92 106070592.4 82424608.33 81146267.21 81725992.44 95329229.95 107924527 77716710.19 82825847.3 72043757.07 106019517.7 176679136.8 63868205.23 120303876.2 91961040.88 90767876.29 73683577.09 67831621.55 28254815.48 107290858.1 69182438.99 55138426.3 57198512.54 2007116.072 205234.0018 48017669.89 54821280.13 61730051.49 85316168.04 118186345.6 117043031 88852057.3 70780109.19 72253797.04 81167220.1 92397379.91 53826003.69 90260955.52 114925959.8 71779435.05 67626284.36 102764148.9 69216945.79 59477315.85 62499445.04 73621186.06 63845695.45 89804836.56 137947646.9 94775241.57 68175893.27 107528908.8 82042828.55 133844895.9 56643962.59 84286131.75 114136681.3 51421595.25 118766089.3 90598432.59 45090304.45 62853396.16 90462799.11 86181400.18 87129295.25 73371523.96 75378699.17 68226924.66 86045676.37 103256815.5 67469118.02 76136189.11 98050272.59 122098320.9 87163289.64 88276803.82 73367706.92 49184546.67 51190661.14 104710812.3 62729932.61 105913071.9 110890405.1 64178124.34 77424455.44 69652079.49 81555474.82 114942835.8 96872462.46 52331427.65 86942287.94 77550561.05 108323637.6 77815830.41 62368462.06 69021028.23 46365316.3 36921368.05 87833866.67 221303.7851 220631.8366 224679.9993 242002.2979 227920.0903 (Z)-hexadec-9-enenitrile 52186.48344 230042.3863 891964.7059 785196.3618 581869.6837 506219.655 207677.3447 877991.9198 588422.1408 379815.356 395113.0015 356359.2259 606503.3533 221427.3969 326929.5241 293538.8582 473222.1394 917496.1743 249322.833 387109.2028 335454.1299 465215.4633 709669.5748 731476.8998 497637.5785 930832.6933 880472.7175 458185.5066 207422.6377 442043.6247 616424.6706 415714.4678 285852.4274 637197.6849 612125.3342 534912.8494 547216.0795 480927.595 459457.59 564579.7223 473603.6326 214923.6534 203616.2877 411911.8523 161853.5463 400402.6948 371557.9485 338670.2407 777382.4615 763897.5242 640121.569 231258.7844 369861.3764 694621.5523 292880.4583 697553.1769 695732.113 525103.4313 294945.2076 377335.5571 484586.2921 674503.4205 696730.773 453141.7525 518231.6141 421377.5474 326005.1649 627262.0066 715153.4943 483222.823 416628.5734 878884.9617 833601.7283 535390.8067 454255.3226 270362.8725 445861.8245 494810.1078 205508.4499 655208.0271 246909.9556 295204.063 339286.2683 657493.96 724370.8784 368189.3797 267504.2309 530775.0803 154384.1943 255829.1362 358063.4278 302772.5634 236093.7064 797428.6237 848820.7027 52221.01128 41458.65633 833746.6611 652041.956 671915.8166 386481.3403 497316.4399 180040.0542 227587.9402 555991.6599 448631.1182 175242.5533 688993.1849 256036.4094 287796.069 288665.7516 359854.8735 485185.8045 342827.9347 1405496.658 740561.8803 886256.1968 477263.8603 336745.3836 280677.8871 376127.8335 549727.0852 339282.9009 345724.8669 401813.3622 348224.7827 425321.8421 428526.2126 732043.4047 192353.2551 392683.5613 193516.0086 819391.2505 777467.9204 436966.3544 700366.5134 335931.1981 414608.6879 529603.665 421387.9471 400045.0942 202831.1848 340365.2166 345786.2322 533682.4331 199433.7058 143139.8299 494035.6054 554724.4835 1018590.69 719125.2437 451968.7587 466938.8527 277433.0377 511114.4772 303106.4722 721933.8942 362879.3419 514474.842 419127.7619 374554.6569 651881.2799 293753.1315 750502.8697 604344.818 693483.8602 323675.8413 284573.3167 896703.2261 887290.296 361763.8553 52491.27329 83471.28273 64899.11689 48304.03467 50017.4596 (Z)-octadec-11-enenitrile 287948.0007 1215904.845 3532795.263 2811291.967 2011009.123 1866641.618 1479379.086 3137462.102 2602214.977 2123704.003 1625723.202 1723092.417 2153692.964 1565755.246 1489424.374 2434664.718 1537168.991 2494354.388 1262300.805 2437470.54 1711370.779 1528297.814 1807497.321 1779040.369 1594058.522 3439565.205 3184240.264 3404269.844 2356125.105 1436580.587 2816912.613 1382812.903 1522486.878 3067437.543 2759470.208 2270220.679 3159811.683 1616441.26 1825512.387 1914897.296 1939833.196 1655057.122 1400523.534 1627647.407 1402898.616 1092637.175 1280281.236 972703.4419 3401779.064 3804369.578 2069341.288 2512568.069 1415406.511 1609174.489 1490861.803 1739043.771 1778855.487 2192691.032 1628621.569 1374288.888 1527635.372 1984005.479 2130507.86 1726375.084 2056208.729 1973514.672 1678497.552 2456441.684 1403523.756 1605527.807 1865220.593 3014955.01 3420091.757 2389874.542 1665935.757 1332512.764 1529578.695 1361710.9 1217163.872 3152038.981 1495872.862 2325761.15 1075092.2 3033716.566 2280428.976 1100761.613 1650814.015 1446885.277 1703348.206 1588878.921 1513858.658 1436415.896 2404464.875 3313073.133 3263808.342 415934.0622 115669.3174 2447065.927 2665262.676 1588878.489 2177467.484 50033.15748 1291571.563 2592561.305 1371248.749 2872016.913 2346488.424 1250434.219 1225931.933 884602.7957 1872859.618 1541763.187 2946691.674 2890378.574 1742826.96 2939756.503 3017624.069 1787432.885 1496563.866 1107118.942 1584262.644 2775002.202 2030563.528 2184115.177 1332502.605 1139734.033 1060028.965 1261253.309 2182319.721 1714765.251 1758096.78 1456742.444 3016796.212 3291926.07 1674378.965 1715041.094 1650852.36 1938554.429 1684578.276 1372081.36 1326118.615 1331540.442 1393583.284 874998.8759 1608120.594 1391187.734 1438703.141 1890448.632 1402781.987 3593322.755 2998288.802 2395657.649 1755359.9 1838913.544 1567585.094 1302650.231 1251210.471 1537446.69 1616924.108 1339096.351 3183522.092 1996832.757 1216123.67 1888023.947 2021877.531 2969261.69 2386832.464 1528974.982 4145805.037 3423004.3 2568747.464 204960.4456 72564.2765 53833.56923 64873.12365 61856.00668 [Similar to: Taurochenodeoxycholic acid; ΔMass: -52.9942 Da] 56387.58004 677279.0222 651608.959 474522.4178 809288.5938 868106.8298 189642.0813 1417169.124 110641.6508 247983.7097 785816.8384 1201638.41 2685354.428 1119375.542 52145.79276 181679.2408 2130184.382 1888747.07 64287.71018 144762.9571 981854.9787 245050.5144 257709.3953 2881542.185 273161.8355 559691.6995 446028.802 344171.6407 53444.68718 422669.5279 1024800.087 1663442.232 311388.7786 1422840.7 426115.4356 3254937.934 99743.13241 552180.0244 388322.3821 63990.48738 390416.9326 168235.3441 613444.7944 369090.6375 748179.3866 943955.0404 828545.6642 629916.9477 602640.1709 585557.1867 283683.8608 355726.641 1840730.946 719324.1257 200121.7173 1180830.624 1533690.964 58921.10048 462855.6462 3568017.45 1204992.222 896916.697 150782.3346 3390758.798 909262.6226 58964.51893 404529.4658 2690713.68 254802.3829 604135.9786 335484.0839 604790.1234 580338.4818 1181913.586 143681.9915 882705.7278 995599.0395 397219.6762 3685118.366 1120681.394 542864.0828 775682.2149 731589.9071 1099941.661 1812554.347 73619.90636 136650.2897 1100534.76 135360.4707 1713903.723 287566.9326 1041077.451 235753.724 630238.7338 486582.7866 55193.02043 54874.10577 455946.2817 525522.8495 406025.4927 1057569.893 619270.0888 3373721.571 780360.5839 370525.9023 231201.5409 238690.6521 414750.7032 251792.3792 137691.6342 1465961.845 702472.3622 129153.819 209806.7576 195738.3177 704126.2692 560866.0754 1222814.133 718566.0414 373331.8784 790406.9866 758033.0134 991036.583 526099.1439 833968.7702 226428.4696 340492.7047 1295994.258 303899.7785 612718.3686 314449.3904 350988.9581 648887.9313 265527.6886 468729.9251 4656848.821 471680.2812 366089.6849 284560.6195 525537.763 104625.6312 103826.3955 253492.0609 1004625.55 103962.8102 247916.111 867598.5779 556798.1467 397078.978 377074.0748 430045.4963 537328.9134 3875039.345 518857.5666 691052.8903 1515675.54 1027951.385 1002355.553 778944.7001 1906948.933 235354.1264 1276047.198 232151.2594 71072.50024 946258.8885 291421.9545 570943.8423 831379.21 679166.5567 534880.9828 747116.5596 58658.28451 48097.68127 47496.80298 57236.888 53906.22378 1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine 57780.40446 115555851.7 212638272.9 212295671.4 96000222.34 75787337 260286537.1 131261515.8 111643348.3 178513751.1 146239862.6 67806877.91 98194346.92 132686614 126704492.5 69918148.18 91079401.21 87007424.21 74345425.7 121228803.8 185513416.6 72781015.13 121454331.3 116949089.5 181061752.8 204904712.1 232803773.3 81251950.45 74315580.21 101699931.2 134051060.5 111341277.2 96530909.42 112180593.4 60572489.81 97830031.87 112452865.3 80301410.26 113913399 96905033.92 170957343.4 55776723.42 116860048.7 64946847.85 114071823.2 253687356.3 72630191.49 99355641.91 194843916.4 224964053.8 72253064.8 88656311.96 57425171.32 95999325.06 118846425.5 95174134 98824956.62 206806921 140496395.6 334170432.5 144131677.1 103390501.5 117520666.4 231735397.3 57741500.25 163192618.2 81424577.78 185118842.7 106448062.2 89138853.8 70706601.99 218351748.2 243384919 109360127.4 77242075.94 107273987.6 79471383.89 61590119.16 129724383.2 92439237.74 124268807.1 139075568.3 168666597.3 297542630.9 90943846.83 152430019.5 83618659.16 112453088.2 66693719.28 92638457.26 106568079.3 111058357.9 44356799.66 188627453.6 233691710.2 41702.68106 37002.27013 189344939.1 224813221.7 79662391.16 138604147.1 174081256 151291538.4 67008967.88 53505227.97 92583780.93 119644246.2 101732074.5 112156979.9 104922735.7 95699368.24 100113710.3 88420151.6 75507839.01 231699681.5 243771322.5 251566029.8 69343157.27 183362526.4 90400203.27 92380044.86 67462355.35 98264650.43 154729493.7 120963918.6 161344154.2 66676436.39 225025005.3 121969814.4 201488454.9 109343033.4 113822280.6 214388671.5 243201041 178034266.7 146325201.2 124838843.2 108464294.1 88652724.33 148041344.2 105218400.7 214656875.6 250518972.9 115025561.5 80591964.07 96763271.37 61483438.9 126210208 119191166.1 227206880.3 203845307.4 190623346.8 108136309.5 95740269.34 75424747.2 87095262.53 96651983.34 201418503.8 97735979.19 279731938.4 171582730.4 174410679.1 115874527.7 72897369.21 81943688.94 146915483.3 133181836.3 95072968.63 232223506 233184644.7 116688579.7 44504.67399 43334.5403 46280.80858 49146.75613 31249.01888 1-(tert-Butylamino)-3-((5,6,7,8-tetrahydro-cis-6,7-dihydroxy-1-naphthyl)oxy)-2-propanol 43456.5994 5695216.795 6975726.531 8344072.476 5444722.216 15013677.52 11626735.05 10688832.46 5733445.67 10639408.46 11491969.08 11698830.95 7567824.236 15167747.62 9605407.519 13686161.88 23559979.35 13955850.01 11528472.47 12184060.56 7666345.998 8989332.075 5804360.502 11721663.27 4251229.462 6029280.019 8104996.979 10137100.47 6770728.052 11153714.27 11357821.26 12597946.69 18885801.69 11933419.24 8139512.355 8280835.055 9326566.644 8372790.595 11041125.55 10041480.97 15175237.5 17369019.06 6293867.931 15960648.13 9584754.485 10248930.55 17828356.54 4069309.916 6378782.916 8637249.245 5928431.977 11325883.68 8371805.122 6418627.856 8306280.976 17939073.52 12174408.75 14249773.84 8311923.004 13003630.44 11538176.38 11319624.15 13480895.91 25074075.91 8016808.073 8219793.521 6850797.598 48502026.39 6432340.939 9320599.501 8321456.916 6036521.717 8571744.081 10845697.19 7244200.99 6268136.873 7627875.277 13140136.71 11699254.85 6809633.847 6366081.121 8446012.793 9291622.094 4904038.739 5088900.254 14420580.8 8867302.92 6234190.099 5121502.847 6317532.758 7758724.018 8778368.11 6628685.124 5678786.318 7983661.106 35900.05334 33467.26227 5750252.798 7226448.861 9236269.975 4419098.268 19473399.61 12570811.76 7934910.854 7421328.309 10447399.78 6163814.395 6667241.554 7241955.69 10103056.78 6403341.458 10941991.74 10889386.05 6588281.937 3971614.435 7505828.434 9479053.089 4276513.718 17680596.49 5491358.403 11440914.39 9084700.255 7034606.459 8838309.455 5088614.752 14201792.34 4708592.329 10374013.5 6793220.562 8465730.873 12775032.09 7232502.955 7042786.24 9517284.979 4608781.529 3975014.138 6811066.161 11048291.54 8806016.875 11276464.05 3775007.258 3622648.13 8100369.5 5850778.23 7450549.167 5436522.243 4235569.729 7132080.314 9159795.2 7493687.11 7973481.391 7514353.037 13364608.72 11436384.97 9425895.53 8542962.197 8810199.875 11205584.88 5698596.039 4776226.596 10857657 20178616.58 6428468.841 7991390.823 16985321.76 13467001.45 13590406.83 9559363.728 7403589.852 9429071.256 6527930.569 40205.49144 40379.75115 40882.26031 37999.14453 38746.67127 1-[(11Z,14Z)]-icosadienoyl-sn-glycero-3-phosphocholine 81790.60533 38005271.44 100425444.3 94910056.89 26936730.39 21228340.95 26551378.3 31734282.39 23919540.45 25871576.3 38282364.88 16505597.69 27639890.07 25540974.48 29205735.24 28471863.13 31482228.31 28046107.38 11788040.64 23923510.1 24474106.93 25496546.56 20044503.04 17467151.13 31563821.74 90193933.25 103911547.4 17825581.54 20826944.58 17333191.74 41183172.27 29301311.78 26076874.42 18153371.2 14757895.58 25003917.25 21090749.71 9525441.772 17399283 19235320.24 20808809.05 15865987.36 23431085.53 20473734.11 14852212.03 28711539.64 17535446.89 26277828.83 96200925.97 107256494 21552150.44 34299458.11 14829171.53 33912096.4 21377294.78 27340460.93 18985980.84 19264521.94 38469712.13 52317463.09 75693378.41 21746962.95 25871752.68 27344091.42 19757691.05 35015035.48 23601173.23 24162663.55 28326604 24762157.31 18352129.93 91774229.94 113913264.8 22773869.9 12290810.43 31435385.69 15743170.08 19298490.74 16648022.53 35374721.14 28635835.72 23959002.44 24846753.12 25319075.17 27457065.28 21821902.24 12581993.29 31300048.91 24423499.07 30938528.98 20773938.87 66442331.78 16161454.54 86711324.96 107282108.4 90713.71194 78184.52184 94638903.5 96422277.49 24281717.39 45731015.31 28946190.52 52606378.28 20779602.6 12568109.91 28319923.53 37745148.08 36613970.31 17490327.09 17604376.85 21969875.69 25581616.46 16402196.46 11556653.77 44184238.3 110306207.8 114916128 13173458.78 32569294.91 19491150.97 32181122.66 14637664.31 14114169.73 26498335.01 29308988.61 40429134.8 22747385.6 31808711.82 32325370.95 27940636.51 28267248.39 9608840.991 91790734.27 105187340 46632050.54 77891817.34 33076028.97 22684569.29 40558373.91 56740135.61 26094478.63 38014062.6 37466690.14 34741103.62 20463717.43 34029439.48 30861870.34 20241387.17 17883102.21 107623893.8 86735625.2 40198098.76 36095027.27 20600017.28 18083752.31 25707020.93 25513502.15 50340287.37 43211793.24 23826778.95 53880369.34 36765885.24 26503476.31 23601047.28 20239990.61 29092202.39 29371595.42 27652642.17 109155333 105746243.8 41846344.56 85380.74835 78424.39693 97255.77878 89614.37792 84005.89585 1-[(8Z,11Z,14Z)-icosatrienoyl]-sn-glycero-3-phosphocholine 414795.4933 212522162.1 281956533 281736786.7 248502513.9 192076541.8 106114243.9 279246431.3 124993355.8 157176669 210965720 122926846.1 294064427.9 113999003.8 100265472.3 169581358.5 184319959.1 200826336.2 46621165.13 158340612.9 122350454.1 150751368.8 152745748.4 187537132.6 151602680.9 285482515.2 291259595.2 92223479.86 101753938.4 134600233.1 293728981.8 119956735.2 132280505.3 150541939.1 153870420.8 181869302.3 94980640.67 80736302.7 92703405.55 175233374.4 144223560.8 72303308.46 128869704.6 143887797.7 85694195.59 215943632.9 104111855.1 167563044.7 292058541.9 323758797.3 119412479 155646109.1 152412161.3 179052490.2 85811378.05 241479087.7 188104042.8 168560641.2 170770247.1 348370543.2 410045545.4 174085449.6 143559214.7 233320660.7 139100494.7 128130559.2 146504239 210844491.3 232120987.8 157816317.5 60168046.88 263059614.1 331806873.3 186122404.7 82759120.32 263995380.8 139058652.6 210524922.8 204557339.4 213268231.5 118014731 82678267.71 185250226.2 321699532.1 203110797.8 85709632.51 49018756.53 249211043.4 90604439.97 140759982.8 84416075.88 287609442.2 55029189.59 286410729.3 297688105.8 219692.682 83228.95815 291043634.2 311952787.7 271999687.6 260967421.7 182132120.3 340475852.8 123504629 84358610.73 82097260.91 154983996.5 344655221 188717523.8 177340123 76636741.49 142048271.6 63477674.72 49329560.04 274389265 311023994.9 341976809 120415705 163680445.1 106121939.9 268260297.5 124623138.5 88995474.12 94995287.75 297268914.1 264325746.7 127094391.4 208659245.5 228856593 88717908.08 134581798.5 72187523.61 303047376.6 329744366.5 280961496.9 418184324.8 212188378 108729520.4 155836215.6 313535716.1 139032881.4 163643007 176142973.6 241857541.8 242482415.5 120792543.9 157738843.4 145433591.2 126948571 310077730.1 275181652.3 143056148.4 256261565.5 148071200.2 196041510.5 163134257.4 151613477.4 260812833.7 326017211.2 172896536.4 132848991 122665448.6 140045579 125742400.2 201024853.4 152697272.4 146020803.1 130960822.6 328680987.2 312210494 213960087.1 48792.89897 38865.34202 52509.46112 40744.60978 47335.35713 1-arachidonoyl-sn-glycero-3-phosphocholine 574950.0778 773766643.5 1155939836 1095544340 622893880.3 460346934.9 922244086.4 417163163.8 712012098.3 1000465960 688080084.9 551797200.6 734183974.4 873940662.6 742936593.9 539357449.7 628258683.1 338933881.8 443082697.8 695580985.6 489425303 546281838.3 624002808.6 580553766.3 742736030.8 1097080182 1173210603 686687730.6 726061215.7 627077650.6 750576046 447196172.4 600295328 456967016.7 274997231.3 436399216.6 695441761.1 348264922.4 793335625.2 571812477.4 759855586.3 407417509.1 663180107.5 368425749.6 541341753.5 1066167874 556351666.7 611691305.8 1091724958 1170830095 592572661.9 544401602.1 363960513.5 558588743.1 1210252689 437719720.2 453169357.5 1522970117 901192031.7 1174710698 1000630622 742237800.3 531673401.7 903747135.2 482928961.6 1097887560 620421847.5 852416494.1 743830937.3 608049287.3 842558275.6 1170049915 1229127181 939481419.6 492125130.6 764329851.6 627549034.8 417035291.5 599174781.2 657260803.8 609581430.8 569004161.9 809661733.8 765799082 527839148.7 821462315.9 486388368.1 720555606.6 523114829.7 674612280.4 885936355.9 808923793.5 359060935.3 1049787582 1198625458 1238422.508 283895.8339 1065969586 1201563255 628521120.1 998071945.6 846939096.3 1090191405 607585091.8 278546977.3 502996098.6 610678735.6 510273035.9 512981490 633719482.4 498119191 473455419.7 554858939.3 643204298.9 1176324872 1320609496 1261308276 416494531.8 575697477.4 471666595.2 701886546.8 434285459.7 227030669.7 716055682.3 837823627 792662779.2 361052816.8 1008192756 608766311.8 478897514 743349660.7 281255860.5 1159648768 1246435654 1063306557 918226961.5 1152704578 727990289.4 527989509.3 373409724.6 542918980.8 674018807.6 545266167.1 713228457.7 359203060.9 521026593.7 539893079.2 526719414.5 659249467.5 1268638401 1078179088 570527136.3 809377855.4 609709855 355432761.7 419035681 548589993 1172896488 1041253345 961542915.8 909350187.3 668453128.3 607193588.8 395280298 577351538.1 773019320 909369032 722706519.8 1261056615 1256343775 766700784.9 530766.0357 104518.4026 238299.3071 141194.5923 54127.42758 1-Hexadecyllysophosphatidylcholine 99232.49088 82749182.2 459964835.9 454054840.7 99698631.89 52766093.57 68833272.07 34387040.34 59945025.04 53790343.14 68973852.11 40962313.8 43473147 87589868.69 76810644.68 82914799.94 50132982.06 46933342.51 36825819.33 61101847.88 59583362.02 57775647.03 63528834.87 63820055.47 71134568.29 430746824.3 465028223.3 51942347.99 51047476.86 48801042.28 59251856.8 67930312.83 60141555.88 46851943.26 52542020.3 59219848.02 74812823.95 38960414.83 48991566.42 49838729.18 48339850.27 61155534.01 61609965.73 42568658.61 51308535.29 67280149.22 52181843.31 55710335.2 473135126 517977569.3 78847497.6 58511755.96 30632271.55 66521429.14 83554734.85 68902508.15 54004005.8 30564155.1 91157881.85 93584730.27 106554807.5 56816497.09 62077162.11 41577264.85 57224291.92 85386447.48 45962000.69 30632106.12 69161735.73 51422085.53 52297360.74 469553612.9 528892321.4 83707308.87 32097413.79 49004399.92 46655893.5 44192842.92 24062237.33 87803406.92 46578589.47 58209044.25 54796289.16 54213714.58 60276322.81 81071070.32 42143612.97 64925648 55064365.37 72871690.61 47184732.77 76517894.77 41006023.51 421678134.5 511374468.9 98380.07899 86251.43206 427340429.4 446087755.7 39992734.13 86344860.28 47743464.77 82061102.07 65318009.83 22068792.47 72764268.54 63222835.92 39737106.35 23436069.98 37305255.56 74776944.31 32498102.82 54691868.67 48503031.27 78367914.07 479854424.3 526165812.2 28324673.66 55809038.93 45419768.68 72854772.66 45701943.38 26216192.4 60316097.01 61088858.78 62091885.23 37636573.06 48436631.38 97680548.65 74892554.51 68704806.53 20826434.29 436594007.2 495574902.8 98015383.66 81393143.48 88844520.51 85346458.43 71305591.08 45878259.07 58517831.86 56288051.8 49211353.02 70531723.47 44734330.21 73334693.42 58858627.9 45549506.55 60084354.61 494115863.6 437311626.7 73561508.56 66616143.01 64114844.89 40959873.47 46380306.99 71153844.49 58507505.14 67438259.08 72112561.47 127488266.4 67630601.62 85445448.08 50191607.59 52591183.46 86297631.3 59352979.77 55233638.32 512811135.9 526191979.3 88836715.49 110702.6062 86132.51785 101820.937 70827.70752 69865.56774 1-Linoleoylglycerophosphocholine1 2617940.144 3133975258 3173952244 3004315397 2773506393 2136716949 2809704591 2235657292 2392440680 3119403027 2962442097 1828842338 2570843812 2168219809 2637031350 2910838682 3066906376 1602895792 1141631224 2208502180 2260488249 2271994299 2520953167 2184647417 3290931633 2918555811 3061498105 2046293376 2088563070 1864730076 4046213479 2639987164 2901923275 1682447226 1242232028 2903988931 2163451344 1200364891 2040046332 2174474018 2683542433 1906477023 2566109463 1791998775 2012820984 2906205521 1889130599 2413102458 2972246396 3091372757 2983835610 2818501751 2415104256 2544379324 1990530279 2100350566 1867026351 2767045331 4265236418 3559859192 4143613900 2211805291 2717115979 2397910948 1867293096 2920734789 2089934310 1651637494 3046532097 2091972259 1915653177 3166633063 3194728102 2898865579 1514529798 2407322546 1500091592 2086065890 2255258087 3248100305 2238585077 1796542036 2913623868 1726085980 2982035357 3128038943 1449067735 2727875580 3230180294 2314129094 1626862590 4158426209 940256014.6 2876375177 3148664436 2115506.547 1107030.325 2870644098 3057759691 1980485349 3506134411 3166998535 5385679032 1840312985 1332134959 2014360245 2918727219 2770063316 2132943093 2029082307 2573091402 2221003817 1484191114 1179707128 3151921371 3470018323 3366886785 2912718793 3877409694 1627956826 3789825361 1287222160 931962710.2 2261736212 2934179288 3945451863 1800406884 3518797022 2933147403 2705060402 2493580757 806056798.3 3082187632 3251315374 4171105774 7668682635 3498074102 2157334982 3172613169 4889779387 2112580954 3384312721 3751799899 3713681912 1397265205 3006439835 3595332507 1895752314 2212397050 3416186713 2780818371 3886501402 3418315131 2356704826 1455177724 2310867213 2001881630 5995084742 4986681504 2941377682 3153410010 4373506731 2129280189 2545778320 2407152515 2636505179 2617770046 2678926580 3399980849 3295309790 3120093724 2875955.217 1330266.818 641552.0432 674920.6573 481985.1227 1-Linoleoylglycerophosphocholine2 766432.1598 275137416.1 262616292.9 247973709.6 277312535.4 168511323.5 280392504.2 185702432 177412274.1 322174801 246324542 157463028.4 222903845.3 197591493.7 231807752.1 253265320.2 288458437.6 159020820.4 80136303.92 194904791 219051425.7 216303471.3 224801615.9 177389191.7 304242545.1 293365882.3 268517297.6 172923856 176494271.3 149292431.4 407031924.8 225800443.4 272577792.6 133449269.9 90827019.17 243501580.5 198330627.7 93557926.85 164404546.3 206590332 219947473 151391940.3 226977136.2 150422505.7 164987910.4 204262435.5 152546314.9 221055186.7 265773852.4 242749575.7 309012074.7 221774853.9 208266523 212617828 153915201.7 180237053.3 145139851.9 219390118.4 393683254.5 331964905.9 396409821.7 155389903 202116800.3 188250001.3 138262198.2 238951888.7 167980740.9 118660634.5 299428399.8 149120232 127885200.6 252893655.1 270796309.3 233977979.3 111620718.2 190540980.8 97362907.27 165960547.7 163540006.6 261096261.8 159025633.6 137830121.7 226104792.2 136447690.6 251543220.8 296485618.7 100619929.7 212625141.4 275462437.5 186258023.1 129993300.4 369757691.7 61246108.36 239972237.2 249703683 261755.3577 72766.81643 277610189.3 300471821.6 222669376.1 338261614.1 332936401.8 652163826.3 145990783.1 95776905.06 170309480.4 282401205.5 256940016 154333745.3 172989874.2 251469677.9 173860404.3 116925549.7 80430745.39 349638124.2 387357360.6 375605305 266956196.7 520629632.6 130333834.2 371260345.1 102556199.2 70998842.75 205220426.6 288269557.3 408948515.9 142928753.2 334295993.6 254831552.5 248331808.9 216531375.6 65144197.99 308522082.8 264933676.3 437160965.2 907104920.5 345388875.4 169662815.1 290514733.1 525349628.2 179299273.9 346731119 337846949.7 332318118.1 106210254.3 289205021.3 338024517.5 154865564.9 181524274.3 309457208 232782247.4 380017173 313902466.4 199048470.1 106155470.3 173565138.7 166803337.8 626227967.9 423211816.5 247666461.6 265560426.4 346116292.6 143728477.9 190759961.8 185932305 225290983.9 207803751.4 206734403.3 277768103.9 278694944.6 260445559.8 683666.1953 175755.2924 57670.0351 674920.6573 65280.74711 1-Oleoylglycerophosphocholine 35112647.1 2897706115 3942977349 3852834198 1965967639 1484007532 2626846660 2144494909 1809545320 2379728802 2044554274 1315160064 1724609720 2240717053 2257750050 1839021262 2492525867 1445533711 1091407931 2014826749 1438259342 2039718474 2083574043 1527637170 2915974573 3726273934 4080337246 1586744915 1712385114 1358072369 2297976521 2186355054 2398224199 1447859016 1060255133 1652267855 1780890043 1038180967 1518363018 1335502129 1515782898 1363922366 2082273373 1164015844 1553919263 2391670816 1447634607 2071024680 4219796495 4555614281 1649304650 2318906366 1311205921 2706519594 2312485046 1975646180 1462219800 2361936620 3389791462 3213659855 2990269843 1512955054 1930148705 1678440189 1366063397 3512073892 1401880616 1495903859 1878840948 1652897446 1721195084 3917979256 4422181705 1764159136 1366776713 1842033141 1392979673 1527962169 1337836790 2467839637 1648673083 1821558648 2287392431 1607829581 1940524283 2566848025 1312030879 1862493017 1928469437 2006008638 1659986207 4581492886 1012923415 3763167021 4066666038 1579189.578 449674.4901 3736952180 3828993479 1755202273 2629014843 2015670819 3023675037 1691445450 777688452.1 1802476100 2183636267 2359417397 1029277818 1352330219 1678590650 1450264950 1367927939 1243789060 3527245826 4357286431 4340036132 1385977148 2872766034 1704966626 3122076791 1140419670 975531766.2 2165284818 2202674516 3310223724 1343588473 2154553149 2508569366 2197358312 1684916095 780681406.2 3901471261 3958128568 2799224428 5651036854 2932654754 2302984927 2207119813 2490559723 1494321626 2520586454 2513672705 2330627557 1019648269 2591104824 2339395321 1433234577 1578610692 4146552000 3791937563 2711895329 2485896340 1602565158 1238089851 1640953641 1361063623 3388840170 2743243026 2255760718 2278355690 2684898889 1868299969 1488013378 1439208593 2443766941 2063663805 2177951726 4294752566 4454631062 2946607028 1367772.906 62092.36992 123601.3906 87620.93822 72032.05866 1-palmitoylglycerol;MAG(16:0) 48877.13302 489100.302 730857.1682 1187078.653 80353.204 128696.6486 116906.2031 3364105.372 47148.64352 45149.30865 399728.6066 162616.0292 40259.39399 511604.3237 63312.75422 346975.7367 1096919.65 1110916.242 144820.1114 183311.3055 340792.2882 1449990.13 941526.557 342111.856 389138.7626 750014.1368 1351672.193 98743.75059 295827.6114 252668.5571 304692.3607 71889.98319 425654.7454 1490308.467 273414.9643 51280.01552 268092.2919 209881.0428 83177.11355 121234.4079 315694.4656 1453949.044 50097.39955 1515240.402 279969.5121 453109.8467 148841.084 221518.562 734433.8679 1550668.951 676788.9004 912760.5775 326448.4669 181494.7599 362011.1412 658569.6475 370340.4588 293103.4464 948965.6053 318858.1667 42925.78067 261437.9613 487675.5789 53268.3737 1563832.283 255058.7814 45590.26692 66216.42671 107450.3355 351322.3977 1473533.012 790851.2943 1497043.944 842884.7399 239493.0181 1944921.335 371174.4589 651671.8287 152460.0251 2158670.941 857845.3249 440253.7991 42815.55785 272196.8437 380428.6403 314011.7591 106924.8585 262688.9374 537795.9321 359562.4973 721816.7007 1950755.672 74344.4351 752594.9026 1572650.351 48901.10164 46584.39277 673761.0739 1361987.395 267780.1025 44572.28845 121445.0278 220069.0938 827864.3964 117822.4241 815044.4672 86929.65987 129673.2433 45203.32895 299446.7098 47830.27499 325260.3858 3494288.392 603306.9782 37236.55699 846351.1503 1473236.196 264308.8116 93889.52248 50583.42471 111262.1144 432220.2199 435445.4331 1788101.118 124317.1984 60954.8599 332676.9422 468115.3344 161927.5012 78586.52989 247126.5432 61760.19897 263225.92 1459381.438 53864.66899 755385.8807 49367.77327 56690.65423 320024.4341 59321.53711 282410.6758 53966.1563 452687.2608 1281273.513 898271.9053 145596.6563 371460.8712 50556.9242 47485.83982 869772.8612 1245326.398 322022.785 43187.69621 66736.99534 1190266.819 924257.7867 1229742.298 102950.3981 1800340.507 80652.38865 92661.17452 636779.8245 192555.6992 523742.4083 394109.5936 128674.5448 301947.1698 692625.7501 1045248.612 1450674.919 724338.4991 43186.98454 45487.46157 43941.05936 49124.27211 48931.96224 10-oxo-nonadecanoic acid1 182841.7925 2558317.351 4781548.045 5646850.855 1733906.592 1939792.841 3642198.363 2696456.211 2181148.523 2325404.049 3315504.595 2025220.846 2119547.489 2148104.328 2544695.808 1499089.907 2133644.201 3091338.187 2472572.391 2504872 1888843.61 1773929.562 1826491.573 1202799.337 2701734.581 4987386.511 2698210.866 2071576.697 2033178.337 2165001.56 2094145.58 1884497.741 1981090.512 1634670.109 1148546.023 1857182.503 1792221.107 973442.0472 1544697.23 1208014.69 1530425.452 1950324.761 2472882.484 975408.3863 1844958.282 2843527.243 1745449.829 2025280.366 5363418.478 6880422.098 1715626.471 2620302.453 1342199.248 2579841.806 2736231.075 1899032.873 1872970.074 3498158.686 2802012.292 3866472.397 2391418.19 1299938.408 1597895.991 2177453.296 781839.9845 4569223.74 1350747.389 2138367.615 1301056.102 1510206.568 2219956.227 4566438.606 7581784.471 2011300.453 1402906.034 2003039.931 1436623.831 1547005.164 1898702.347 2810070.888 2550426.561 1983094.804 1835234.423 2585544.747 1738603.101 3112540.37 1796069.484 2287177.495 2437703.033 3288767.248 2200204.361 3209407.511 1908472.385 4003793.851 6772086.591 210455.32 85867.011 4161171.991 5513496.696 2272299.5 2119331.076 2108404.204 2733674.552 2031752.028 1448017.972 1670403.793 3025658.727 1912266.716 1595183.737 1340484.188 1702757.893 2652173.268 1795845.105 1700604.324 3265813.651 5008989.59 7030352.788 1819996.896 2223324.545 1816720.999 2757087.357 1555154.924 1793845.445 2098354.895 2357708.235 3183625.571 2981319.666 2424879.536 1838228.437 2351432.683 1796470.778 998854.3253 4267202.175 6788826.084 2533485.584 7245619.999 1887764.681 2727658.523 2113252.404 2968801.506 1426984.672 2152463.38 3304252.12 2688574.333 1646601.814 2855835.915 4208810.151 1373506.77 1667132.161 4240858.48 5612437.136 2314754.142 3906056.77 2082565.666 1524521.212 3828459.173 1697602.467 3372752.342 2339587.715 2784562.824 4184778.382 2404600.781 1738147.885 1113961.053 1451825.44 2261081.448 2306719.284 2052845.554 5870811.602 6980727.948 2824131.049 112024.8417 62276.26816 60371.10898 47536.87594 55062.46664 10-oxo-nonadecanoic acid2 164670.8522 1652175.231 2266852.845 2905860.121 1390575.884 1000435.962 1889241.397 1676359.65 1489896.859 1410937.945 2138713 1171869.018 1457658.881 1561697.081 1616786.149 931674.2552 1125286.405 2131422.573 1285153.214 1401843.459 1205854.017 985416.0102 1256843.933 697653.1326 1863116.473 2035192.243 3037383.834 1477539.83 1230786.373 1269060.233 1157326.629 995689.0832 1171639.045 925805.0914 694976.8897 958704.9416 1148244.13 542059.3074 817942.7691 638908.0085 993158.1602 1096830.326 1384358.569 517297.5812 1158081.725 1699434.405 969847.3528 1245122.462 2283550.631 3372391.38 1074706.748 1597023.237 727863.3596 1560076.858 1608540.242 1080463.487 783233.0805 1874778.722 1454198.702 2350393.69 1423407.008 727055.9925 901395.1074 1284287.182 385738.9159 2368754.178 638202.7241 1316540.184 659217.7648 766392.3561 1144131.193 2407059.374 3272853.743 1011350.781 805663.4122 1352735.441 847578.7845 973186.0652 1228540.051 1504873.515 1184452.461 1023981.566 952395.8898 1419173.206 1042625.678 1690994.879 911066.2444 1151981.428 1335957.12 1725499.544 1196302.839 1787288.102 1136632.341 2159204.42 3113021.321 198702.1302 49952.6874 2159812.145 2816753.354 1415912.645 1191541.46 1161240.021 1531356.602 1087549.252 941699.5459 966641.4192 1857070.598 1025732.588 869946.4865 753060.8834 909840.419 1543894.323 1074607.597 909750.6376 1874961.997 2423101.849 3112261.397 1039947.139 1360483.529 851809.1349 1373067.928 786540.2429 1152004.154 1239848.125 1325251.477 1795886.493 1787123.965 1015413.489 858926.814 1249527.621 1140420.087 473504.2478 1698861.525 3071967.619 1267454.151 3873261.483 1042648.239 1470820.93 1052846.26 1710562.228 745807.2551 1039588.608 1698194.079 1475295.762 867061.8666 1348071.04 2604367.167 844870.4381 861806.3694 2579616.351 2511516.469 1413138.863 2130598.435 1012723.701 767796.2141 1970910.136 979045.1439 1744842.482 1418718.034 1544418.309 2365839.928 1516838.213 940651.4596 696856.6012 724597.2187 1322018.228 1301481.451 1107455.368 2572109.882 3390800.99 1673377.412 112024.8417 52509.76425 50509.80365 73778.38864 45510.20811 1alpha,23-dihydroxy-24,25,26,27-tetranorvitamin D3 / 1alpha,23-dihydroxy-24,25,26,27-tetranorcholecalciferol 55658.06572 1803892.014 1287714.473 1687746.36 2164599.296 1500368.932 2229895.611 1826071.749 1934064.544 2485316.426 1688326.974 1672761.6 2186188.179 1615965.483 2442352.403 1482168.337 1640340.409 1370797.571 1465047.966 2074772.387 1279928.095 1678941.484 1480250.292 1759849.247 2239485.016 2376902.658 1653255.404 1783230.787 2025310.797 1736056.145 1741241.324 1364528.339 1494534.379 1294388.081 1037432.151 1273487.233 1333246.464 962347.9025 2189113.289 1336175.912 1558481.508 1834967.153 1667000.313 1188435.427 1778310.159 2468309.059 1594758.638 2105148.091 1323637.501 1519084.651 2075510.339 2235478.558 1619933.066 2246006.404 2461411.255 1564418.365 1591482.289 3470763.547 2263016.418 2928455.465 2548943.645 1634960.91 1464299.861 1841847.593 1018526.772 2513069.604 1703235.894 1778590.94 1740231.423 2386632.513 2668199.283 1475274.285 1988742.568 1845540.675 1343788.978 2172623.613 1277442.311 1293376.572 2289490.363 2294957.44 1734731.42 1200970.296 1780425.628 2432096.05 1783958.754 2451448.559 1212276.505 2210845.015 1989104.563 2596685.156 2227167.114 1881970.075 1086860.462 1178068.187 1799054.868 50042.41125 62604.6275 1152522.851 1725103.613 2180512.989 2887240.178 2335651.492 1881279.253 1453168.908 872072.211 1237475.308 1764576.463 1563425.642 1999014.727 1607136.843 1257789.778 1448007.426 1255513.031 1032605.978 2303754.797 1675208.18 1927374.277 1154532.848 3456368.012 1600780.414 3037665.031 967410.2694 970122.1134 1773781.519 2201398.991 1973830.977 1612601.087 2675127.269 1493499.789 1194468.287 1897336.926 612394.4072 1381742.381 1587827.49 1717973.678 3489947.335 2216057.703 1957403.25 1461215.149 920878.8985 1237427.664 2173173.687 1596669.476 2760241.694 1217397.931 1581466.755 2461499.81 2206559.012 1939953.005 1559618.26 1421545.116 1128525.378 3530156.704 1467662.108 1427507.886 1405413 1780015.336 1783365.818 2122517.535 2394587.167 2725269.116 1184425.256 1572738.626 1283181.818 1696879.479 2253348.428 1738935.655 2072478.176 1538947.586 1595511.255 2211175.243 53466.32431 43691.80004 52797.9383 54322.55853 54871.17801 2-(1H-indol-3-yl)acetic acid 64235.15285 6411095.982 6326660.913 9379790.361 3097664.496 6627230.814 4930257.12 8886978.966 14564205.3 6699304.067 5523914.388 2605177.439 3110929.857 7035583.217 4527867.042 7553283.565 7642972.455 5590819.499 5459126.147 11416204.21 4599730.923 4573428.414 3284048.294 3141675.972 7413494.751 5825450.297 8655507.53 2985437.688 32014803.01 9009328.091 5873621.149 6153190.105 3765807.73 2018015.939 5313966.881 6956105.014 5601717.616 4915714.606 9730230.269 4899862.326 6091410.092 17915803.06 19200971.16 6848045.935 6581759.309 3895134.167 1741023.635 7946314.518 6646133.351 9738583.592 3001259.16 7284076.342 4520771.217 12315425.66 4941631.915 4793889.059 6556654.982 6028354.188 7860945.905 6417568.021 3655587.347 4076161.459 9806889.639 1798797.566 4641981.747 12301554.92 3323066.277 7407224.803 6832500.256 7414910.843 8604325.984 6431143.318 9780228.29 9691941.971 6513498.447 800768.4879 4574178.536 4653400.307 5364797.576 4580749.239 2348432.557 2436746.304 4333112.307 1690229.024 38562640.09 5595755.815 7156555.484 2501452.748 4612526.09 6890667.521 4424700.212 5314874.103 3433441.231 6005534.71 9361395.878 64695.01868 34727.04393 5937898.707 8867877.143 6464193.443 1952479.231 3726907.362 7607957.335 5214084.184 7927724.727 11293104.73 12697840.56 7333549.788 2627748.016 3240197.363 5749185.695 5799732.868 6252583.847 8128763.232 4205513.37 6293018.992 10253414.23 3414825.085 3652245.433 3846196.32 7489861.29 3919514.837 36372288.17 6601078.994 4230718.67 12034268.19 5140666.849 1909550.994 7667862.274 5043988.408 8381394.935 3489861.871 6520558.762 9573016.836 8436060.155 7233935.578 6873605.413 5015499.139 5202907.556 6978851.259 10064939.91 10874270.19 8404563.071 6082889.248 6376249.243 6541377.457 18166898.8 17891925.76 5983074.896 7414050.883 8923189.126 5801802.846 4504204.88 8301236.09 6629525.97 3414507.283 4458107.027 10723861.12 8470671.457 5212376.14 9915711.423 3283287.909 5690737.712 5630935.456 4514415.02 6486898.032 2935379.029 22486272.44 6640498.994 10183966.35 7364332.385 37193.97844 76438.30968 36674.16047 33477.7296 149016.9347 2-(5-((3Z,13Z)-eicosa-3,13-dien-1-yl)furan-2-yl)-ethanoic acid 44527.32792 611408.1657 558669.2626 590355.8143 1958242.354 868980.4079 462679.8382 3602053.624 1027346.983 1075733.259 761560.0596 1179346.604 604267.5282 1023620.623 648051.7135 703979.1047 991002.0268 3053757.947 1782021.919 2055376.139 632639.4204 579593.5159 354446.9908 1094220.918 324307.8015 530413.0983 607712.3312 721801.1578 1386629.001 912634.2231 1466588.162 772042.4824 1452626.489 655842.6017 2178267.275 632338.3357 787625.5381 1331568.162 1569898.983 610442.3621 711272.2434 1841534.739 610025.313 1295344.71 1358534.188 1703448.677 979032.8213 683794.6674 531160.4957 680801.1811 1021017.21 1785305.381 1065164.548 1169372.849 1169629.279 1294454.439 1562392.258 1525273.357 764267.0652 769583.5501 608350.8392 1310486.082 3688223.539 670091.3467 603794.4573 2251831.266 872532.6892 826411.4604 552125.5682 481233.6533 1352105.276 518478.4223 648248.0145 1295469.217 569163.4744 580532.23 1084604.868 457868.9359 948019.1279 1777438.546 582349.5196 739487.1983 447953.8589 502226.9941 1106131.199 790557.1371 1199222.084 843531.2781 468811.2203 1145022.537 3308317.544 1219945.911 1142963.054 474773.6666 549995.4181 34095.03491 34420.15106 442652.6193 558596.7214 617583.0517 239876.9419 524006.313 408685.9932 375682.1532 445610.0228 1593400.521 964544.9986 371748.8747 486723.1209 596353.7129 1070101.172 652021.7708 1833181.762 1264271.441 263691.0374 481898.3579 644428.2886 534088.5757 325422.5643 479701.1437 864634.3538 787056.649 1629228.297 899516.5029 670832.9416 302117.2057 566872.0571 880088.114 408032.8783 260994.1412 1049282.035 330018.8279 516846.9977 635135.7832 466983.7066 1445342.525 519748.8641 878409.444 517460.8324 170113.5386 513144.7844 298280.2951 344894.3981 925636.4676 899866.5826 717721.2203 1407979.229 953484.9025 620258.5543 626551.0957 588133.7373 289911.5714 852508.9985 1078429.507 990421.8146 716956.8555 1062343.271 363832.4038 374808.8552 809783.5543 2008399.523 417884.5904 680243.7092 718524.5055 649029.5952 728972.3147 595753.9845 699305.9934 516447.0174 603212.3171 752055.2185 34203.76886 32599.38416 35110.73168 29729.77479 36846.47895 2-Aminooctadec-4-yne-1,3-diol 39842.99616 137719.5114 6075241.286 4546329.515 450670.2445 444312.1907 312429.6813 291084.0127 262389.3276 144077.6222 164613.4353 288071.6946 223932.5143 211081.2216 300433.5389 280942.0096 268722.372 403485.1032 429013.6234 225768.4696 105662.1731 176213.1578 249814.076 281820.4909 170978.0109 5530910.803 4682892.436 280950.8538 224678.3735 290528.3005 300690.9673 228465.4186 335512.1508 404057.44 430968.1559 279136.7075 216611.6601 298790.5211 219109.7064 218935.251 184257.8906 262133.3478 192876.9933 359946.9498 66750.48676 324558.7298 322732.1523 258997.0941 5837030.439 5632726.944 253389.2805 199886.7516 140533.3876 180533.6237 151583.3919 279018.0042 328516.5628 276170.1618 195972.4479 456167.3263 400497.5361 479153.3233 464975.6011 211604.1439 321340.7712 410096.8313 303718.6734 311946.209 273110.928 242591.2032 376585.3988 5137959.595 5581504.002 294918.7092 263709.4067 179521.5604 466226.5469 245174.5992 210807.9189 509935.3225 158788.8804 174875.0397 362917.8569 1074584.028 318560.6251 234547.2217 192311.0099 238287.1012 225921.7973 1956149.57 329598.3279 107330.8233 190866.8478 4867605.209 4659203.489 34088.18268 33885.68968 5207878.975 4408990.918 258388.7704 308084.0105 275404.9411 121932.7537 129831.6387 147228.224 717419.1834 193252.787 254456.9106 97057.12838 203079.9849 271998.011 214702.4227 251254.3689 348159.8997 232705.9736 6138685.966 5163894.584 358007.9663 193442.3077 454188.1089 292176.5677 405441.3087 240907.8884 283755.4868 201758.7526 136283.3407 198416.8937 291463.8744 237306.2788 225904.2145 222538.2225 166251.265 5635579.825 4821108.82 212582.4628 343357.4108 261106.0403 304771.302 227065.5546 279694.622 159785.6222 248937.4465 170257.3522 196901.9094 269239.3032 131137.8997 184002.4708 801854.5723 301667.8787 6254435.585 4118148.091 209046.1561 279021.2548 302142.0693 264232.264 288835.1572 297164.566 241274.0377 254477.8458 132852.3953 2897828.019 243503.4604 223792.7301 331401.6942 328367.0621 439924.5523 235056.4736 318388.5289 6365614.579 5266321.107 158084.3439 40432.41057 33331.71192 36058.13071 39775.83472 42485.50903 2-dehydro-3-deoxy-D-arabinonic acid1 2796950 2196543 1574018 1939793 2718524 1.11E+08 61130785 3465588 2438934 1.47E+08 16194737 99208889 2773113 8851020 2847714 4231421 9077054 3256569 26047100 5547797 18865029 4578729 4615682 7102492 4827188 11555791 10581886 12853641 4351641 22247477 3998067 5685388 5424897 4327034 4005968 4929616 82820909 24043130 5499162 1.02E+08 4593714 21229490 10468121 7352395 6759818 9045239 5989751 40819154 4380386 12899470 14244620 7828327 7629893 5570050 7426753 43868417 11315131 38875013 6078793 6130544 10102012 6059196 5777517 8100839 6644787 47749738 7523436 12380732 6147972 75889978 7688705 78749403 6821187 6046454 6732265 4335384 13738063 5667195 8959452 7857090 19424574 59606687 16619377 80871017 47250026 8054811 8686518 63162984 36206485 12354513 7563127 8059679 8201151 40432044 86126900 6472114 30618881 2591607 2411959 4572614 3147272 3938009 4491136 4029840 4512505 3351788 4727849 6252759 6423392 5885627 1.09E+08 5719544 7163739 6829099 6179243 5131221 5052521 33389537 5778894 7322622 8688556 6100138 6557219 1.63E+08 79116338 81781133 8498988 1.07E+08 9517086 9408966 7420089 1.49E+08 51301523 7806402 8663261 9917730 7256848 8635954 7975777 7462348 10207117 9465235 9684221 7505914 20104233 1.07E+08 9917478 9758882 9142125 8543487 8758187 10707967 9407720 8994279 56450675 10694183 9847486 9497254 11450236 9618677 9447395 11169243 47603165 8175479 9473437 10525022 82201418 9771094 10650808 9415709 9044903 2613100 3230472 2825864 2743200 3212071 2-dehydro-3-deoxy-D-arabinonic acid2 1335252 1137831 1214711 1554202 1631892 45474580 30707026 2100555 1554865 50571525 3564362 36362587 2027052 2910186 2050953 2613043 5816623 2692310 15255618 3608633 15165670 3058461 3123131 4012323 3055027 4465706 4708200 4353277 3120486 16139994 3085929 3762733 3509973 3539565 3491606 3703646 33470383 10516027 4032866 36282908 3714726 17221205 6449901 4704606 4574395 5811741 4406136 24969414 4687338 6541109 12701661 5029746 5003091 4994556 5180277 26133333 8791599 21173057 5118008 4831183 6196524 5174895 4933292 5466130 5453312 27420962 5348187 6346325 5401270 42623757 5903783 39915165 6897512 5806767 6265171 5295214 12501812 5501051 6147907 6236310 17792579 31293577 15125789 37173967 26703230 6523675 6836513 30440495 23040244 9705833 6477321 7341421 7073943 26644588 42120946 109078.2 599045.2 2637759 2837932 2892594 2425780 2991166 3162519 3276389 3206785 3348559 3391383 4781239 4251319 4218186 44590241 5022901 5116107 5032933 4845878 5586622 5449743 12019492 4846825 5399133 5884861 5445122 5809031 60705849 24591532 41230051 6307398 40092160 6769572 7076845 6287489 55190061 18452617 7048232 6871090 7064972 5997616 7208198 6533222 6416637 7110329 7170358 6987333 6524621 11033012 47008388 7237506 7053373 6450873 7917810 7713850 7236314 7635476 6746523 30047233 7886484 7698539 7269683 7088609 8004212 7363472 8080589 17690800 7041311 7384048 7732379 36289194 7185090 8855462 8843611 6905918 207620.9 209235 195533.1 54335.4 62193.74 2-methylacetate-3,5,6-trimethylpyrazine 42286.46882 2494908.964 1623121.393 2112965.958 5410088.004 311534.5852 481266.6324 2595613.944 1748056.07 2303495.783 3471918.65 2335441.55 2864561.535 1295105.13 1287924.815 3591749.258 1543131.902 2380242.388 2798110.92 2564920.723 2075636.112 3301012.97 1669236.611 3203032.477 2925306.898 1470453.782 2466555.432 2032584.669 1742153.036 4159485.79 1536428.914 1750886.633 4134887.423 2119085.491 4263334.924 1478382.231 2289120.868 3325877.381 3226188.989 3153354.605 3997895.77 3038795.24 3911821.628 5598793.726 2496815.729 4643405.825 1082952.014 2672771.276 1644587.304 2693510.888 1661928.315 2475209.481 400897.5015 3829255.484 1169974.753 2868116.118 1194101.153 1347587.448 3404399.317 1228639.676 5098952.513 3699664.594 6553909.585 1666245.698 2026556.317 2132973.5 1963849.474 6242332.219 2694328.428 2669618.361 3644556.622 1693001.629 2627131.953 8840670.228 1321777.92 7254786.925 1139637.79 4795451.277 1697413.404 4065997.777 2584557.18 1193517.482 1968542.592 1936375.598 2829796.675 4724609.275 1314684.321 6203117.853 5411903.244 1446625.896 3507636.415 2144980.931 1106139.438 1453737.245 2394600.763 35386.66948 34945.8424 1439396.618 2772001.067 4323664.451 2092191.548 1797230.83 1760137.853 1954139.974 997639.3819 2870243.863 4111142.989 3855423.398 1616609.97 2339889.366 3161465.369 1725471.6 2463291.863 848147.4115 4216950.138 2503080.27 3316833.91 777395.0605 3538551.467 3435899.659 1543198.72 2412995.824 4471485.236 2049386.787 2748321.471 3095545.259 1696751.613 2053343.22 2228326.71 5101347.433 7236226.969 1605141.08 1837156.854 3106844.467 955595.3069 1570645.864 2188183.706 2213318.01 5129422.71 1821230.353 1926069.698 2651013.929 6293665.662 2825014.535 2083105.328 3752659.343 2405953.358 1675581.123 2198502.711 2084233.319 2256290.505 2045869.675 4830176.197 2624268.319 4207801.679 2739910.145 3239965.819 2662600.225 1668020.792 2140927.819 3161742.053 1930006.604 2017172.381 3077133.744 2662915.069 2869567.531 1746440.754 3182042.654 1906616.853 2792810.307 3083571.215 34727.39242 32685.92378 34944.08974 35821.56283 34033.49707 2-Oxindole 85188.89617 13385314.82 13486078.33 15510893.64 6180242.732 16744771.03 12488759.48 72927810.5 14439611.84 13510998.65 20595672.37 17841686.45 13073957.38 16973474.31 15023459.18 31744304.57 26373191.57 52986532.16 33641701.11 20187333.57 18325911.67 8585176.054 13668226.15 7940890.85 22236334.7 13232864.06 17676465.8 7710112.601 30739357.62 14683781.51 11914600.98 16780293.39 12514560.64 20921997.56 25390273.73 9473414.19 15832531.14 23412440.59 6586880.172 12408614.13 19405405.42 25529219.57 35065902.57 25312729.65 28201337.05 20455594.14 413741.992 31987226.36 13459218.25 18485747.94 16776005.89 28130936.19 10374070.37 17076339.87 22039412.76 65356293.99 40774980.05 31363185.97 40964174.28 7221632.767 29720035.66 10690585.37 6885742.951 12231533.16 6407153.727 18743328.67 7269913.928 15247714.35 21619839.94 19930407.98 25517693.42 13479937.21 16845450.57 31987628.91 12631938.41 16895201.74 10088529.65 10625836.45 11168324.99 6482843.77 25821027.34 13560308.34 11897011.58 7701948.112 10216566.06 17566292.23 5206985.996 19844023.82 24078638.44 31981824.06 19447090.54 41149320.74 9775042.671 11953408.57 16895315.5 93376.89572 78766.86004 12192807.72 15729888.27 23121152.47 2475980.382 3864928.404 32819026.42 23107875.26 18239313.62 42453156.26 7658480.487 14997482.09 3740655.952 11385035.97 21551748.41 21686278.77 16197759.55 32391344.31 18824665.04 15809040.15 19224196.85 29597140.6 11873858.8 28298598.6 18223063.07 9573422.47 18345052.76 16270506.83 23143374.7 5280257.23 11302129.12 5362936.391 20740816.37 10589907.72 24970517.16 16255751.37 13567902.19 16714986.42 10480094.33 10942941.82 26875114 29372036.76 26819029.45 9199623.342 8452126.719 12937864.67 24806550.52 23428759.77 14747761 27822854.6 55497438.06 5787036.332 13856938.56 14393474.95 15154428.38 10921190.08 11058013.89 20772887.47 25001399.68 27631100.99 15944358.01 41169662.98 15938589.99 5953203.108 21599290.52 17564809.21 11219509.06 15254558.78 11917750.88 16886166.03 15203064.62 18134407.68 14968923.65 17688505.84 14214823.77 105745.2105 99404.14529 75688.9379 71943.1902 79885.23492 2,4,6-Trideoxy-2,4-bis[(Z)-(1-hydroxyethylidene)amino]-beta-L-gulopyranose 29746.17479 1679185.688 977110.1439 578759.352 1339995.284 2002462.536 854754.8015 1119489.507 1797262.888 1896019.862 1874591.04 2303866.532 2079264.349 3494053.208 1431315.42 1724910.233 2382913.529 1151641.739 2267104.791 1728633.772 1652165.674 867767.9 1473964.334 3073717.73 1183198.763 1252696.866 1074116.66 2072905.587 887474.3278 2447228.098 2973484.058 1787718.911 1505047.666 2966488.506 3007311.992 1467108.978 1458342.353 1681069.66 1205210.236 1315527.55 2438372.494 619076.1457 1066846.675 1741678.015 974315.3781 3806855.774 1204255.5 826151.6599 2070248.682 933278.214 1463720.804 1761467.869 3041939.811 2357401.863 1574708.763 2123203.332 2960731.935 1777607.286 1399195.882 2827747.107 2626501.302 2941584.121 3613842.188 1555077.759 1064661.7 1468492.494 2640603.63 3927007.546 2369081.507 1792596.866 2433833.308 695294.9887 2048389.237 1930475.605 1907673.946 1962742.582 2055607 1862505.638 1634331.833 1805720.434 1458939.339 1113299.729 2302887.118 1374757.772 2481315.687 1454384.099 2014844.881 1893175.091 949445.4096 1661592.809 2054276.727 2054753.883 1347172.793 1744899.092 1024095.324 25688.60888 25052.52486 719277.6342 585301.6398 1054380.943 834776.7863 2671968.584 1243921.513 1883019.075 1144676.984 1151313.583 1595144.222 1141603.046 1952610.681 2325033.294 1376723.651 1411313.249 825779.8531 1197079.934 1530942.355 538678.8437 674359.4762 1853161.303 830224.7203 1213353.482 1741338.6 1686529.986 2046243.78 693842.8028 2497241.199 725485.2283 1405798.265 1568783.262 1354140.817 1271994.857 784460.2426 1644608.032 776889.8683 998634.5435 1987333.649 1741592.091 1831118.013 2197236.583 2047225.49 1759828.256 1744213.162 1107995.744 3419197.42 2116263.373 1829568.371 962125.0622 1667176.651 2476212.764 2139617.839 1159976.955 825928.264 2919848.509 2919400.216 1524475.418 1689074.973 1748994.318 1395265.955 2601480.962 2588181.227 1472488.154 1219239.563 1308128.121 1357255.11 2011267.267 2282989.076 2264031.545 904972.6507 2375864.412 1607631.451 1414726.908 3381314.247 23816.95856 23738.21314 26910.37462 26294.1452 28773.22328 2,5-Diaminopentanoic acid 258724.6022 10659940.91 9368876.439 10714259.32 7786518.931 11632946.41 13440808.5 18915025.79 12406062.08 10097464.08 11015761.31 10913719.01 7158353.107 10900144.18 10889615.95 13657466.12 19645047.35 17357148.74 11450610.94 13287851.84 14318424.98 11112344.74 13679379.97 11954187.08 12259921.52 10211614.89 10589520.74 7679539.814 9628444.951 12800387.86 24288885.97 19153674.41 12615304.04 11713644.71 18844494.63 10007338.57 13633742.89 6979348.846 8181934.379 12251211.03 16213100.96 6652139.526 8895076.982 6566459.099 7746157.73 7786173.589 9061814.57 6664981.331 10583336.28 9712828.157 11117725.04 18414974.23 8472828.137 20364513.26 8980890.416 13271025.45 13956276.45 4726523.81 11477250.25 13156480.1 13736576.33 13592679.3 20567524.51 7868060.11 9293381.918 17634244.4 12060407.66 10898633.03 9855883.759 14171769.86 9697120.064 9118010.759 11563346.72 13389119.34 9052753.022 12755900.63 5825467.012 8714489.808 6450062.791 11792536.97 10586420.94 10917522.04 9693835.489 11418221.14 14289164.36 6027839.633 6897887.405 14513427.22 12008070.75 8341874.742 9679545.723 15543733.73 7175902.963 9728069.982 10081561.83 548784.2101 399399.4989 8242942.569 8673726.677 7842713.313 11163395.11 8031496.613 11619463.45 8085761.527 4306757.149 17506649.21 11049740.69 9659506.882 5920152.494 5874008.683 9252800.829 6875675.271 10698004.71 11329556.53 7956553.965 8544351.571 9905035.921 8923004.065 3877979.555 7000653.244 11758366.07 10094195.61 4813212.219 6416211.668 13094197.65 6543879.196 5286625.54 4919108.606 14561895.15 7694636.214 11103961.98 5882596.047 8106934.36 9218924.09 8387550.838 12906680.68 7833723.916 15787025.29 7214534.466 2906372.347 7509358.021 8006498.376 11221473.7 11431264.33 11342728.28 9604368.357 9439373.391 8746723.765 8148812.908 11162728.93 9902625.41 16410875.54 8677785.657 10890443.02 10844217.38 5472952.95 11514540.97 9336135.803 12014027.16 9206358.366 9062418.025 10632714.31 11353107.25 8693352.257 11866447.8 12401742.08 3091133.629 8332387.937 10237814.93 10302285.32 11441373.19 279514.7528 281367.5736 327950.3753 331890.6648 459234.2066 235BBF3K97 61880.20964 56992366.79 54918802.18 59145314.8 75303125.61 42911217.93 44625340.18 109924509.6 46517124.42 49115174.25 104633971.4 55499675.22 78224329.32 128148924.9 53466715.39 54909030.31 73822204.99 99988817.12 45328429.64 44872439.86 48730249.77 60887591.08 75072550.54 63554671.58 65104007.68 48922979.16 62483807.53 75843061.69 36444572.84 92519365.04 79277548.86 74837856.61 68121284.62 58661608.96 49332942.2 64328386.83 38787690.79 46986474.34 53981335.75 52735307.11 98888493.39 51133779.79 62217260.8 70785530.76 81262732.6 144962837.6 57504968.28 53885000.51 56964791.62 68833031.07 58011332.12 60126468.09 55225018.8 76961442.24 49498406.99 102085797.3 100919565.6 77331960.17 65629983.34 73357568.38 96704292.85 82635628.8 47004376.16 47897519.74 57023610.48 47831958.87 60466755.53 123725509.2 68599724.77 62122089.34 55414461.11 47389282.23 73400496.29 59191481.24 61352779.9 65187498.61 63146154.32 68307756.36 91872030.85 69006781.27 50394275.85 49065421.18 65529638.6 33960400.1 63517228.29 47625781.03 44251910.59 68931899.88 38338477.11 89974824.06 35139008.66 105893025.9 80901521.63 53702417.17 63684453.47 116391.2593 112604.7354 60810985.68 72891640.94 103076934.6 69030810.52 129181963.3 76909815.36 67173833.21 115177859.2 50982197.48 62366612.9 88871673.44 124731795.7 68980945.53 82870075.11 130518006.2 78776421.45 54022430.52 137816547.4 75350273.26 85536616.78 70393138.9 85383359.75 79980377.41 119117594.9 78197063.64 69441269.12 63377505.9 84748089.65 90054705.27 134193309.4 80525341.24 97222429.89 72731465.05 91795590.01 63879598.54 68469629.46 82256157.65 101368495.5 145695617.4 90522908.17 48191091.14 71373835.12 82776250.84 68650444.52 61892008.44 107933990.8 72246415.83 91987532.07 54591338.41 95519066.56 98547857.68 103248490.4 75849277.86 71175082.38 66687217.55 98594789.04 49999909.58 75074961.42 115289610.3 99392430.66 71172963.87 138679890.2 64448681.9 62989317.26 61858728.5 62006034.87 57613115.1 80095269.12 92295516.76 62107919.57 93777626.66 76847719.52 82682338.07 71211184.26 112976.4896 123500.9254 120941.7373 128275.2404 119575.1551 2R-aminoheptanoic acid1 278840.6373 4870861.483 3053009.191 4022976.959 3125347.392 1638960.011 3227717.017 7114056.139 4705594.338 7630152.63 5587514.631 3072026.517 4311106.903 2733178.559 4638332.754 3662067.865 1146950.556 1006016.698 6226313.369 5608637.216 2465974.689 3703929.984 1393288.633 3739139.251 2832187.88 581989.4637 4015694.004 306491.964 6776657.736 4802495.172 5879653.965 1085485.956 3672572.506 2063480.736 5526862.571 2954120.491 5428260.112 1640562.086 4991998.534 5657794.559 3067792.604 3509227.939 2385382.924 2726713.563 2141947.087 3490278.989 4218906.457 3680426.486 2150400.149 3080085.328 8347462.867 5196718.959 3120414.886 3270191.027 4366551.924 4681891.076 2735456.207 4542144.126 5130122.733 3198314.983 4164021.071 546118.6796 4466620.036 3267610.959 2753078.768 6637501.264 4410942.296 9078788.185 2075366.658 3591528.78 5506028.065 3673620.673 1341632.588 2159339.484 595720.4348 2821710.769 1069459.222 2839494.289 1639904.213 2959135.294 5826337.718 3253500.305 3724066.02 943894.1283 2758475.433 3685055.684 2409546.714 1021236.39 6040939.874 4119984.102 1429098.988 4542026.237 2497260.209 2147374.305 2573292.083 73267.33326 101413.6659 3236039.182 2583877.079 5021830.462 2454913.052 6386975.684 10475511.97 2412568.185 1057662.32 3974348.299 2427374.705 3283124.077 3492562.653 4209714.474 3279149.641 2231764.395 6271129.32 4997583.569 2733125.508 3591711.31 3729129.177 758357.6632 2776855.956 2552145.182 2666450.667 5893267.207 1047265.205 2390557.651 5470094.466 6650097.583 3456689.662 1843126.702 2930282.995 4088087.702 822956.2962 3527278.486 3369961.044 2701226.299 4589226.06 3627438.675 2184048.926 4217371.936 5166672.553 1408197.468 2855152.555 4076487.7 4042610.723 4588095.895 4616279.967 5243099.246 6463147.4 1152202.571 2661861.474 3894053.238 3826248.224 5053547.646 5757586.39 3203122.16 3986039.366 3560151.865 3740931.509 2694938.767 4470585.938 3382723.738 7465402.807 4548535.206 3060388.869 3722162.12 3803431.669 2232172.621 3634368.986 2820064.285 3247069.467 3833437.3 5450730.789 106267.4851 37748.06638 108071.0626 41235.821 39177.49764 2R-aminoheptanoic acid2 1580126.405 17479231.47 14308300.5 14491318.43 21311308.71 17709167.2 15332640.88 15203993.74 16824316.62 21348914.67 23622086.36 13365412.05 17393447.39 23608638.16 20887438.63 19440008.53 13320979.92 15688592.72 14280926.36 18564940.48 19343115.9 19560181.01 21340116.06 19199725.34 18714043.14 13657026.57 12462080.05 18322007.79 28436512.16 17416729.55 19202436.67 16726600.23 18237811.53 22287599.34 16447072.22 20083049.17 16019261.9 17463808.81 19413200.57 19209839.78 20304475.19 22992894.97 25102530.36 21937315.45 17457260.15 16777556.34 19039700.05 16055578.81 14040418.42 14004129.18 31010238.65 19811765.03 8328304.338 22335876.82 17596583.61 19466390.59 16802076.65 14256902.88 25833038.3 21721376.48 20226756.98 17484604.14 23116251.07 14259646.77 14018877.85 16882173.14 16004816.82 18789159.39 20170415.13 15072628.4 22123080.83 13977974.56 14595498.51 23239142.94 14380413.94 17937255.51 25895197.99 15671057.71 11668359.6 20631683.21 13248672.69 19640191.05 18666509.27 31560437.48 15354720.31 19800761.15 17459003.17 15639823.79 24468917.06 18523869.5 12756144.95 19590080.79 16167987.96 14149206.65 13061833.75 1093527.607 191377.4526 11959463.87 12729029.29 11446425.74 11702571.31 21080955.49 30501572.65 17954907.59 19713406.04 19961262.58 20160346.55 20970988.26 10617203.8 14048765.47 20259152.69 14200794.84 21956428.6 23184109.04 24552986.13 12375211.74 12945388.64 15972167.49 11430708.13 21012312.37 22383134 19626112.18 14591568.43 17621460.87 19389200.41 24256277.81 12391818.53 16202891.71 18522140.93 19993410.44 19915993.61 17419798.37 12877158.03 12707228.43 17783949.01 21294930.09 25950426.6 16940833.43 17357186.42 15672084.41 29897126.3 28562709.84 18504821.19 17122220.97 15583987.47 22372291.2 22147159.82 14768103.81 14540204.47 13863898.86 12085705.55 21999878.07 12244819.93 21144406.71 13410458.7 14916943.47 14218783.65 23507841 20098438.8 25599010.94 26468876.29 17086772.94 19559266.92 18823480.98 12718547.96 13440803.66 11762923.16 13775662.15 13875543.55 13263343.5 17788422.88 196589.0933 213842.4329 177740.9305 193774.0423 200401.3717 3-(2,4-Cyclopentadien-1-ylidene)-5alpha-androstan-17beta-ol 57399.67759 1321414.622 2241589.446 2267731.68 253488.1512 473163.5443 166338.7887 2709715.771 209609.6062 355998.8648 558917.3076 297223.2169 182081.0912 626637.0006 160053.1131 516078.6204 1630576.234 654486.099 809344.3115 443748.8985 611736.5439 2805624.254 1089753.114 811851.7191 363388.8098 2050277.427 2360798.783 357921.988 513186.9132 354553.9518 535215.857 120962.1842 890722.2016 7781738.487 252159.041 583810.9951 930961.1817 404563.8393 69721.56567 530524.6139 226400.8576 2610487.969 244211.6314 1502821.46 632649.7628 607329.6875 580481.4878 486166.6863 2164215.021 2533436.017 1198651.743 2139360.74 453400.5348 1883401.447 940270.2622 613039.6974 540003.5079 421502.5473 2414745.841 554444.1816 142302.911 445209.8492 1787048.843 417497.3361 3544169.174 777413.2103 230419.3477 1959954.283 301700.732 564188.5195 1037330.299 2329114.115 2510766.5 652333.5835 514457.7905 5371867.613 719092.3808 850725.2735 965248.3116 9463091.765 3107584.525 317208.0231 87011.9565 922596.5061 1550472.237 953650.1828 539900.1947 1325337.824 1068602.192 1205725.544 2604041.724 1906990.053 124928.1649 1926871.941 2486199.447 49253.76541 43653.88576 1980992.032 2125030.276 168028.35 187973.9091 121445.0278 469088.1851 1130835.34 90585.33812 2894584.806 86929.65987 112104.7183 199280.1035 538909.8962 1526146.738 407080.3781 5454336.42 1774189.548 97508.99378 2436194.016 2594281.508 1672363.629 226908.2918 62580.49785 250729.3723 421415.784 525188.0903 3561809.378 183440.4231 60219.20174 581879.8282 848764.1468 170135.0697 167431.2857 323034.9236 50157.59279 1960796.061 2557963.144 128486.3212 1872460.877 108686.691 201133.7958 753076.1851 1436678.133 1379599.871 547584.9423 242084.4465 2698767.985 774541.6051 387294.54 597655.7601 573628.5162 51557.87932 2349613.708 2244155.471 1791501.601 186832.1066 335625.9249 1585310.597 1317509.693 1475539.106 272367.9272 1540452.779 4756513.662 217565.0739 956182.5806 192555.6992 272204.4308 991599.7578 244395.1256 528173.353 743350.6106 2312934.617 2608624.773 1335340.733 46621.87887 51587.38661 41999.74158 48371.28466 37584.33411 3-(3,4,5-trimethoxyphenyl)propanoic acid 40219.54728 2875151.94 2572337.69 5138549.885 1497962.096 355652.8488 6178635.996 5397023.068 2581638.527 3394225.652 7381031.668 990065.3756 101862.5024 6183326.711 5152021.211 1136316.365 2360080.938 8811828.872 1039458.307 2438389.251 16192335.78 1117943.11 4753442.067 771990.6513 6132225.101 2134073.88 4996690.107 130771.8533 190530.0703 4662619.917 1593879.313 1730184.033 643206.9722 3325992.475 1319635.228 4286759.221 1985308.917 2345242.404 366311.6382 387439.0774 3398326.985 192926.9383 2307373.507 139502.4654 4790693.865 14368471.72 3387552.703 1730814.011 2424484.083 5493778.938 534985.4298 908086.5837 39101.8672 7953633.431 318555.9072 5817585.609 6781840.415 508099.7345 5382333.939 12730512.62 1985991.887 676973.6161 22477942.01 4741223.085 405555.8676 1459092.009 571551.4364 11016594.58 4467415.443 313287.1641 4242546.996 2291575.455 5414853.062 8358869.8 1489305.542 1824029.239 264140.9805 1548323.874 3758715.353 403750.5242 2917920.966 13938550.35 7361815.644 8505114.814 2347604.262 4993537.261 1423049.222 1485283.205 2186903.535 369345.5299 580303.9069 1973442.442 1043701.298 2183957.093 5096323.781 36335.38126 37307.7353 2010870.425 4855644.599 322122.8043 419817.7774 1097362.522 4004283.321 150744.551 912167.1135 4712713.481 8714831.616 1556513.335 1105115.967 947815.3976 4159500.033 428767.0815 3570789.72 315413.6005 2984206.412 1978242.709 5284217.221 291256.5717 2623220.617 578962.3508 351231.1047 491767.4412 11128851.1 3161132.075 709066.6831 7636405.389 892094.0802 6005083.589 2508851.352 44927454.64 1709171.613 10578178.94 2309385.765 5346978.146 947072.9585 2405611.323 1626140.683 876445.6361 1931342.069 6392205.905 2051286.241 8918235.181 67065382.41 752878.6287 1214642.67 2234431.518 598531.8573 1292293.743 2460794.217 2588550.237 4929850.774 8453966.641 210878.9188 1721943.477 1945272.948 6384567.888 1490458.761 4397692.974 3551144.704 16120069.03 2495441.49 3261433.982 6901243.607 2970375.849 689419.5258 1317261.637 313067.1123 665162.9087 2540076.648 5220367.561 2900605.096 39649.94834 41016.98011 38457.17746 31826.35112 31598.38124 3-hydroxy-2-N-iso-butyryl-anthranilamide 32217.88372 2009164.325 1221869.529 1012847.103 105655.3847 3405246.17 69402.19751 9984131.864 342675.4419 7962839.116 483108.773 17055320.23 467626.7752 49569.47281 1704175.727 14886521.52 1472032.014 2797331.696 57514.10699 7040904.344 13949035.21 13749506.46 8638919.492 18421739.11 2080120.456 1172100.831 1032067.812 88007.70373 12492505.94 1007794.586 4949892.425 463615.0215 2851123.605 680460.4135 10619016.83 9014470.289 79811.41275 13809686.94 23461497.33 153072.2754 110507.8225 91265.24512 5401382.975 357778.3801 711128.6904 56235.26366 193467.1276 8775634.338 1399801.394 1269048.213 14132093.51 12996970.89 60372.56967 160035.7884 101057.5423 800333.3205 1834409.002 19039019.67 514830.8752 5298156.143 2466628.574 276920.1836 138621.3189 7624920.227 14735624.47 4840183.88 11058424.43 624458.9217 192865.1683 2773518.309 40159.58602 1306362.058 1168202.803 12280112.19 202522.5512 13773259.94 12995339.11 1898850.184 12836064.63 174071.6307 1264532.331 13765791.94 1327822.33 2375626.093 11366850.99 60301.28223 186323.1744 19307588.51 3824275.539 5965332.565 1457630.461 822346.5845 14698845.35 1202597.788 1047624.905 30195.11206 32162.72725 1113703.623 978306.3002 10881307.57 1844868.24 1372956.945 96934.6531 40802.91081 9393290.105 8426614.6 323705.4466 209701.0859 1771216.568 11708199.49 16558543.26 7189340.291 4638194.426 926710.234 818545.7858 1246487.784 1106973.187 5560138.24 180174.456 10268794.59 592648.8298 834333.4418 16168623.49 105246.2384 55429.12615 115668.8515 11409163.25 15288994.64 5965782.927 4381115.877 608846.0837 2734649.017 1292783.694 1179699.543 373493.9252 486464.7613 135066.466 9970204.212 10375648.49 16228356.32 52474.67137 2817831.821 10105588.8 74800.92244 19030226.87 176143.6448 10464403.82 17177565.69 17784960.64 1372978.101 1097677.702 186460.327 14287391.38 273466.643 20002975.62 8627128.078 14293679.58 731794.1435 432544.6003 8827569.63 1108580.444 157850.6936 267537.2115 14823739.39 17325814.86 7960166.793 285650.4054 12556038.06 1293185.995 1055552.44 2263876.3 31961.6748 30082.79037 32161.11417 32968.7046 31323.04184 3-hydroxy-N-(1-hydroxy-3-methylpentan-2-yl)-5-oxohexanamide1 48187.72016 16744653.86 23807571.42 27946967.35 19165653.77 25003067.02 7143671.001 39535712.54 15534618.86 9299957.368 22149505.57 18579101.13 31161149.92 38391096.81 8112021.103 39669043.66 35452593.68 37266864.39 8346011.281 20123406.66 18631781.2 28206099.86 18071541.99 44675550.05 8689817.341 24392942.73 28215371.1 13724796.5 8531655.761 29832297.23 42047682.24 10072327.25 25168513.21 12407526.39 25703132.41 22437816.57 17765750.12 37119688.82 19751053.86 11095574.06 34816613.67 10394219.66 15510984.49 32281250.36 16369579.13 57075234.45 39700937.94 11467628.18 23036926.45 29763146.94 7709979.012 8889972.912 25737634.63 34124537.09 6300602.527 20888631.99 43419586.99 45383404.1 17346415.39 42841920.86 24947087.06 18856780.2 29379854.8 45686924.28 18583564.82 7188159.419 12499567.9 16967406.03 19683742.59 36136252.57 15472253.72 23171527.61 28798957.18 20516555.6 18254939.2 3337223.927 12602106.34 19609840.11 25046899.14 4675892.426 20342950.49 10540950.83 18609960.54 20555408.97 22437065.17 8373940.315 10238553.59 11498485.67 5950322.917 4464879.922 1883154.504 18261896.39 4237403.264 22229431.99 26407799.67 42190.90279 38096.79043 20147935.44 27525014.04 25209516.28 6457220.215 21677454.07 17016543.14 21367511.46 12827382.04 18342559.38 6055452.233 53908982.7 10424453.27 28008689.53 23276381.3 12434553 14940614.08 10055669.71 14803933.93 24822784.69 29680182.34 50442855.89 20689881.99 9723891.433 14340202.76 34407018.83 18978679.41 16285949.87 23641524.73 21327854.31 7828583.525 10939400.44 23961658.4 16956210.36 22057431.35 16361678.95 25076016.94 29031441.43 18655842.23 24342262 14934686.25 11361207.06 15115926.52 10136991.17 18584377.21 20469882.29 16806868.15 11621076.2 17647547.47 11311862.74 22682879.58 24165662.49 72467675.5 27624039.71 26941135.83 22181365.83 28248724.01 13024176.4 11273174.99 9219219.582 37597897.19 40075684.31 38496457.4 8349562.501 18727751.01 10596678.11 23274224.82 40532911.59 14978058.37 32329233.81 10774820.97 19744423.5 26197980.41 28988327.91 18941787.74 41950.55031 58378.43146 139467.9013 59739.88594 75542.23137 3-hydroxy-N-(1-hydroxy-3-methylpentan-2-yl)-5-oxohexanamide2 56143.6146 8588626.516 10590347.86 9820525.252 12968241.87 11809270.64 6835544.936 23990950.01 6333824.776 5396831.748 10910909.56 10716744.42 13394195.91 16951560.63 10395545.53 11517473.3 12228721.28 24397643.99 11114987.75 10187356.74 20117795.25 7697727.795 13518412 16005773.51 10312928.03 9936425.357 12866709.45 11590771 10495722.24 20755201.09 24488971.71 9695224.611 11793886.66 9841540.196 18576357.98 9158274.534 11556520.77 15274507.44 12523022.32 11339920.33 15046657.4 6718323.746 7171844.817 17177849.19 7263731.398 22950167.74 7857298.167 4647666.199 10436686.28 12737648.52 10141728.47 8047707.888 9189276.697 11079748.62 7566538.383 16038438.34 22330422.15 28824372.83 11581707.68 15045536.52 14888116.64 13239278.88 15793444.78 6701348.434 6182809.173 9094561.316 6865894.374 16342388 12865136.96 10415665.35 14731121.99 10242241.27 13182534.47 15291670.09 6995834.891 4650766.033 9902331.882 8832685.404 10126633.44 6740337.079 7522014.533 5548537.791 9617279.312 7528309.516 12953653.75 8787639.327 6879717.292 11640521.56 6885834.232 5049307.148 7272503.946 10132547.93 3706983.686 9346211.209 12524543.68 40754.2743 40586.9071 9296725.531 11154493.22 10415654.53 6412789.556 11193443.28 11543337.02 10675853.43 9083854.549 8982687.869 6546695.74 11826546.25 5477401.746 16889208.27 19542842.33 9286017.559 7650525.649 6659366.804 7697519.289 11346523.23 12512866.92 14584706.7 8655517.335 8240252.676 13680524.02 13933962.69 7431722.993 5471432.332 13226363.83 10837715.7 5981259.613 7385461.079 10560617.7 7005750.646 9948575.915 11615538.86 10277966.16 14444255.06 9879194.708 10476878.72 11188008.42 6719391.958 7618278.379 7523335.255 6995486.995 15068858.43 9360065.228 7708079.553 14158946.37 7947615.021 11342879.67 17597090.38 12872543.44 11400402.54 12266794.09 12501995.9 14933316.75 6456220.436 14863236.39 6689958.405 11990021.67 21528514.06 16590729.94 8499922.019 9567327.41 9656979.4 6999472.311 14454647.72 1878546.6 7946456.728 6831195.004 9315306.455 11916318.78 13082972.49 9820374.266 39814.89936 58378.43146 139467.9013 59739.88594 41743.006 3-hydroxyoctanoylcarnitine1 93202.34791 2877702.946 2189667.202 2216095.069 5350473.199 4742004.896 3583580.596 7449261.465 3308178.378 4872553.203 2159728.302 4965748.086 4805475.499 1342376.409 11800722.91 2072853.424 1894307.152 6436771.666 4081189.31 4238106.046 4645235.36 4953840.578 8009283.898 6222075.946 8574926.777 2116240.343 2337716.68 6183841.681 7216857.93 3969885.232 3599281.613 3529245.818 5767458.043 4542515.568 3477508.033 2260818.388 5055605.716 4329725.713 8124007.196 6850989.282 4212963.789 7181554.008 5842768.508 6130650.683 2223726.658 5022819.484 5481534.525 3427043.63 2197181.398 2477309.154 3582931.842 2501127.401 2326964.974 5379294.823 5804032.556 8644801.26 9123080.903 5328299.824 3963006.05 2430125.703 7431140.633 6297316.406 4875541.819 3694308.197 2264891.822 5887481.393 3111513.812 5360648.45 4356378.97 2943614.933 9364468.879 2113327.387 2404409.945 4971381.292 4015320.295 2933070.827 6259695.083 2613784.673 2544154.504 6516061.039 2098844.895 5590654.532 1910471.829 1094283.705 2569794.875 4789722.098 7223687.64 4413067.158 5361423.544 2759870.901 5227025.878 3674419.319 3344017.81 1995023.316 2301758.244 109559.0052 97291.54588 1944188.152 2209281.532 2838906.271 4462097.208 14910139.33 8156056.412 4223449.488 2825652.345 3684948.086 3240231.784 3770760.178 5565429.642 4691769.255 4855015.488 9880731.393 2526294.996 5432436.261 2151478.386 2317857.509 2481542.79 4294909.974 6245393.297 6218679.768 3860193.61 7062521.885 5134796.825 3677953.89 2474909.941 3781732.878 2909381.26 3686078.194 5848762.881 2890221.079 3987166.984 5857954.688 2249141.74 2409422.467 8498696.833 1300745.519 4587654.636 2392927.976 5760518.789 5014836.13 2758069.288 2689914.608 4757022.627 6299065.967 3078256.596 3289002.454 2791918.949 8134306.408 6548995.159 2524388.422 2125372.821 5371925.864 4732060.788 2976957.629 5332234.994 2684396.136 1090128.56 6879641.791 1928809.388 7784646.275 4584552.999 13612975.46 4231698.568 4987486.509 2144653.801 6008129.507 7433347.322 4110392.675 2401084.354 2449802.395 3278772.605 99334.10117 98626.31754 105831.4466 115387.7451 109948.5979 3-hydroxyoctanoylcarnitine2 62849.04985 1120767.226 925755.2997 910630.6485 1932768.94 1478191.788 1196837.298 2880773.262 1199825.618 1626696.041 644464.4726 2150561.901 2224957.862 1480606.975 3600749.974 674754.1108 167325.4939 2178210.413 1499566.271 1235516.566 1822832.586 1937380.097 3118408.151 2052326.554 2560965.489 815100.9061 959760.9587 2344710.637 2005476.71 1380226.618 1669946.864 1137217.705 2052174.255 1648122.136 1356123.219 948712.3076 1930987.755 1451920.495 2361750.4 2622813.006 1917491.703 2141288.74 2178573.986 2121853.194 809096.5711 1882912.902 2130896.591 1041725.729 894747.8388 1033050.616 1448931.481 701789.3823 882882.9803 1899661.159 1701466.733 3210132.931 3662770.465 2279886.311 1237997.558 926389.2693 2719388.273 2349938.514 1867327.674 1308974.778 873910.1231 2156817.908 1386565.482 1580756.023 1850062.152 1156956.64 2412505.645 836329.5979 1047291.232 1680420.129 1157679.913 1164432.194 2409994.592 1076019.268 994247.8718 2013457.405 706267.1242 1853105.608 710785.2428 564145.9326 874600.1095 1781274.264 2485749.864 1799338.713 1481914.705 979939.65 1366167.394 1231133.442 1187774.825 805697.2352 994299.9015 75222.32272 55508.93743 751823.3293 868120.9543 1154387.585 1760442.554 8957133.852 3034423.416 1535079.379 955060.7966 1263360.916 886130.9164 1432205.773 2331515.59 1768717.617 1772893.957 3162862.125 956245.3017 2135457.156 1085123.738 1051104.427 1074198.536 1830659.878 2294271.564 2026997.181 2214540.275 2997369.832 2013522.652 1294461.469 915332.7202 2673936.436 1048063.978 1246376.701 2289914.632 1583688.595 1623916.504 2093906.695 931931.9263 956985.0468 3057067.252 709935.4064 1703489.984 734022.6189 1459949.898 1591181.419 2050987.433 2182411.324 1829839.63 2463315.761 1198245.389 1110579.077 1234627.693 3232872.172 2488307.151 1008304.562 930656.3329 2118780.807 1706879.323 1245049.713 2006364.356 885489.3627 633520.8797 4160678.703 1186855.194 2832417.521 1653245.496 4251807.36 1694694.218 1669467.257 733103.9665 1862105.625 3524212.862 1506900.018 990319.711 994691.3483 1313422.563 64131.74986 57666.35621 67890.17106 61388.89982 61733.58568 3-Methylsulfolene 31481.94384 4913714.095 5844657.439 5868148.915 4352093.161 5868056.148 4742832.506 4541690.563 4205677.372 4644507.416 7230759.643 4892385.229 6923335.816 5991038.366 4315136.718 5019739.828 5045239.834 5451058.193 4547236.806 6028237.365 7107267.381 6496058.769 5531384.891 4399699.554 4702941.261 5334271.348 5788719.738 4232410.534 5080958.939 4963328.183 8199190.504 4264660.995 4768453.544 6115456.735 5001135.305 8547529.958 6139034.81 3310198.397 5000679.959 6166536.568 3102063.781 4048413.247 5605960.571 4374956.492 4822570.847 4519654.266 6653510.787 6048818.45 5100201.646 5998313.45 4597343.256 3944311.725 4181554.421 3210824.197 3974299.963 5018280.919 4267772.02 4654614.593 3506805.551 7041334.129 3940048.036 5787294.851 195443.5636 4402804.035 4494825.471 3917554.263 4188711.423 5565567.396 4558545.863 3753173.148 3623416.832 5488299.861 4842681.071 4883566.907 3081335.109 3594951.471 6713247.165 4094679.5 4042416.389 3135046.736 2832302.023 4776319.317 4187103.551 7433679.014 7506421.338 3390214.992 3739605.227 4844390.983 4502744.63 5406608.344 4299650.19 5107097.761 2298678.814 4516169.607 5717997.898 312247.0073 69771.73836 4513398.374 5447905.306 4353480.097 5319464.919 5583031.54 6350971.53 5543337.435 4984143.516 4210690.249 4956509.401 4153002.774 3654624.38 5296173.32 5550949.72 5172254.428 4480080.191 3850769.962 5484997.477 5056657.127 6067650.288 3312188.961 4401273.924 3362708.726 4468584.622 5522837.237 5559562.737 3948388.961 6187643.581 4883714.318 3741513.428 5323890.341 4589676.936 4539410.895 4688703.963 3399722.615 5038513.12 5649044.966 5153951.272 6112215.11 5176869.139 4338259.76 4244012.242 4182673.051 7655928.738 6703576.643 4229548.388 3949465.562 5422544.058 7216509.632 4563181.174 3689030.203 3184775.428 5590025.414 5573968.403 6115399.257 7181798.745 4695344.651 4929614.219 4006328.677 3766466.222 7607713.964 4982809.121 5539036.671 6228023.357 5230868.042 4269416.8 4411007.009 4201987.677 3081696.013 6123590.561 5746910.306 4829259.985 5412805.649 4592230.332 68169.14839 51552.96716 345464.0917 22289.69143 8521.348567 3-Ureidoisobutyrate 488988.8873 84154816.51 24721145.21 23736329.32 85416540.48 78406345.17 114870635.1 82792706.46 101993967.5 96078878.21 103267071.2 70684845.39 109112394 96403517.3 80612932.83 80582565.4 119276914.9 83774236.65 113858373.8 156094184.8 91760447.81 27056322.97 102422852.7 81951384.71 104015483.4 23302714.15 21937026.26 111311101.1 109263569.5 94161184.44 107173646.4 108240745.5 88375219.44 99233617.93 98722033.41 102972395.2 108612322.2 77798982.19 106644473.4 107329998.3 87103867.03 92824058.97 100270122.3 79337669.81 84101486.71 70191085.2 97427776.01 100052137.6 23131023.59 21966288.36 104224988.7 142873104.1 73213410.32 81120791.89 118619872 106378004 91109006.6 65453720.95 75177635.76 89082530.21 69987234.74 82965588.19 85710370.88 82048021.07 90894041.29 115957525.9 91586077.13 103374657 90654637.7 72444073.83 107357854.5 23154547.78 21582686.34 65881844.62 95413255.54 100713581.5 101588340.1 94351924.81 73960084.57 86071541.3 83921872.65 90589032.46 94384001.37 106226883.5 95548478.24 104754173.8 74917906.14 110700370.5 93057216.25 119148732.9 100105631.8 83734086.63 65671152.04 6138056.377 20693500.36 1203790.404 495749.8076 19792379.28 20264167.66 94702987.81 104748552.5 118099245 119258490.5 99713460.61 74078020.53 82007843.66 86379686.65 82948217.97 82260057.58 95556785.19 72626412.48 91714898.64 89509027.43 85112021.52 109343208.2 18635665.14 22218036.73 86568667.32 94025037.8 79712555.44 101229418.5 90926272.9 82823258.77 88744336.78 110730167.2 85009720.46 92492667.93 111004836.6 84764241.23 103380425.8 104957192.9 83145354.02 20020515.6 20474486.54 108958782.4 116893120 103800977.9 116918410.2 101637370.1 97940302.41 127503981.4 118487704.5 98750644.78 112527671.2 92503549.08 102444723.5 140010101.3 65915196.1 85156904.66 7373781.776 20117913.5 94153009.25 99184350.08 94665110.46 106243465.3 62341232.01 83638984.13 100052595.5 93795253.96 124718446.6 129659796.2 100998874.2 80527511.8 86470256.93 100127929.9 75035572.43 85091299.86 93799758.19 14069688.76 20913170.09 82463529.8 460732.5776 501168.064 443971.2999 454135.1326 469667.1568 3-Vinylaniline 78051.68852 406492548.8 416459546.3 372593616.7 491318203.9 382646251.3 232741351.6 436561737.5 395883481.7 261738406.1 551352432.1 373680180.4 513983568.5 733437898.9 399871714 457577154.7 404474580.8 620971323.5 78000956.06 447283697.5 402962976.4 417779688.2 456609888.1 476203574.4 396251533.7 512784400.2 534412799.4 407699543.4 399368964.2 453848906.5 807877002.5 420817286.2 510782277.6 537452065.5 627118322.9 585950859.9 204153776.5 374474459.9 560691253.2 390864682.2 529383647.4 351958565.9 393973268.2 546852923.1 441130124 677161927.9 521880790.9 449295192.6 648791918.4 589878826.7 589645559.3 400253011.6 455401777.8 551515456.9 451020272 583239875 591718612.9 523603125.4 558110276 700584948.4 597678204.7 620728521.8 821412606.7 417002225.3 554609522.5 393411636.7 539751251.3 653142165.4 614707279.8 509777076.2 516411662.5 513056129 762951215.1 723899733.6 428117789 536221444.2 662890828.7 583114624.1 574193696.4 511684713.2 362870024.4 555554779.8 576607314.7 806997089.9 681886687.2 373612038.6 496947459.7 492949769.5 526484625.6 524961250.1 376087379.9 639095479.6 363539576.6 611349199.7 558259275 380741.8429 108444.3639 482531484.5 456102074.2 460850156.5 399741908.7 360177492.7 367069549.3 439371305.9 493456762.5 469361911.4 322215816.9 373884467.5 330886300 485776251.9 556629281.9 515996767.4 399740243.7 319538185.7 501420076.6 533236363.7 485830783.1 394416434.4 507430135.5 429410574.6 425873298.5 610810609.1 589496941.7 338611243.8 598883813.6 402000325.4 408473238.3 410743356.2 510731538.3 462709952.2 559214592.5 530396050.5 532970005.9 577019976.5 576291570.4 614624409.9 621257564.7 427363775.7 495406782.9 576138804 463488422.5 516410851 533107022.9 438829324 719920124.1 514100761.5 450458066.6 540734347.5 535634622.6 600043587.1 552005267.6 600032985 757470398.8 555805819.4 633535845 455875252.4 575992217.2 655287429.8 637360538.1 494655661.7 501645191.7 577103354.6 544344803 611928459 577486024.4 536868881.6 511775244.7 576979646.8 690808897 694470599.5 566695721.5 105886.9207 154398.493 243412.5025 81426.29673 328001.8515 35-aminobacteriohopane-32,33,34-triol 8238059.645 28746329.39 28799997.12 20083424.14 25190404.63 22828543.42 23131888.87 15830319.09 16361572.72 20784352.33 13893634.98 19809865.38 13396355.58 14237473.37 18026603.3 18524014.27 16131729.86 17918388.58 13222955.18 19090082.9 18225013.77 17580667.13 17190879.31 12573256.32 16184352.23 10976596.25 11670085.33 17404010.06 16848147.63 11357620.95 9315514.518 16872381.96 15232329.56 14238042.49 14023738.35 14646900.86 14736928.83 14072946.13 13420813.35 14501256.16 15201617.91 10441074.71 13484136.77 14777354.27 14679723.89 13641236.34 8707256.151 12521315.11 10812304.3 8546565 12647564.49 13548582.28 12372827.41 13485211.31 11229832.81 11649352.13 9518072.656 11626512.35 12166380.18 10096315.01 7290327.863 10607766.76 11314965.91 10915782.07 9147702.693 8176797.836 6869690.202 9233448.985 11555292.73 10148590.94 10064974.66 9270435.541 8985648.369 11997869.4 9884045.695 13069845.68 8876440.516 12913176.56 12177997.55 9925061.351 12470764.76 13301966.94 12468040.37 9229226.47 13085600.25 11846049.08 11927060.86 12587409.2 13571564.13 14288933.11 13409203.05 14051768.45 10842268.14 13562881.27 9886661.897 6742962.126 7544782.906 10312072.71 9581375.77 13316832.23 11495354.63 13186786.5 14407497.75 14134776.24 12368957.11 10903643.17 13250958.89 12982749.94 8245077.808 13014595.26 12653494.23 10700041.03 12088843.26 11050673.37 10200250.61 9870818.019 10010045.07 11593125.11 11620170.59 12503494.35 9909729.127 7499177.263 12757168.78 8992510.412 13240577.93 11954054.43 7363864.939 8643407.4 10551040.8 9653586.856 12068403.86 12640855.16 8445878.064 8710344.644 12694340.23 9078379.573 11274427.88 12451082.38 11521555.77 11249434.44 10269429.08 9461008.37 12223410.1 9614037.218 11650012.76 11680963.07 8337501.663 9196946.532 7357615.171 8760583.51 8002244.829 11570588.69 10112557.95 11067296.95 11060785.83 12013621.93 4812878.634 11514147.25 11576412.37 11562257.88 10764194.55 9094556.426 8567179.72 9688413.68 8151975.67 11155784.01 11280393.18 7774648.406 9374257.215 8365779.482 8566898.568 5976556.729 5024983.73 5583431.772 4921301.686 5010243.963 4-Acetoxy-2-azetidinone 800010.1914 5365652.029 5245266.277 6620896.041 4827231.593 9106787.474 6874439.203 31357179.41 9756307.095 8742912.171 7716705.611 4497737.353 3840783.427 7963543.679 7156187.954 8418938.004 20072300.67 20116793.91 14860396.9 8398837.535 5262609.156 6639033.34 7990509.237 5380122.748 13207109.03 4050562.234 5993743.309 4150944.377 23805743.12 8600822.094 5862165.591 8641409.912 9231331.498 5275136.988 11295709.22 2437653.097 8414275.703 14707708.99 9178434.78 5185901.477 6811301.519 13758501.06 8626621.901 8841400.512 9907523.712 4670594.252 2090688.577 6696093.847 2769186.332 4890831.653 6022113.537 9904805.742 7414370.623 19353670.36 9952190.54 44539672.1 17881819.37 11615764.26 16777341.84 3443365.886 8867155.998 2867561.47 7462726.29 8797712.753 3545117.594 7191233.438 2923081.538 6778316.828 5290558.661 9233106.805 19923846.5 5033624.587 5127762.74 12443992.73 10562749.38 6087300.025 3748510.636 4460862.946 4658593.552 4978801.524 10210411.2 6210529.899 4661084.556 4027953.218 11951116.8 8590005.415 4951085.295 7059408.846 8334636.339 4311414.886 9448337.147 11032120.21 3498802.054 4734542.763 7519298.396 1427605.655 1088084.19 3265245.943 5920717.713 12844372.12 906849.9257 3327123.962 14095740.37 16408319.1 6556461.037 8528810.795 10553758.38 24575860.82 2715381.486 9373558.648 5413587.468 2814083.327 12669431.52 19960536.55 6740434.918 4347792.687 8000038.637 10171734.74 12054237.66 9597794.058 12460595.23 3885500.879 7095169.1 11540796.6 5534500.479 4704275.301 3629629.672 3744080.529 6431021.261 6977839.491 5786599.035 4751886.773 2868753.63 6531303.825 1297197.737 2980237.471 5312667.676 9783828.736 7008436.336 5424755.686 5509577.361 4908340.931 10473204.71 12791375.24 6928976.29 13033771.32 18726110.82 4010417.408 7411164.401 4580442.909 7149195.678 2658337.593 6543900.01 12136263.71 21090358.62 5154178.419 7940606.622 6285785.451 3800781.417 6140064.6 10771445.5 6336513.774 3297315.655 3531970.482 3951067.411 7165960.934 5388488.16 15937889.48 3338257.13 6619010.944 6938940.409 1313881.559 1006523.673 1021940.849 1083563.347 956573.7951 4-Amino-3-hydroxybenzoic acid 489415.2348 2446302.83 2642778.681 3090444.306 2650081.91 3313561.126 2135859.943 1201760.621 4268202.467 2420686.246 11775447.66 3163883.688 5752676.745 4173123.147 1241298.274 5428102.989 4496794.129 4874433.716 1379423.956 2631810.528 5476695.84 2120756.826 4255313.659 6932672.746 8431798.484 3090344.017 3580389.369 1394949.626 1127726.547 6896056.433 5201380.65 10862731.95 8672676.352 2672553.137 8923111.066 2292438.173 1154393.559 5033764.677 3091371.427 3645363.2 3417229.269 4527018.344 2165533.053 6879910.46 3529681.967 9716913.258 6971013.64 942563.0998 1834622.655 3564658.466 3220672.732 834933.623 2192133.015 7996426.912 12263308.47 10013902.15 9588903.011 2905640.083 2507074.809 3571020.907 5951163.696 4388262.225 6387918.095 1999964.046 4578385.129 312478.4233 3083889.527 10751203.38 5736106.715 5880017.959 2846389.744 2254795.081 5692017.314 8529857.991 4753695.921 1901399.432 2635653.765 4508533.57 5249846.786 7605519.341 1745930.495 1543657.964 4375305.968 814857.8081 2696549.541 1250439.571 5814408.73 2581359.911 842074.3907 4772193.352 873880.5327 1110965.877 1367280.165 3267680.109 3786508.251 740153.3116 2120493.131 2475883.023 3145261.042 2142547.829 1504871.631 2233954.834 3111435.183 3620435.211 2432220.566 586415.4073 1203543.511 4804076.03 4040225.285 1815908.916 1808047.028 5560307.65 950363.3431 3526671.425 4865660.953 3179171.557 3561458.176 789053.4838 4835768.675 1151783.706 2576819.46 2981777.89 2224699.351 2644708.796 4411376.911 2886422.768 3093293.711 1639195.827 3270268.709 7167470.476 3591474.79 960629.3004 3435643.166 3745351.156 2651162.235 603802.889 1980275.209 2063519.608 2243073.546 1172716.707 2842033.31 2580404.506 2938918.095 6564475.559 4196219.919 2455195.321 2300625.22 19274379.44 6002461.773 3090089.657 3848907.711 3512945.953 3090292.491 2154971.05 5848266.731 3339971.811 5224566.34 5173271.511 4124255.827 1631253.586 2282576.358 2274147.814 3741087.176 10445178.97 3757328.586 6857207.772 1572781.615 2428960.839 3828477.991 5264810.871 4397714.342 442867.3109 1242123.197 3360932.885 716960.939 2532443.703 4-Hydroxybenzaldehyde 32131.66755 5678812.012 6350411.942 6733154.631 6304970.09 12047708.66 4616977.397 7817446.314 5547923.263 4099246.742 6814470.872 7469076.546 9036233.386 8672212.882 5360040.286 7497210.456 5673237.983 10051401.3 4557722.577 6851192.97 8441501.779 9178449.531 6799078.449 8598412.184 5609977.265 6299750.236 6656105.796 5236365.24 4551761.013 7557170.097 14873039.34 5799480.597 6296005.631 6254656.076 9343723.025 10806175.14 6856217.204 6914374.946 6362641.447 8808638.519 5290868.116 5041446.593 5007201.456 6361158.69 5704003.193 9139949.719 8331701.564 7061844.604 5061016.26 7639136.495 5823245.259 10131445.74 5639444.146 4585669.175 5366381.312 6130868.037 5850326.826 4644284.763 4823843.936 12507961.54 8735805.263 9623150.024 7971473.096 7923322.658 7586864.391 4666461.358 5507782.648 6624664.532 7953146.83 7119902.749 4163761.497 6654807.297 6588805.436 10001571.69 4841308.244 6431127.55 10142903.55 7393480.674 6314726.41 4860707.886 5473034.555 5275227.808 8000971.94 7538539.596 13243998.89 4566275.409 6160853.699 6107681.012 5022425.202 8166994.753 6273437.881 8255160.868 2330734.366 5297030.617 7447601.279 334085.023 194992.524 6194647.316 7512170.882 6448730.065 6495740.485 6948000.002 4818591.998 6085150.896 4798701.552 4940681.307 5693479.708 6118519.226 4850899.072 6096674.962 7682614.688 6166719.406 5120080.888 4737488.45 4425506.663 6440775.397 7604019.673 4953335.603 4697969.688 5023420.277 6086362.15 8192494.149 5603280.403 5362974.013 10768823.08 5105890.341 3986650.554 6426953.861 5702609.133 5757206.243 6840040.213 2568273.841 6620497.675 6237946 4554014.971 7718914.224 6029042.896 4275318.142 5649412.059 6830051.443 8134113.099 6295798.954 4345137.069 5804770.874 8875432.902 5330716.422 3614919.723 6184925.298 5180194.175 6932539.592 5241553.253 6425631.615 9093176.177 6223191.435 6739405.893 3337898.735 5905458.011 8726151.695 8384560.634 9263112.077 5257428.955 5552405.086 7045370.639 7576265.465 7502535.836 4936633.659 4632111.264 7794361.079 6332056.94 7519765.581 7164741.402 84883.19091 46406.78686 308009.7638 164473.3147 96224.60027 4-Indolecarbaldehyde 501766.3446 35903257.1 37737735.7 35750081.14 52138532.72 48178040.54 27454277.75 31867155.01 37632429.18 31525925.21 45646425.91 41469299.82 52174303.3 75525635.48 37800534.87 46790848.68 20240915.5 41927322.61 23102803.04 44516261.53 51338424.22 46555813.49 55933830.51 47326139.7 46838911.6 37410296.48 38100934.59 38601507.51 29433306.67 41811980.71 67244158.66 42853001.63 47600363.81 49108455.59 53701064.74 64701211.43 37714916.88 37345789.56 40699303.41 45366382.87 50915058.77 35975445.46 43790451.06 52527799.11 43190618.02 65263280.35 46238621.35 50796498.26 39356580.96 41588264.58 50990808.33 39800397.76 47775054.1 42051167.26 36756293.76 50055049.51 50112070.97 32240403.33 54266252.13 100086952.3 52088446.56 51707725.95 40240180.06 42704749.68 44726779.18 36195754.9 43995165.78 44815823.57 50199153.34 54963683.62 36682272.82 37317337.76 39142367.68 61081260.57 30746073.86 48357330.99 64552540.95 36814053.34 56250945.02 43736083.11 32692721.23 49459645.14 41362942.39 52286853.86 52328596.36 33654238.97 37226221.93 41716061.14 43164967.51 52442867.28 31490542.89 65577839.39 31747747.01 36362696.8 37870885.07 663184.4468 86414.04058 34364766.65 35778839.83 43622874.03 43766024.39 50750262.73 41257213.34 43964808.11 50316507.47 32051210.24 46675281.99 51848751.86 36367833.37 27271500.87 54814772 49455090.39 39839872.81 21849816.97 40657338.86 39946161.04 41392607.21 41134504.65 45315640.01 41511176.48 43530942.36 51430021.95 48063821.45 44164572.96 63712614.85 43233270.93 42021495.73 39952001.88 47949318.5 59901255.27 53435011.04 43122285.09 37910733.22 39956586.43 58499686.63 78519006.77 59009654.64 40720422.66 44725669.74 54472490.84 44687954.44 53119368.25 43413197 47818504.09 51182457.33 43202922.84 48157800.84 53866089.43 41868225.23 43158994.18 37763431.36 56948727.54 64784815.63 45327413.86 51994746.85 55828051.17 40408877.63 64334681.16 61541619.79 60722630.23 48794746 51386736.85 40989868.03 50259461.73 51940132.24 38781250.75 48164819.18 62741166.64 41637298.7 42152493.41 40522186.72 744475.7256 660707.0366 151296.531 545630.9495 578571.0778 4,4'-dimethoxy[1,1'-biphenyl]-2-carbonitrile 35067.66534 4137560.373 5387805.527 4707835.996 9416692.443 5510793.857 9564409.993 3131432.347 11540966.36 2796082.72 3613674.245 3678965.645 4630946.088 5304308.911 8376764.928 6719786.266 10017298.59 8935114.05 12713724.05 16615228.55 4207293.694 7211438.694 10147495.8 8123183.641 7459260.987 5529489.564 5124307.041 3056049.74 6046890.67 13018936.94 16744509.41 14755104.08 16339647.2 5486938.845 16620280.06 12289099.17 7967340.522 8306808.272 6809909.648 8451329.213 13658712.5 9245343.72 11935563.07 10383159.06 4260381.547 6615443.856 6657027.185 9652031.054 6583981.193 5117893.042 15129441.27 5563404.589 4474672.998 7336938.462 15532337.25 14661198.61 12707740.26 4053748.645 13757748.46 4810575.71 9537151.939 26816282.47 3553685.461 3637717.506 5468506.646 4621857.484 19924441.58 5479162.068 9461468.445 7645523.319 13679730.64 5135498.182 6893165.033 13721744.96 7127677.437 2741586.983 5047583.458 7446452.904 3914464.33 7336843.094 3368681.975 3222832.294 12764864.91 5868225.237 10229494.03 10507402.71 5356327.535 2787480.798 14660080.55 4580888.946 12878399.31 9428272.559 17089946.71 6479771.849 5199427.932 27522.74447 29534.33724 4732059.105 4783808.341 4909251.578 5676346.62 3492394.675 8245389.131 8678348.953 3949954.724 6449937.415 7504522.221 13732858.91 5349238.109 5459114.239 6234534.554 4496069.62 5668200.422 9590818.05 8717571.964 5001608.917 5583026.051 4750436.749 2348600.873 8338660.932 15084229.77 8964279.395 1482914.858 4702641.735 15176596.49 6472882.777 8727510.595 4690990.351 10021643.39 3679209.075 6099866.316 1673838.35 5072567.286 4915284.084 7695767.431 5235786.136 8741734.319 12343006.31 8669567.769 1671843.754 1355096.856 3461504.85 3451893.774 13698905.82 14634120.71 8297265.915 3731827.229 8014450.522 10911190.1 5800721.414 4779340.993 8828016.445 3932447.08 9645463.179 16358266.08 3321749.742 5986564.811 4925469.328 7946407.1 10208216.67 6099828.021 2992584.478 8513306.154 6982818.365 14710957.34 9963254.277 874405.1075 5049258.099 6381799.688 6452116.165 4836274.2 26196.75124 25390.51849 25587.75394 29534.19846 26004.70722 5-Hydroxyconiferyl alcohol 47081.44294 985516.0957 799398.782 924757.8755 1006388.693 2520419.264 460449.176 2826530.876 625898.6438 1043722.304 1301492.828 1354212.046 1432520.585 2161904.019 678060.6791 1972850.886 1098355.329 4656706.371 629297.2991 1324706.735 701172.3316 1175332.509 597133.0255 1986250.514 699981.2886 738375.281 914015.5955 828751.4651 865025.646 892978.489 1983234.49 909796.5824 981973.3338 888923.3708 1712721.009 1037831.855 874818.5423 1372904.889 711397.0472 1001085.888 1332764.901 508793.1784 559130.5944 702530.4098 919760.8348 2368658.342 717709.06 1042760.747 763835.3947 939045.5853 986368.879 1408828.075 2103492.779 947899.6191 850755.323 2984552.056 2836094.344 2203033.23 744534.0443 1329747.59 826401.2501 747728.8569 2867235.588 1581178.754 1093238.561 1523483.451 964347.1861 1871033.865 1133801.131 1620224.51 1478046.965 699330.8842 889504.5139 1876985.931 445512.2071 797233.4867 1027089.851 991759.9842 1082980.03 827082.5751 1551046.675 530031.1338 814937.5209 778857.5121 1743297.544 731921.7873 513737.9762 1247945.628 571392.9518 1135989.033 1055821.892 1362023.177 366646.8787 705474.566 916654.6193 32812.21606 34026.98724 677180.4942 702831.2267 1030538.736 380331.4624 1342820.18 806857.5841 999541.7294 431510.0378 756556.6268 736627.0766 955756.8686 637868.9493 1260321.405 1932937.773 995495.7139 515764.7824 1165273.506 675853.9369 630895.6847 816086.5484 436427.4525 618743.7237 333464.4388 767007.8564 1848346.663 1540772.93 778951.6413 1339760.943 805215.9367 497784.4286 1170974.362 407141.6531 480594.5047 1268257.254 523286.0498 698175.111 900932.5298 308188.3859 2053459.255 759547.9643 608255.8997 644725.7391 465033.7635 1453422.197 516523.9531 633753.0441 947200.4476 1522864.159 798031.4276 2054721.96 662900.3827 1316151.597 867570.7885 844567.8469 592300.6324 1966140.726 1308568.709 808041.1612 641883.0297 856779.9345 805283.2098 1161328.999 1078188.398 1308509.381 1476933.994 790090.2467 784418.8782 963370.3201 950289.0605 775404.6715 1803527.008 798939.511 862140.9097 1077688.741 31139.09989 37050.2785 34865.97485 35578.7188 35094.78034 5-Hydroxyindole-3-acetic acid 32061.72971 3116412.387 2416528.535 2718639.239 3641534.739 1280386.168 824888.7892 4795893.247 3644080.029 1044034.785 4006566.996 1569585.121 4672842.252 5423887.622 3530084.969 42212.00308 4121415.063 11359057.43 333350.8508 6387459.257 4378098.623 2829871.232 4914285.854 2820852.064 3839366.515 2875260.819 3545514.016 2498139.162 2691527.24 4431250.739 6895567.805 5152389.099 3756617.666 4985242.24 8673493.931 5381944.195 2814655.159 3820958.288 4773419.265 3740815.703 4139147.909 5003415.38 2847928.827 7225853.218 4396646.511 6479493.987 4838517.849 3524229.914 4113953.012 3703678.452 5983751.704 3407890.701 2724862.871 5840265.344 5178559.966 6366867.544 7823804.856 4776251.43 4159361.267 8422747.315 4815620.913 7505031.917 14701948.27 3336089.607 3696634.327 4505367.851 4843051.529 6199433.407 4280082.955 4334472.018 7335477.638 2752232.129 4297260.95 4845477.786 3407447.139 6072028.084 5833371.249 5210068.025 5723095.453 3913313.782 3040250.001 4305950.64 4678745.787 3722529.238 5881150.667 2665408.314 3958073.759 4142289.896 4091258.316 5058170.937 4533697.044 5921720.897 3009825.182 3215597.581 3598360.309 28016.41529 27227.4025 2642364.512 3046225.167 4357597.274 2284686.864 2428221.103 3366594.84 3962087.963 4617354.27 2606779.323 4220335.732 3624230.681 2287973.176 2516638.752 3598286.122 4942899.383 2527848.924 2951553.637 4303472.517 3236004.673 3454947.983 3541044.482 3179516.898 4437409.657 4513142.264 5346244.689 4011747.233 2784255.617 5957050.207 2606813.779 3045390.619 2982196.048 4542796.726 3552406.667 5254011.885 5754693.663 3023422.359 3873054.941 5395362.723 3613479.374 5781703.102 4103335.47 3531500.635 3961000.022 2869303.305 4412244.708 3599696.119 5425440.651 4400743.108 2818375.77 3857871.616 7072331.68 3519783.049 3326413.19 3622107.796 5096039.59 4006086.799 9852625.728 4535539.977 4221572.786 3398560.258 4951921.696 8258161.938 4767641.346 4339398.894 5380700.692 3911677.205 4229690.733 5157847.833 2542630.038 2990019.259 3656525.949 3760095.176 4106820.7 4106939.888 26363.47265 33009.46285 27622.09714 31477.48872 34902.65968 5-Nitro-o-toluidine 202303.5696 26019846.61 20171955.24 25131982.6 24545198.04 35961468.19 22406114.85 13129332.11 36953101.13 23062482.78 122327312.2 36070822.19 54713485 45436949.97 12701497.57 62434364.59 49200943.85 53983184.69 17770053.3 27425611.3 54500047.88 21408826 44209924.41 6296887.73 83747250.6 26789561.24 31819674.14 12006188.6 11469473.85 70573375.93 59880738.12 108154999.2 96370221.92 31642655.93 88973391.36 24925931.76 10412750.96 48633268.16 35361330.02 38715247.08 35117129.37 51150353.78 21641376.48 74099481.54 34201726.39 87842192.96 69318507.31 10185153.56 31618448.37 31812146.18 34904318.56 7683599.739 27386560.17 69073464.91 130495867.3 114074181.6 107502428.4 32512834.5 26151163.41 40419908.82 60085491.84 40167401.17 63624655.51 22026386.94 43251951.26 5171803.402 35585419.58 108167741.4 59898828.22 63094689.41 27997501.82 21159952.91 45206665.02 81940701.66 48017737.07 22987827.12 29749563.42 46831473.35 55853791.82 71729857.24 20067222.2 16806333.68 46277012.92 9359442.493 26217336.82 12574981.76 52393302.73 24342496.39 8748850.193 48643120.98 10350879.84 13819765.61 14023280.73 30884271.76 33275625.21 239141.5728 34338.63588 23761610.78 27265952.57 23704718.21 17691206.82 26218564.52 36235848.22 39760320.04 23427945.22 5524272.173 19266475.39 43170954.49 46720939.18 19695831.92 24797559.36 52676573.71 11378404.02 34602154.74 51368175.59 29739130.67 30850582.2 15198676.66 47636348.95 10276708.84 31570000.41 31702417.61 23643655.28 23442742.03 44045630.07 29938731.86 31348519.11 17441124.99 36564483.25 69108060.64 38579300.63 10964395.67 27790175.81 34673157.67 28349101.76 12801869.57 21912125.44 20054739.02 23559888.97 11250696.94 29707232.63 28137948.58 30953812.5 66971750.13 42475787.88 25489459.31 26114416.24 210935822.7 55409648.56 28939918.18 34217846.15 36879176.73 31076229.46 24052202.21 54663090.3 28283689.64 54027793.95 55266437.03 43936836.91 17786996.06 19742586.94 24126354.26 36002045.35 90764380.41 37158086.51 62395797.88 19717830.24 22170421.42 33642065.75 43159089.96 43409196.47 269833.5268 216248.3591 44633.28946 67032.002 73837.53958 6-Methylquinoline 33735.32333 19929576.66 20902471.52 19659302.48 29068979.65 27455756.86 14651116.75 17472089.19 21579915.34 17244442.52 25637492.48 22202108.25 29404849.81 43353304.19 20978005.89 25987235.93 10492865.28 23048196.56 12431230.67 24917702.36 28808478.42 26333033.82 31288126.22 25390210.23 26136868 20490249.82 20950506.47 21387239.16 15859785.7 22581652.35 38369729.82 23246089.4 26958102.51 27255637.01 30516398.14 35942802.98 20674766.22 20839827.98 22299214.97 25101466.25 28253461.79 19415132.51 24433950.65 29584252.32 23934302.23 37233619.41 26146627.64 28378577.33 21431961.52 22457898.91 28671351.69 22027678.01 26520268.04 23084955.5 20326167.25 28303488.89 27143032.04 17221924.26 30668211 57115606.62 29300707.73 28725777.94 22352598.89 23179525.55 24403496.23 20268799.06 24380866.41 24568289.1 28360308 30215079.43 19973215.05 21032086.01 21929679.59 34446928.48 16410010.25 26903288.58 36077297.06 20268357.22 31313510.67 24771511.82 17798471.58 28018348.11 23522542.78 29476386.41 28857059.3 18137731.62 20461401.66 23123555.15 23361812.44 29839496.86 17825775.82 36473402.41 17345426.4 20022674.15 20761580.91 60762.38197 38545.73974 18363774.38 19526701.18 24344407.48 24370429.81 28108233.27 21996722.84 24086120.94 27993858.59 16920063 25907386.93 28763982.69 19841550.87 15055226.37 30486552.74 27235631.27 22136136.86 11871304.28 22527511.36 21282224.44 22107889.98 21912756.19 24300396.16 23623110.13 23765543.84 28670823.2 26953079.81 24033814.64 36740977.36 23892710.08 22762758.78 22042326.03 26891365.05 33433609.15 29970194.38 23917738.46 21246967.55 21769166.06 32572788.84 44273371.87 29998853.72 22573491.01 25121109.4 30723405.33 24423743.08 29759777.52 24093819.58 25646582.15 28856041.24 24299675.49 25972461.31 29985665.26 23629969.1 23701149.84 20105647.04 31993076.71 36612287.13 25379071.72 29447145.72 31510113.15 22427792.21 35457469.12 34129372.84 34211920.42 26302813.55 27978557.82 22507504.75 27425230.27 28351147.24 21114353.18 26606139.58 35406312.11 22884928.66 22754991.81 22890912.35 31581.74051 32392.95099 36674.55124 35892.85843 33436.48637 9-Decenoylcarnitine1 30397.43478 504602.4147 484460.9696 617645.981 809732.3159 368422.2311 538507.006 2591359.622 291013.9726 640884.4457 670726.7775 728984.9566 952069.4911 1089318.769 937857.2337 184511.1686 1056499.083 7566004.175 999735.9801 627852.3608 277067.4744 449987.0021 1039942.08 734010.5387 706477.8451 343756.0398 650131.4076 659375.6026 349800.7043 1579603.047 654249.6832 713360.8064 615034.6153 717436.043 516405.7865 192051.6808 516026.3846 575833.9338 343337.8805 392487.1729 936323.4768 468624.3354 544634.5415 763784.7191 729548.6212 913921.4227 531603.5733 217460.5712 432892.4348 616564.2647 369924.3826 446248.6101 153163.6776 1442401.719 594545.3294 1002160.585 1147009.236 728105.4419 542456.8214 744924.028 948326.5573 437139.0434 1315601.099 354548.509 353881.3696 1035300.956 481058.2539 609530.9475 509066.6464 725398.7989 966830.245 443665.4268 720520.0211 713667.8984 655579.2613 417762.5495 633076.1974 864472.9787 622391.0211 1615433.968 654095.2635 423864.7385 571041.4017 574292.1385 251249.1756 610149.9775 474275.4815 404341.3642 347560.3132 420125.917 136585.8549 966847.5097 214283.2505 425651.2794 656252.3839 29131.31239 26515.25583 460711.4408 566304.3224 411833.9992 305972.2734 586302.0697 1056333.262 763108.815 383285.0201 445960.1611 755198.106 653428.9229 211321.9897 399300.8836 1233979.07 443794.1696 578809.0648 287317.0258 384076.9336 527408.9291 730097.3312 509227.3133 600551.5459 310366.443 945715.3821 361117.6105 335233.8205 561115.8799 382035.1465 738157.1819 292223.9588 373692.6742 518708.6462 607262.0774 688662.6228 465352.6713 423231.2742 732758.2868 270066.3329 2264634.962 543471.6841 441650.5996 481505.0947 254573.5789 792203.72 721386.997 1023676.924 487705.66 316600.919 925283.8656 1470613.764 396791.2 750018.7032 501030.3545 670314.1704 584695.5473 504481.1798 666317.6052 713125.8523 300189.5295 606868.9432 651871.5215 807830.5578 654290.4533 2747895.512 868591.1672 414183.23 402466.2108 398313.661 954131.1266 499801.4418 568259.6356 513690.837 725945.868 508866.5984 29645.78537 29917.48286 29354.63387 29805.06696 27342.21008 9-Decenoylcarnitine2 47367.3713 21469584.41 3253000.291 17204726.11 33587611.08 26487214.5 20712052.54 49806046.31 21159887.85 31265457.31 35492299.02 58239612.11 41100508.14 30175626.61 108227000.3 23241933.8 24379494.45 42050127.48 27806209.8 63472834 51976270.58 30581946 38492048.55 51311900.81 49418007.67 15554181.6 3193299.808 149706195.8 36887934.93 44206394.11 25047373.35 37938842.14 34924084.98 31706783.61 38325622.46 31327038.38 65910554.96 29349017.48 47934220.22 102825845.7 56152196.78 34761964.95 22459401.19 41113763.7 23395393.35 31550000.53 45126470.16 18657333.36 13566384.79 18404040.68 40361403.74 15847559.45 16988023.35 52539530.85 48459778.9 50041802.9 45356805.97 36720734.14 37658488.59 26725049.89 61512620.15 76402353.49 58474622.95 42716359.77 24848242.89 59683900.93 32080913.11 47680586.67 57288518.24 20321306.53 106686306.9 16349022.38 19094440.32 44219579.83 18284716.81 28713753.26 42044745.35 15934743.43 25129810 41165560.15 25346736.21 35436881.13 19380086.26 9519351.156 18263355.42 37549914.51 44464550.87 57285194.01 47903046.86 24987649.22 51990741.59 31005826 25166589.18 13703413.54 16387602.28 30329.34258 32810.49273 13160694.33 16424952.85 22672958.84 33865516.64 81397453.44 35615060.08 41229861.96 17882973.99 57084876.52 21912739.73 25495758.8 25674519.79 50481515.44 38285678.6 38574102.39 42865717.8 32466323.92 14048954.13 20179073.17 20796913.45 24413065.99 29505550.92 56145018.41 41900380.09 58717687.32 52129226.49 50599135.28 18034688.06 25860595.15 18629011.44 81635213.44 33451372.92 17554782.82 59293046.78 33108240.69 16607848.25 19230207.52 39502628.86 12330538.79 28139609.55 28119090.98 55353374.62 27125298.35 70847173.52 34212172.26 30413347.4 34505337.53 37450085.86 22529865.03 19000501.96 36359946.21 34721832.24 18036895.15 14969257.74 39289481.96 48589132.89 30018318.63 72049372.57 18048664.66 26615724.53 41474913.1 20162042.28 95529168.21 68671286.12 34341494.93 39087413.48 63998235 27398400.52 40736913.44 81539968.38 40565850.96 16747382.83 20383851.88 21675446.5 45944.60591 32483.20352 35077.71796 35794.79045 31639.04916 9-Decenoylcarnitine3 40618.28625 485869.9703 569184.174 401065.2619 271794.3156 38928.4365 41197.84341 129006.2149 99908.11076 69856.43247 970272.6086 35933.84232 34326.41053 171557.3044 75958.74695 87854.2163 148202.3673 398478.0443 36219.42585 34947.33619 153699.4239 985070.8942 1513628.891 68276.02914 480715.3922 479411.3767 442189.4556 39495.36933 34509.57048 152277.3297 695130.5843 1124561.266 693487.5897 85366.70037 31826.37094 44851.49752 34213.54721 40295.08222 38604.06586 225969.1263 384088.7921 32729.9024 76799.88837 30946.40104 48946.88814 38972.8557 1201263.31 341590.3498 577883.6038 445486.8221 40039.0638 31313.99984 40549.73544 996981.8628 34638.09471 435133.3595 248846.7148 312445.0083 43152.14693 523627.1698 253172.3758 167829.267 98753.06168 40958.80408 1338623.357 36993.26666 33359.07622 294003.1294 75226.37218 200182.1713 33851.50225 561963.858 474766.8473 37156.37535 77268.52606 757620.8783 42800.12979 36407.52021 41343.76247 60869.42557 36765.53618 105141.3743 34331.72575 38222.63718 39872.0389 44771.75197 222996.6875 295697.4554 34414.5248 38254.49689 30851.78648 37580.02505 40528.24895 521265.259 519362.858 30330.4542 34545.05875 500706.51 392060.263 39270.79635 75739.69538 32004.52367 437333.1665 35036.49669 49757.13572 136768.7375 70811.88189 123880.8575 36590.39562 35505.16589 101855.2322 488280.1698 66693.25537 38157.18961 1762785.347 637815.4368 457328.144 1459082.706 895070.2257 32993.30181 237468.1602 41050.62409 740220.668 778061.0352 96329.0164 285489.307 565268.4438 101023.4047 1400240.039 690453.1407 208165.1433 273574.9099 616105.2472 449104.5309 517942.1681 40767.52133 196046.3176 47406.32387 440015.6169 784190.0894 376747.4607 4148499.697 1130343.484 39229.1421 115307.8518 137816.3944 654474.3889 37575.46092 265896.2864 664175.4181 404228.8288 565423.996 811181.009 36436.13542 72371.05281 41277.25215 235163.1727 256044.5796 1427134.407 35323.49558 110887.7697 532979.5243 163759.3276 98885.65397 57373.15171 209494.8429 480732.3958 138902.3796 608862.8428 474683.8808 626777.9489 35993.27358 33980.30135 36759.7725 43552.06674 43312.2188 Abietinol 50837.11686 173447.9925 147743.7385 201021.4109 162105.0949 93301.57428 49434.17514 176104.9565 58688.58429 144690.8595 384985.2952 42499.99702 50020.75259 354163.8173 50720.71275 289997.7586 55300.68927 1017209.188 48049.80573 47729.04372 159061.1392 137917.3653 45185.089 38125.85543 92742.33344 131975.8999 195738.5498 41293.74429 45154.72291 148148.5576 407651.2196 46715.33861 44558.43247 44509.59571 46431.4476 42198.79811 100908.4729 42836.30148 45290.38788 44995.15873 61468.2409 23812.00287 38926.82732 39266.12904 53922.71752 125543.5963 189690.5625 69971.44309 153937.8369 201279.9272 18178.96654 346097.5119 36124.83917 40982.96957 37032.69039 216035.299 348148.0645 66794.88129 35944.90926 445299.06 114587.4894 42248.34833 173142.5364 89592.02106 222137.7543 207619.3723 44181.90483 281211.5859 43014.28793 51274.15014 46735.46058 170801.2649 204730.0489 43671.99284 39727.51288 1002466.981 56499.76964 72583.76898 109361.1189 48798.42518 95323.93262 77723.51197 39261.02964 47133.87194 52977.28995 43168.85063 63168.98202 476576.9574 48209.69603 42930.31176 48113.84363 81812.1901 40179.38524 171174.7464 229334.8983 42035.31564 41854.59762 164545.7707 175370.8454 51042.26957 46557.73596 41308.85339 138812.7519 117059.2436 577183.4845 138622.1888 116221.7428 343588.7918 43106.29455 44701.84053 150822.9995 45111.4008 46090.94655 44909.29091 40845.15614 144139.7341 252220.1417 42737.56613 100776.7374 35623.42203 40934.39641 201585.2514 69807.44951 57287.71675 50225.04789 44926.41507 360305.3078 161230.2898 628068.8477 641087.0755 62232.75094 45487.7568 188516.9935 242982.3494 68377.26538 1276646.348 123240.7364 119106.3315 107144.581 161557.8631 224626.7799 314531.5568 63590.32715 51899.73475 330373.2048 577565.4461 358092.9055 48178.93699 54186.12703 213124.7999 202292.374 72663.69931 51538.36344 44977.48904 126995.317 44832.74061 97368.25532 376526.132 148788.1148 836984.2823 70738.24656 362187.7859 159734.8542 97736.08009 105306.7103 76234.16587 44854.54355 29086.33312 178402.7101 248025.1179 159087.2702 42574.44399 40250.6737 58568.6606 47590.04928 43015.7199 Acetyl-L-carnitine 47785.08488 363007418 301095282.1 303685838.1 727485056.7 439985286.8 560066287.6 349494106.3 449598127.3 521612765.9 342107596.1 687605184.4 548410756.8 407085328.2 657441733.6 345993089.1 310287506.9 295136533.8 889342862.7 495867520.6 401805806.4 476601087.2 671644775.1 587904047.4 511699620.5 277483293.2 300734859.9 700411581.7 643499890.6 781241788.2 271259092.2 578690851.9 365292799.5 425840872.6 376816976.7 274504967.5 382420873.8 621501687.4 820433906.7 448908007.7 457007858.2 458355151.7 569901514.9 438643765.4 424607572.4 309913336.5 390364666.7 258784901.8 279433295.1 311874605.4 414733218.8 765720444.4 530369077 489106185.1 505651583.5 493081527.4 644118253.7 680451011 327931143.6 293969109.8 522686563.4 533721562.5 515114846.7 503780000 281481708.6 856029489.2 521780944.9 404508591.7 355562351.8 706182421.4 655912560.3 276373573.1 313495463.9 280232349.2 537531771.1 374037003.2 452319783.1 312002218.4 510981565.7 520430769 407835868.3 347377392 280152733.8 281587008.7 245748032.2 529661537.9 648517589.9 460297315.4 366200623.2 243659753.5 725247599.8 246635419.4 409324518 267134439.4 298483180.6 320283.4344 58169.35949 245037979.6 284291641.3 304299719.6 389064174 795705124.6 338561445.7 343564860.7 350747466.1 351704478.4 390724029 362464119.8 459787549.5 406896327.4 527654169.6 308532553 394450345.7 815678594.2 345373715.2 259970956.2 301707000.5 543732565.4 429359625.2 471522399.9 540104271.5 461680729 446631948.6 425475915.1 291268987.8 819947772.7 294268952.3 517603610 394478035.9 379649467 384560461.4 563095218.7 263607173.6 302480917.6 370199234.3 522732434.7 237644996.4 654320856.8 447323157.2 345204535.4 623376658.9 394511185.1 611822558.1 461635347.4 378016876.8 458847134.6 937435832.7 854321487.8 878979744.1 292865394.7 294631989.5 304721875.2 345730035 374649419.4 497876340.1 312393383.2 322832597.1 471263717.9 319302825.1 508170523.7 553217185.2 437204893 389138946.8 390394460.7 400865234.2 532315859.1 373016182.7 366485387.5 276655264.6 297016020.9 380232049.9 343233.9298 373357.328 354355.4402 195668.6179 349889.9617 Acetyl-β-methylcholine 52078.54615 27532763.25 22178273.53 25127167.43 30203212.74 39922542.15 36365854.42 32167395.29 55412655.22 25915036.65 74088143.55 27077072.62 40768214.92 19911864.88 32140623.75 31907154.88 59790273 81652042.93 30850422.55 41638486.88 27806970.69 49951230.89 36698703.23 40219750.63 45244929.89 21419071 23981049.43 27454655.52 28004165.47 49925880.37 33087965.6 71359571.07 49921885.77 51201888.08 34961127.47 19584006.42 44159907.31 45723499.53 31033690.42 48492221.86 67594800.9 35977335.23 39574888.35 30122355.71 44217481.45 24882047.23 27798444.03 34823681.14 23299384.8 25501690.07 30389846.88 38694964.57 26995431.53 28822288.52 39353445.13 91317496.76 51872748.36 26861564.18 33484538.04 46200965 27328383.41 39456377.44 18878380.6 50514059.3 37483661.22 33675875.58 38958694.34 92145000.12 26521366.65 48154819.31 45231951.68 22201858.37 26486157.06 30858487.81 37336126.76 24730467.37 25408467.61 50230309.76 46783601.96 58043856.41 41002010.7 41624849.59 50129017.17 38885844.68 32459668.92 38382453.43 24454643.74 20807332.33 35633445.62 28264657.46 27235953.8 62293754.97 38106069.17 21473372.27 25491276.84 178625.1847 158726.9713 18766989.39 24044867.69 43392546.79 19542190.75 24845769.16 17536988.91 28161494.88 37325368.97 46718484.35 35433979.12 81968632.52 29931902.6 21989447.99 32729511.41 36719844.15 39995513.57 40500470.99 17948687.79 19676048.04 23199711.12 49137487.31 19630141.9 61501770.15 56519879.26 31820804.12 28080420.3 35767816.55 51262062.3 31082663.06 39578052.01 28575340.33 72893525.7 24426308.44 37433674.9 27390950.1 20811477.63 25250566.87 46552264.37 38392890.98 19488976.37 28919291.84 36856622.39 45917224.46 28323000.14 21812197.95 25332476.81 43773231.38 60993290.45 40376694.71 22032919.49 40881026.28 26410048.89 22857778.09 24995065.96 25292599.06 43548818.18 20438999.14 61196205.99 22055402.59 41928792.99 22142719.19 50118345.6 29510251.3 29411490.05 38071371.94 44240025.03 31485488.99 30397435.55 33155916.17 22880108.72 40468492.13 21420154.92 24620723.96 30527160.82 270114.4928 293820.676 234314.6849 266246.5972 275352.5842 Acetylcadaverine 44118.29422 4091124.736 2551728.338 2430605.026 928864.3173 1937002.739 1981042.354 6721512.423 7313082.003 564296.57 4388191.506 440184.7727 9225582.695 9086050.847 1020577.844 3482305.473 167995.7289 4906493.366 2459716.739 583474.8825 17121695.3 829828.3189 230578.2028 72840.58419 1022941.633 2903938.936 3587904.675 5046023.124 2747674.362 375890.1334 61823.06737 168165.2493 328923.2769 6979953.957 1772635.454 3325898.261 2911899.083 1532442.607 374337.3802 4886403.852 783450.4649 832591.3268 10228377.85 264522.6048 1824776.062 5081305.876 543089.7249 3956253.859 2962470.93 3148552.63 2392791.033 12021258.24 779987.7682 1496831.779 3961105.41 1343678.919 578560.0667 996440.8756 1795886.384 2190341.478 5542955.22 998621.7802 285028.4194 6946752.342 761450.4924 3333097.757 282992.6761 6453403.704 117355.6451 4867189.37 1048652.592 2730233.358 3192315.874 1275552.683 1168777.249 1156379.763 1166571.628 437813.6893 3769459.328 5511592.16 3953956.222 2986412.011 1261610.168 5698314.869 8022183.287 3890252.095 3524998.478 909909.4455 5888805.561 14448204.89 2320079.498 900749.4832 239624.6326 3613813.623 2926368.762 36398.69685 62640.69769 2794268.278 2660430.555 298755.3159 6526653.831 843373.6957 10771027.77 4363417.964 123890.5568 7727074.608 1099205.956 326999.8824 590400.2168 356365.7337 4102739.455 6789346.268 879522.7215 3501738.378 119344.8843 3425590.318 3440202.904 566210.8166 266989.5505 1116665.343 391282.0729 99542.4596 749170.9082 451550.4034 3764886.599 407017.6884 333338.3577 250463.3453 827440.7538 3008326.855 288029.0958 308850.9571 3304110.178 3613793.803 4990477.98 15368730.86 3105108.15 537552.1987 454621.1869 1080494.257 7042216.517 5828909.616 425295.9217 5176442.279 1008683.149 2253010.007 17159492.94 1678681.995 74982.20206 3462284.22 3576483.344 176657.3272 3809134.107 1087830.005 1289488.868 865517.0219 8724288.378 2210299.457 756802.5048 10957879.81 1547317.029 2953943.221 7068915.995 2704596.214 298126.7691 126797.3738 3349241.972 3737624.199 3530174.449 3515185.642 5095968.595 34018.68831 40951.98467 37640.76323 35817.87365 40902.61366 Asperophiobolin D 79322.87183 43248373.13 74806865.31 75248216.79 10011151.53 16707564.81 6524365.102 69531509.22 7757352.685 10024356.35 20655390.09 10657009.24 7148097.856 20005386.47 10083727.71 16710983 50545890.48 15187251.09 25002331.5 14057907.82 19834952.18 87710316.29 37126706.48 27438321.16 13074887.6 67403601.13 75798859.05 11925562.4 18186091.98 11284872.16 16695646.22 4476362.227 29760340.43 236177840.5 9476222.342 18700945.17 29636462.71 11073601.71 2961843.052 18045716.91 6805680.699 78404076.4 7057144.896 48577220.73 20036875.94 20938992.62 18674897.15 14606722.64 70485513.16 82833523.08 40641186.43 68626262.34 13378453.89 59401103.85 30845936.43 20339975.23 17791522.57 10244460.44 79158592.26 18813528.95 4446814.148 14701886 58083511.89 11530277.43 115275794 25389405.58 8454389.545 61536027.63 10249086.91 18151089.73 30195528.04 71928390.02 81796610.92 22476102.66 10727022.14 169461538.1 25551243.85 29553498.86 30524252.68 290421520.4 97645922.02 11573741.83 4193087.259 31405304.36 41087558.69 30309137.02 10762332.38 40710105.48 33370924.15 40243333.72 83840219.69 61158982.52 5079648.175 64602665.89 78994723 52237.20828 46298.12774 63536111.18 69353130.78 5811823.818 4293781.22 4736004.239 10080914.15 31869424.9 3852414.125 92242473.22 2366927.729 4297057.724 6927477.02 15882269.58 39028972.8 13029890.65 164441275.4 57792375.55 2047626.097 78892198.42 86812561.95 53614002.42 8945247.622 2675101.343 7862736.592 12220469.98 15307353.1 110220916.7 7129304.69 3484145.446 18724427.84 28684314.94 5624658.909 5580642.791 11417584.02 1191660.496 67649327.92 81672639.74 3900042.297 56374936.24 6793670.223 5663768.203 23994984.5 42920696.5 42395151.06 19125549.13 7291667.369 90226135.31 24545773.61 13251527.02 19847496.81 18637275.17 771319.1975 77052496.35 72854027.06 54708952.74 7152349.063 7480716.576 52025950.59 41733204.02 50416846.88 8468798.792 50238278.31 148261963.3 8461106.012 31950251.13 4140485.314 8807946.404 28625250.11 4443364.214 16793827.41 23469249.63 75496915.28 84378280.95 44928664.12 49445.90076 54712.18366 44543.78727 51301.27312 39860.92581 Asperorydine L 52353.86805 8219251.375 230800.2579 194067.6472 5496521.965 6105469.622 11361791.95 31211111.01 9449283.962 6280811.504 9364177.203 12794739.26 13919065.23 2423167.212 15280239.01 9699958.231 7990769.161 4473901.834 5590130.792 10892784.96 6675151.646 8951242.765 6577304.689 8308114.826 7824866.266 251223.5519 234409.3147 7690786.708 8754748.965 3089636.568 15195017.63 10561170.91 6105834.675 5672607.394 7767456.57 9372402.726 6607835.499 5065362.346 11725699.88 6492051.333 9500754.93 5599513.71 6473038.508 6130795.94 6283957.671 3077821.451 6982656.296 7646173.34 267851.2971 275068.3816 5724823.351 14605035.17 10286690.94 8200102.165 7164879.251 10035193.36 10951734.85 21080603.85 7575122.59 5250257.475 13955918.66 20242213.32 13503331.44 7256641.047 6329762.127 12758972.47 8726962.228 18857789.08 6656483.231 12045454.77 2960299.393 193081.2098 184278.759 5937466.916 9127982.332 5825969.788 5357265.845 5462300.627 16255145.62 8731468.389 8400806.849 7233554.68 5722220.147 3293382.71 7122440.681 6007093.523 7093886.334 7801467.914 6126786.387 6424663.25 8287676.18 13907779.37 13048174.01 193700.7473 222191.0536 42715.87279 50306.97352 241937.4226 251018.8481 8632576.877 10778193.98 10727225.53 7376293.963 9326179.419 11910409.61 9364907.389 7672251.818 5525375.242 8467229.75 6921629.969 7012026.617 6420722.463 8856496.919 7157180.297 7265428.778 276939.7386 243616.4809 6450885.372 6104598.464 6276728.668 8779700.429 10527248.51 7441203.655 9899376.75 4167650.044 5513188.593 10075626.01 13614711.36 10568273.58 5943377.765 2658676.045 4282386.391 262508.3529 247643.0119 6885770.02 11804098.77 6993963.406 6605073.949 7626851.482 5383179.084 6002505.496 4864645.16 10535281.93 8014705.375 10420335.96 8612381.96 7542541.078 7354338.198 7325690.94 242999.2835 193142.2798 9688196.072 15568623.59 4625375.155 8583255.663 8534895.819 8475803.131 8166538.682 8806961.305 11208397.27 2554574.18 12281856.05 4275169.232 9766650.12 7023073.74 15405682.52 7157370.418 9196357.491 289033.186 266121.8291 8185790.812 40169.57935 40347.23284 41157.66361 41649.28457 41221.61016 Azanthromicin A 48931.58541 2399109.782 1781607.996 1482822.67 367982.5183 68528.69738 711569.356 842101.171 1055427.013 2213291.106 2460707.076 534934.7109 575893.0257 4532594.737 318490.1608 2989226.738 619080.2494 4075206.322 688196.8551 48784.60294 3923225.88 14340457.05 2135399.576 382070.0688 770621.9332 1438026.335 1476255.552 871795.3886 56765.44018 1979680.367 10187303.95 3729394.224 5011274.859 358460.3354 58887.09923 1019546.432 487272.9454 62145.35659 48803.04547 2248041.178 6376258.085 95650.37795 884029.1551 53317.76517 84476.73665 905905.9914 2819816.718 1363751.982 1469351.624 1483632.287 1243523.15 1874784.669 1146642.987 4553507.694 130740.7887 890882.6047 557124.023 851673.3552 319690.8051 4600600.68 2273521.139 1779052.487 638508.1372 87140.52701 8523003.851 603794.5883 159194.0142 1427787.045 540747.7244 347375.3811 55170.07078 1290495.125 1286146.606 101636.5251 979175.4014 5603672.728 55740.48022 276575.2374 246895.34 98782.73918 52493.8648 2758145.746 834104.4489 67004.97278 668709.3381 338399.9598 930965.1811 2629506.454 323025.1583 134408.5522 61560.89664 1203619.791 46212.54853 1117455.453 1152953.283 49962.877 42056.0512 1424029.488 1282242.652 95864.1868 883173.3016 476282.6914 3505131.768 365583.7774 824325.3298 1172990.988 990235.5164 861055.7679 87813.67051 470060.6715 1412278.886 3940845.36 1514515.79 60804.38794 4816596.517 1901389.786 1715249.377 2125316.295 1563990.039 114092.8521 557913.6893 1137493.606 2743734.513 1173310.826 2112992.219 5244583.707 1384719.355 948793.0928 3511178.583 2625152.717 2503304.817 1402084.714 1751324.031 1594167.48 3179116.062 3186862.951 4850161.493 397953.6977 2554162.091 8461713.017 4342336.404 9915383.569 2355549.635 756338.4301 2264964.785 390977.8681 1202458.088 189856.7813 1576399.051 1723629.255 1224817.091 3230672.434 1529396.768 318700.3214 657437.5583 261078.1625 4779998.687 2212126.613 9412574.879 258148.8239 999826.4425 3877970.405 1956631.678 1231321.629 3246403.444 631162.7367 310263.368 1223008.458 1702516.072 1407071.966 2167614.811 49968.77645 52201.71598 47572.40121 38647.34039 42888.85204 Bacillamidin A 36108.53275 266452.3411 33988.11814 44124.79627 493189.3925 530980.0323 266997.11 886375.1509 379011.8347 315970.5968 446909.1012 598802.984 465327.3785 494899.4274 994955.1106 300476.5758 285043.9954 688271.0122 393278.0291 534090.9099 452009.5955 466120.2247 595279.4313 625320.4729 964030.2883 60513.96726 156570.9517 700689.5334 593081.677 505374.1168 433264.7028 486333.2919 630609.3739 518172.5205 482928.3643 223153.2773 391920.5202 418655.3254 914085.6273 692144.7953 716701.2142 633674.693 457585.5064 658128.1633 315220.0851 467236.863 672469.201 339381.674 129249.2112 53980.94216 434371.6352 244614.639 482965.1203 637637.2453 586803.4522 1158078.096 1229346.367 448693.0775 452997.6074 292965.3705 923129.7641 751397.0484 787473.7617 488901.8101 395158.1916 721434.2182 562140.74 561506.6357 782420.838 425519.4763 986145.9272 107643.469 125603.9027 516683.7744 548669.8451 519578.8943 789262.8192 591155.5277 332836.0301 734975.9199 256711.4763 536620.5651 419196.916 239974.218 1000780.332 328135.1594 774687.5898 467666.0454 546204.1789 634769.7565 520438.4599 629989.5292 508163.8235 34426.26933 39767.8491 26361.58208 61738.52686 53159.31206 148433.2499 665844.9224 543058.5401 1549571.936 970782.6119 523999.7069 338454.3478 466489.6562 376928.7056 649467.9827 653062.0205 615546.2384 627724.68 933733.1741 502068.7889 802365.8119 333765.1948 91144.28857 64211.75369 533393.765 668906.2218 738404.7722 666890.5705 721942.3176 683676.8803 413317.0309 317547.4159 783099.2471 611617.8446 514269.7385 720348.8385 376427.2659 689297.3122 619646.141 99015.79465 125032.717 833577.7727 299480.8954 491280.0009 269319.8841 771341.029 549744.8173 562228.3865 916450.7791 445232.1785 673915.7827 515822.2506 629048.9481 266216.4415 900163.4773 616662.214 117439.3172 169163.9191 714159.4505 613548.2476 649687.1291 716820.1069 599641.0281 478871.1613 1113357.706 534593.1071 705322.8067 499316.3786 981077.6041 621669.2702 733878.4167 308634.9678 640589.2791 978278.9024 620586.9755 46720.66445 75406.43129 547927.42 44575.18325 54201.17721 163748.3689 55578.62408 54563.05302 Bilirubin1 56930.71373 3085975.719 178101.9782 69485.87977 25134755.24 2538934.227 3486653.244 3820327.911 11131168.62 2795509.054 4098949.59 2898879.963 2961464.14 13326777.14 10356739.07 7407699.723 3384911.822 4255364.591 4709182.061 7186348.098 7847365.878 11356554.06 8101122.925 3509777.786 10711353.07 64198.81492 75432.45913 6566391.877 19066301.32 5990802.209 4794090.858 6886479.576 8733584.992 8355491.349 8685537.227 8769797.256 5384523.966 4724972.523 15922352.4 4264026.718 4463289.521 21081883.26 22416331.86 11490962.45 7504424.403 8365651.458 9822736.304 21447771.76 58164.09422 76637.76544 7537975.952 7548146.465 6526539.465 6824894.412 8606051.139 13425728.09 8608795.97 3304265.441 11157726.06 3979730.092 6007751.954 9619572.202 3256642.464 3220296.018 6475760.341 7202432.017 9780863.695 4995042.261 10612769.73 10743348.65 7340874.388 61582.88431 65708.25641 9649319.048 7214774.097 7658175.163 8995446.276 5445046.796 5654719.93 35280033.32 4992163.202 21541101.62 5430894.661 7390518.237 12202390.26 10586031.6 14191111.89 3449513.662 15997423.9 10302137.97 14639308.36 11041435.33 9234360.683 87115.99462 54427.4323 58130.5965 48592.7941 134829.7812 58541.89299 14385926.15 8890480.991 22189987.9 7696272.132 8998990.628 9208858.272 35572053.24 12321691.47 10538924.34 15665203.42 9122422.599 12724237.33 14459148.49 15409345.86 13168587.56 10942107.68 562307.7863 301756.9533 1880834.487 24952913.33 9151373.575 7836996.831 9564274.856 7673194.58 17185102.07 12438249.97 17285507.14 6441350.684 9069452.81 22474911.93 10191659.21 10789109.34 11037806.39 86011.85205 77691.69348 23105339.81 13763048.46 18065975.64 8141605.139 14508771.77 8248843.375 14411364.75 26374551.72 10852288.55 12896613.84 8858033.28 13193693.56 16236133.81 10032384.55 8969663.763 69627.58475 68355.44515 15949151.48 6669293.495 24013034.67 12707573.63 9187221.648 10086923.09 11257063.39 8015235.61 12592433.67 15948602.86 14393672.63 28870346.47 6998158.94 5956606.959 11283844.58 11688183.24 10953159.48 144299.2047 66120.17185 8722989.625 58137.46037 60735.4314 55349.33586 45043.11513 49900.13991 Bilirubin2 30250.72756 62385546.43 16472380.94 8829077.985 115298567.9 64567269.08 47349482.81 63035150.7 44099439.86 37556397.63 26327304.71 70022342.76 20247163.57 39391537.19 85066333.91 54167676.68 37984172.56 34296217.51 79024322.72 40064765.98 25792411.4 57442904.82 43474747.12 74766313.13 65740783.21 18661768.96 10509264.03 35008463.72 158307570.3 110542336.7 36302198 47180091.43 51021533.68 57167198.85 31546844.35 100583886.9 22288427.8 59206192.18 189015051.6 16799793.25 25497490.84 101741561.2 287640594.5 70116652.81 57988338.35 32995512.3 78396177.96 129465888.4 21863493.54 12157545.16 27273250.5 73612508.02 100914661.5 83499953.79 83547549.46 91228259.99 61580622.51 36650167.29 90937485.47 28575444.68 58081721.61 148233995.9 65750833.92 48763168.17 25027190.55 107239880.8 96940993.81 32683152.45 78121077.61 114876373.1 84350327.02 20697161.61 11869815.63 68698525.51 85298501.25 21539117.01 85096928.02 51560741.85 53575805.5 115970417.5 50377006.86 61462560.35 40272544.93 82817097.26 65402236.28 104992823.4 86015574.63 26206846.97 53191042.56 75026822.68 180569895 33080466.45 65888021.29 20979018.43 11552061.31 36348.72059 26523.59343 16799061.91 10349288.29 10609065.74 12491161.53 25742322.33 10135732.76 13934247.81 7584581.235 52049786.32 20251699.62 17022738.45 16847614.71 14840502.86 29898150.15 8595583.312 30880197.22 24668263.79 9477181.824 12990047.51 8579042.724 2249637.342 15790765.13 11406985.8 8552525.512 14699495.53 11947913.2 28943899.85 24388969.36 12163291 9122815.357 20880801.72 17750030.29 6062128.022 18917704.43 14830396.22 19304861.52 11618628.28 8382351.268 10314777.32 8162373.8 17892058.61 18699211.19 7264170.816 11977380.79 18263079.91 8595614.798 32517817.51 9574346.274 39255868.04 17656363.35 11071571.57 17673113.83 23173551.67 11090310.03 18127594.13 19654719.32 33520932.97 15422556.85 7139298.334 14090313.75 7321340.854 4564938.635 22469682.07 35490379.53 15434980.24 35635559.2 8786759.145 9454807.949 29627027.11 14218973.82 21801338.8 14350562.76 8993462.502 22479658.24 35528.101 34634.21849 31725.84549 32902.23212 37201.87147 Bilirubin3 33770.96000 32336065.00000 7064761.00000 3379151.00000 53842074.00000 34195503.00000 26056230.00000 30731530.00000 22350542.00000 21317185.00000 13135954.00000 37837123.00000 9890704.00000 18114763.00000 40694525.00000 26056199.00000 19008489.00000 16864548.00000 42146078.00000 19686994.00000 12854785.00000 28259867.00000 20481181.00000 37776252.00000 31682611.00000 4462575.00000 2378053.00000 16932727.00000 76009675.00000 57746776.00000 17731029.00000 26379490.00000 25953845.00000 27880239.00000 14410853.00000 52017008.00000 11150521.00000 29976774.00000 89819318.00000 8079917.00000 11692198.00000 50145205.00000 163000000.00000 34704551.00000 27900656.00000 15231465.00000 38333676.00000 63070236.00000 3223682.00000 1661194.00000 11304738.00000 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4834101.00000 3813941.00000 6602808.00000 4109099.00000 13324930.00000 11858712.00000 5730602.00000 4006566.00000 9932678.00000 8295817.00000 2726226.00000 8667298.00000 6629944.00000 3290572.00000 1631288.00000 4217388.00000 5389075.00000 3517091.00000 7097019.00000 8810514.00000 3562066.00000 5335068.00000 8291567.00000 4003436.00000 15230974.00000 4308352.00000 18052885.00000 7845809.00000 4753256.00000 8094167.00000 3032992.00000 1401254.00000 8577998.00000 7933630.00000 14624849.00000 6731581.00000 2958320.00000 6155482.00000 3224220.00000 2018574.00000 9740073.00000 14785472.00000 6598949.00000 14385339.00000 3692449.00000 4129241.00000 12692573.00000 6408178.00000 9536959.00000 1803049.00000 780609.80000 10004724.00000 26577.16000 27204.88000 30265.44000 22884.30000 27341.93000 Butyryl-L-carnitine 107185.1173 37634945.62 34422924.67 36882724.97 35344145.67 47990292.2 33537298.84 259051109.1 53383676.06 12354744.5 97893359.23 41738167.9 47645224.24 110443958 64899097.09 38059022.77 68680515.85 170790837 40064659.8 35654776.95 76499590.44 43954135.65 59892400.88 71598545.87 50037784.51 37326610.57 43270393.92 40196660.84 59451471.02 100084003 126504673.5 54881249.2 87574996.45 45141107.87 47863124.27 40503183.44 38242103.94 63300621.17 56067401.87 35712372.72 72032866.33 42793946.79 36559489.22 67268802.75 53553101.34 95243016.33 29727917.73 14695126.89 42250236.31 42385266.95 27514699.15 28066450.08 30596143.2 87160922.09 31236187.78 87943872.65 93021830.54 92718706.09 69990948.55 64851579.25 90143018.82 134693949.1 62046420.59 44150503.74 37122036.48 48327939.81 24232567.67 58951507.04 51511493.38 56837870.57 75666820.16 35404741.24 50263783.21 61462343.54 41268934.78 25197698.99 29995420.36 32870436.1 69764287.31 25323431.75 52758088.77 37006568.04 37695681.37 50892005.76 21885580.94 45810001.7 45937360.77 39037101.64 28439748.33 18792705.73 75248396.61 58496450.38 16980655.96 38195101.12 40203709.27 116814.6975 39490.27716 32988422.99 37573456.95 54492020 28948323.12 54871877.63 36364743.61 67236280.32 37503626.82 33745062.89 38255090.02 69962663.32 19579891.49 50927670.17 52406260.27 40768725.81 48052446.64 35120210.61 48755076.59 37348565.6 40297210.55 68855971.88 41171922.04 63895722.68 55346484.48 44062547.18 30616473.65 42009320.13 43602449.97 36180428.77 26513865.87 33051671.75 250202578.2 31350094.58 62973435.23 40754144.19 38099659.79 42003939.58 71921501.6 38034737.13 40343461.67 23677189.07 36635091.1 38041299.81 53509936.19 43564561.9 57373725.61 35399148.38 112922272.2 41188277.22 32573828.61 56808644.05 39392566.81 41369646.16 41110979.63 50075021.4 40212315.2 46823350.03 86666549.05 44967569.28 41974647 98770896.7 77225288.93 41328828.59 79256407.91 32018791.39 43315719.55 40522793.16 38815620.1 36203085.26 27461609.4 40526000.79 44658440.49 46932854.27 51170386.88 40850.13422 74913.065 135249.7635 65817.82531 103438.8845 C16 Sphingosine-1-phosphate 54413.77216 1082060.114 3115008.419 2569912.366 2324246.291 2132546.688 836095.0046 3387046.813 2307530.549 1450707.245 1503849.94 1405683.705 2658377.715 875085.337 1412259.436 1185525.681 1841320.651 3661502.096 1011543.091 1460057.309 1245685.359 1561197.226 2517814.394 2741235.512 1790631.2 3024838.329 3206807.412 1803662.292 967102.2331 1563995.813 2497254.929 1528193.461 1323273.273 2638696.007 2281081.093 2226439.869 1953328.309 2168233.257 1757284.484 2074825.75 1881189.467 938887.2119 929595.3382 1667062.159 816512.2977 1753018.034 1638826.807 1438333.884 2964284.737 2865984.736 2614479.639 1047816.429 1303022.93 2406980.647 1110339.107 2741941.138 3136282.063 1983031.037 1239374.841 1561334.108 2092380.471 2409625.305 2755723.883 1718340.474 2314436.536 1555055.863 1407274.131 2599367.802 2753638.95 1889572.608 1633962.086 2983346.177 3005880.914 2109169.719 1878615.863 1234777.14 1974237.507 2302642.597 952136.249 2660434.913 1211102.664 1266219.455 1339884.888 2665550.274 2817031.245 1439726.549 1378665.41 1988530.86 1287692.827 923830.6427 1400712.913 1272512.357 960644.4297 2889638.865 3012578.294 54449.77364 43228.08764 3039224.287 2295396.477 2609315.582 1597294.878 2066333.653 722426.0851 996764.097 2231274.461 1899506.311 746738.8985 2930090.794 1250792.247 1308471.538 1315251.704 1574226.242 2076416.247 1665927.053 5538900.585 2692201.778 3028529.349 2061183.495 1732631.346 1142352.765 1828228.283 2018492.504 1478715.628 1577596.415 1608440.444 1517375.084 1702957.463 1872040.86 2830411.027 883440.3884 1610216.516 1321008.984 2904014.097 3014323.994 1603647.576 2664625.397 1502691.672 1540031.076 2385434.999 1626748.973 1308399.887 823292.6062 1241506.315 1345585.084 2143078.232 710247.4306 681393.7424 2380661.447 2268354.101 3572018.223 2580455.465 1773467.739 1866361.047 1249566.262 1946257.835 1146538.828 2984827.476 1567802.422 1947139.797 1819535.788 1458189.336 2347076.777 1312023.294 3028119.528 2254375.306 2781957.889 1178164.049 1230610.75 3333197.748 3322719.612 1424160.566 54731.57027 87033.78847 67668.9734 50365.62274 52152.17565 Caffeine 2318954.794 150376015.5 191390321.8 242105039 4548948.623 238661180.3 39999033.36 590404915.2 4149273.348 32979926.96 211644063.4 145425687 41238665.64 2079091.066 5935762.728 233231148.7 66613920.58 188911361 4294336.334 255682674.5 7550218.248 200969123.6 99956744.2 24007284.57 63068308.56 184782398 238529758.1 2719554.151 33457621.28 26428941.5 27750679.38 3599740.008 480271423.3 79366306.37 593288365.9 53884109.19 117607274.7 43674363.2 40255242.66 195453979.2 14878612 35777689.09 12109707.02 42545436.76 5332804.798 447760.42 229780.1643 33185234.9 209142022.9 272623014 142707330.8 578281219.5 39020765.15 25257570.74 1197825.362 16615412.34 1427491.833 134011967.7 4611067.623 33808069.09 23807077.31 346721.0295 50053770.39 2360704.053 6744498.095 9558716.002 6947820.748 422268535.4 143677555.9 9451930.055 133873705.9 215581449.9 292544850 7885296.524 2745822.951 378184459.3 61010855.86 249473218.4 174385996.9 19871193.88 606334543.8 13212922.62 75043897.72 119425938.2 91882341.22 25769444.04 7102887.384 497930085.2 235056682.1 9489802.284 74372901.61 42025777.77 5339135.475 192207749.7 281311372.3 1888853.842 286034.7898 193065703.7 278085297.8 118881116.3 1119365.551 171740.7426 31492765.48 4098819.393 136379683.1 662290.3044 139120793.4 23370390.24 16733445.91 232419659.2 94297414.6 471093943.3 18858284.5 11543406.15 8267650.229 244741340.8 310107239.1 559233885 46115628.6 2621842.299 2772332.939 49983772.57 364893394.1 22885662.96 110367321.6 141960148 67926199.03 354935963.6 131571303 1383686.264 73194564.28 76853361.13 219372992.5 285477282.4 2758049.105 367067.9355 94536877.73 43325391.64 61281297.24 229752165.8 15731497.35 688487.8068 121853722.8 803421264.4 62472956.61 161683861.4 662038.2922 1584661640 18569216.93 237192342.2 258497086 33985994.2 189436790.8 59315730.96 371634451.6 215106199.9 16052701.48 108626832.1 12420114.23 2761878.877 28989233.53 454998643.4 368225223.9 93352985.83 290376410.7 15041801.85 1428858.953 67814608.4 228375317.8 294142060.9 163247294.6 1882422.948 429412.3814 80372.28176 339546.2514 83953.81259 Caryophyllose 33272.95317 96622.48597 107071.1509 108433.6138 1949965.37 1494764.588 6114241.929 1826692.6 1681851.769 1326620.188 1585047.68 582164.5264 1999364.838 2489214.165 1670906.856 2119747.216 2573966.213 137389.3816 1115678.045 2155592.66 1464137.193 112354.9404 3495094.716 2836162.57 2387634.539 123678.3408 113816.5149 1469548.493 2147567.654 1247203.038 2292535.24 1957850.919 2266543.987 1883205.033 1532381.347 2235983.028 2008899.235 1576255.476 2272455.961 2875094.671 1682035.153 1681134.413 1386746.382 1403689.182 1178694.877 1247311.018 1516311.78 1057349.499 123772.7836 605717.5015 2610010.785 1980204.992 1566575.024 125952.3888 1444980.424 3024097.836 2293611.588 5195608.088 1349261.487 2258299.834 1316894.4 1152881.208 1599707.315 2147497.371 1248588.069 1697282.889 1193946.552 2054903.217 1541539.256 1262855.092 1171682.818 141776.9851 129211.6917 1505847.174 109250.2772 1177869.671 1344851.547 158629.2994 1149074.588 2328305.797 2268572.664 1213546.127 5513998.216 937420.5709 1406514.077 1417272.448 1781022.591 2102110.211 1195803.296 1460879.998 3962830.629 1599099.113 945302.037 116342.4336 121301.3434 34932.20815 38017.4389 128944.123 115295.9529 2015342.134 121692.5847 124692.153 1557290.999 1042911.296 1604924.866 1871370.112 1617212.862 1607235.549 101025.0143 3226992.955 1658207.887 126293.7985 2484542.753 70120.95991 129718.1297 117575.0292 125319.3693 2222537.72 136299.3005 2617652.451 127676.7528 2102724.251 131609.6749 1231159.605 1608260.029 117136.2816 202782.8166 2971612.083 2852334.632 133671.8809 1489414.366 1699508.39 129644.792 119097.0377 134439.9455 164963.297 139480.9491 3691715.319 2470954.795 155917.5453 115446.3188 3593793.628 135738.324 1447558.133 1487395.985 1412660.787 1335974.45 2577634.838 3548088.833 138879.1397 134129.9208 3186373.454 1302060.872 1321634.664 1686880.174 157134.6637 650174.5864 160347.7943 176823.6385 2117315.453 1261938.858 3783780.626 1722101.229 2086825.908 1965352.818 2203732.81 122109.692 1344815.639 125846.9377 148862.734 118386.9924 31933.28084 36960.05993 36171.89656 36203.12293 36279.14906 Chenodeoxyglycocholate 62041.38162 2651473.614 3139580.597 2474784.407 2538591.759 497352.1033 16920832.88 11261478.48 897551.2947 8775168.11 2472205.157 234750.1134 118467.2999 2966134.87 2265817.758 1129518.424 1986742.711 3705612.254 6766231.509 2529447.951 961611.1873 2481102.776 1285685.907 2261855.091 971317.4501 3097122.209 2328572.627 17305897.63 447556.81 2818604.67 803006.9701 94945.59783 926690.917 3594343.405 443372.2382 1358595.987 1744341.936 1560563.369 8079783.126 1186314.204 9291323.536 14536383.6 1745886.09 8283929.633 2181082.713 1149462.483 2443669.315 1350167.914 3201629.176 2500136.145 1155849.064 1195794.058 871194.8657 630651.1902 3017780.201 1323493.559 1101216.048 5606497.552 2299073.685 413110.1475 476817.6927 1065932.345 3186614.887 880724.9201 1807295.109 809970.8509 584128.4281 2886206.247 438381.2259 1646417.639 7087768.159 3132692.583 3190808.987 1251249.365 25387579.67 4083087.788 3479904.578 657437.4997 806869.8619 6628831.374 5133016.278 2738373.591 269580.3234 346484.8696 7107065.124 1504260.811 32884701.34 3967940.415 1227696.041 1140701.364 5691010.847 1635324.926 2089268.872 3156284.26 2558960.001 39329.21464 43090.46004 2557099.302 2655507.829 2499475.098 822392.7414 607986.5813 530422.5166 35368687.18 314150.9152 3647292.477 231450.981 580005.8392 729379.5757 2108077.308 2185117.275 1159787.878 5005874.402 857399.0565 946467.59 3557682.495 3211251.449 1209154.455 941656.5957 225917.009 1809121.727 3274747.574 3313105.503 88684328.29 357360.8007 693190.377 1079739.707 4587612.06 274788.6062 120819.0833 522599.9499 238651.2019 3092571.975 2854753.724 1203470.752 6210594.193 271144.6415 8626342.709 992106.3956 673244.4881 3662198.891 1073137.76 1448346.781 1166028.027 1996087.253 1171971.167 1730960.293 1641288.747 965929.6747 3655143.931 2795949.318 2795936.953 440332.3712 628779.6885 1813483.71 1419935.214 1954799.836 748019.99 2422242.501 16469174.5 716615.5049 981239.5304 1193373.236 239167.6915 4411530.647 19324361.06 1892143.28 183485.9151 3543632.153 3299213.966 2717914.723 40984.56648 47527.58021 38785.5786 51907.30289 37724.84044 Cholinephosphate 85075.50236 24610910.51 48754318.09 47984620.15 21306520.54 16116124.3 23243769.21 18446481.99 16783917.18 19928651.33 21133258.09 16626358.79 16503386.1 16948488.53 19752097.3 18157998.26 15402496.28 16347774.79 12769830.22 18424062.42 15178373.54 13501468.39 16302407.26 13685866.2 19921653.75 44141378.59 50395141.82 15644335.46 12802338.27 12999172.29 19216232.02 17192100.07 17241423.45 10688778.56 8993458.205 15866240.96 17421535.02 9229739.337 12742249.66 11395591.05 13932535.12 14098249.35 14430997.83 10019311.51 15801565.55 22485214.54 11583681.72 16578051.56 47122607.17 52314926.79 14498412.63 18919358.59 11895939.19 15797949.04 17817179.49 15045793.15 14141004.16 17850529.01 20248965.37 20972524.2 18702376.53 11995976.4 12661895 12730587.6 8608496.075 26024100.38 12949875.08 12908513.76 14090851.02 14777816.26 14675388.06 46679231.69 52366703.2 12152399.45 9457593.076 11817786.45 10782899.06 12346874.7 13161179.99 19609260.53 11500937.93 13081165.4 14673160.21 11653964.01 14259257.74 18082952.7 8825501.52 14851691.37 12902568.13 18625168.61 13197753.78 19748648.82 11944699.7 44006039.91 50226180.85 661774.0696 626393.0697 43957863.05 46324135.34 17603396.48 21845820.68 22623413.1 22555846.84 16160778.14 8998000.03 15612116.09 15699343.69 14638216.85 9282016.933 13053142.83 16388917.82 15191746.2 12572228.62 11188397.86 19427246.37 51939930.41 53042313.25 13324713.99 18668791.73 13126703.74 21194924.05 11796041.26 8230072.47 17082851.22 17858608.75 24559513.4 13322655.72 15860182.6 18725616.81 15057018.85 15557420.46 6709799.362 46499190.51 75418407.07 18525998.18 33650962.05 20114372.18 17220487.67 16098326.38 18083378.72 10256784.45 16969059.91 17411015.81 17239142.04 9678574.856 17939270.35 20968293 13942206.11 13502184.31 47206223.11 43947681.97 18178640.9 24082103.23 10988458.14 9243604.63 13990851.15 12322944.81 19981444.17 17658379.2 20957646.05 18502196.03 23341017.99 12899598.82 10152632.08 11188699.67 19959981.48 13834256.75 15450360.39 52497784.81 55378024.75 22535413.73 329089.5719 123440.5738 440579.1361 327501.7408 122769.5159 CJ-16,169_1 47756.02615 8325074.498 7895644.353 6653631.918 409233.1709 1541494.596 3601742.226 10798051.1 5997570.601 19817474.57 14944773.44 17085246.13 8265594.638 26429409.49 1895671.036 25763576.71 3569155.606 43443989.06 6271817.141 424172.3358 59813288.78 89672168.87 15996080.97 5698778.911 4422866.189 7515902.282 7351580.369 9980202.843 709513.1327 30087122.51 97294195.7 12922127.07 35705431.47 3664521.966 2781430.144 15150676.33 6199238.236 703159.999 1853354.562 27862642.79 40566325.4 605386.3291 6421177.694 1152991.91 706636.0512 13934688.62 24170638.77 9391416.522 7374253.703 7008030.551 14081212.06 18709626.64 11894685.09 25610882.84 2112614.288 6324997.829 5124804.084 5439392.292 1351557.972 23388435.74 13304938.03 16302976.51 10383048.25 1539260.916 53822122.81 7342975.565 2117680.683 21440352.66 5062924.057 5081060.21 555352.3017 7508860.882 7632814.957 672603.8683 6412707.997 40960486.71 888118.4834 2923895.968 6732912.707 791744.6642 402381.8393 29660579.79 8035415.124 2101029.486 9442144.536 1705513.859 5287629.027 61134313.82 3607344.731 945620.3766 1921422.272 5084577.095 166283.3574 5930664.511 7192273.747 42937.65278 53716.35161 6990642.501 8015995.416 2027075.446 5761469.733 7868897.354 10883921.09 1960145.657 30735640.13 7242535.99 7958943.58 5829378.034 1627478.133 7304721.562 13863558.92 27163963.86 13673642.63 446653.129 18899503.47 9047529.217 8193985.575 14028308.81 6046772.176 1580284.869 2817918.569 14145902.83 33469119.38 7223098.745 20293354.24 26963682.1 7922255.605 6781153.033 21782027.96 11165769.46 20749528.81 12734474.84 6863364.71 6609481.759 7684629.255 8519928.247 23597950.91 3965227.266 15420960.37 35477708.35 24408019.86 32247106.35 11735100.63 5019842.559 36092423.46 1216704.568 3963977.89 2409429.116 20953538.28 6994808.717 6277775.304 19230755.57 9438357.119 5759996.623 9687837.517 6169460.549 76670821.76 9247150.225 22317976.85 1992766.763 8121806.764 29811097.41 19755243.16 10773290.35 33075173.04 7648203.831 2269699.406 13568877.67 8644151.261 7756509.486 8695046.055 38500.94945 37488.66796 45301.96459 45227.12849 42263.21877 CJ-16,169_2 55844.95371 4935228.646 3625802.189 3522244.452 149771.4648 131364.9306 407615.2871 1666878.168 815067.5602 4358983.628 2217687.777 3878993.109 1177918.623 17464481.99 172793.9825 5616253.519 611409.9222 9752493.538 5731654.333 424172.3358 9757525.039 15633987.73 2545473.388 786883.5395 284100.0925 3460601.804 3848946.469 1144352.851 709513.1327 7493907.824 27758868.52 2129296.437 7251743.137 284282.2277 212098.8253 2321857.079 646178.5621 81762.47012 120972.2103 3893110.875 6539408.172 114652.398 1157549.637 103886.8828 343803.3078 1877176.294 5008253.782 1431944.873 3498864.05 3843293.542 1829473.037 2359574.413 1893666.587 7530312.915 123824.3382 956244.8955 698166.399 1134878.793 244024.1663 6135574.354 3053335.022 4656017.659 2610713.006 135734.4424 9885754.349 2211088.642 305186.1658 5288708.35 579708.5388 680822.416 555352.3017 3552365.341 4312317.954 204119.9901 1277640.131 7012223.382 137861.6097 969410.14 1286072.869 196395.1022 137584.9562 3841305.712 1080593.027 296865.2866 1943179.017 289831.3054 927609.2463 11805249.81 169758.9486 156009.3209 123489.092 452462.7329 166283.3574 3006208.875 3076182.374 40430.85298 37302.86058 3561507.542 4025619.068 149234.4088 320289.2522 379103.9299 706066.6696 119350.1525 1930539.123 3734566.724 274209.6544 1674549.415 146974.3653 544826.2967 1157375.493 1491669.625 986162.45 446653.129 877136.8204 3218248.454 3632730.997 1266916.386 213100.68 107145.7584 207375.7831 1098488.99 3936683.559 458627.4559 1796600.968 1699400.7 412015.964 524907.007 1132934.531 566491.8164 2947822.276 1354056.061 3372893.412 3741903.316 365973.6191 497786.2235 1595408.164 338054.2217 965601.613 3009671.518 1528994.555 2056594.769 436732.225 3360603.382 3766436.714 153659.33 203572.2547 101059.6274 1637281.645 3803064.554 3542564.059 988270.5144 1401198.007 373760.2268 806055.8178 268491.3144 7947054.022 361426.854 1555492.171 176723.7129 402527.873 2555246.22 1695919.545 776604.5482 4537713.292 403802.2206 157525.103 1254369.916 3492845.391 4020998.632 5135457.344 51129.01927 40445.9924 40161.36503 64608.08818 38031.39112 Cladosin L 40333.27422 1092065.558 1102267.904 1297498.517 830612.1037 3213655.705 2362706.105 2882676.661 1325487.882 2182004.824 1599452.25 2469671.154 1627478.527 2622933.326 2710333.903 2799381.239 4699267.847 1963811.814 1459970.147 2708998.074 2022192.1 1985945.07 1192155.746 3677995.622 936696.3797 1090544.799 1398750.382 2297068.038 1774114.158 1608009.999 2654546.266 3028681.542 3206746.182 2425852.789 2238029.472 1898727.599 1671474.288 2007961.722 2795346.638 2429738.958 2060449.761 2407610.656 1177576.713 3387533.792 1356977.85 1961438.626 3412417.622 1096813.256 1069147.792 1487086.256 1277662.562 1857841.759 1211906.678 1387441.97 1606168.073 5064878.008 3542877.956 4140701.43 1235657.748 2332594.642 3118861.607 2679522.326 3849252.07 4564976.21 1535497.298 1638218.531 2207602.294 6227452.735 966074.1798 2159472.873 1411540.957 1126701.924 1573882.194 1977907.916 1755622.585 1870603.773 1830330.349 2482990.645 2995012.59 705173.9695 1459352.778 1463783.921 2781692.876 955012.3944 1341595.249 1530038.522 2227425.504 1797593.587 1465206.192 1017352.856 2075400.402 1283057.745 1541742.124 1022116.164 1458214.878 35560.64788 33632.60604 998372.9981 1306985.872 1467623.083 649212.2072 3498797.787 2312517.73 1247046.449 1230789.738 2479256.637 1126487.216 1293638.168 997260.935 2479138.343 1186591.163 1771794.902 1959276.69 1650982.451 1276321.266 1211430.526 1550733.807 1350553.276 2672989.525 670681.3522 2117329.605 1782163.473 2889064.106 1741772.962 1558906.305 3011682.471 868423.4058 3580583.983 598220.5246 1274617.463 2071277.64 1550721.305 1167709.196 1498386.075 880197.0266 1173182.87 1409370.36 1668183.871 1405600.315 2297831.088 1126652.703 695245.0248 1810073.485 1594456.454 1194813.575 1106194.784 1151766.18 1890112.779 2234081.485 1252658.431 1304751.435 1241463.143 2785279.805 1984652.791 1503015.69 1559379.91 1653062.073 2453051.407 1444400.897 870378.2533 2641418.179 4046913.022 1561324.777 1215503.508 3085606.194 1934863.794 1915217.277 1329166.479 1221203.729 1435996.606 1196777.225 39176.11667 40880.42622 43037.56034 38435.65371 36326.58129 Commendamide 40539.15066 1673926.429 1916330.382 1721051.772 3225829.422 3083225.573 956435.9831 6592681.598 1002705.705 1364832.618 1175588.876 1969909.46 3306421.071 3076619.957 6857111.989 2116853.389 1361859.433 6181743.7 1806293.946 2955761.185 3778028.677 2001773.291 4451116.959 3544356.866 5604844.416 1720210.609 1614029.699 5188777.009 4060765.624 2162722.863 2893562.991 2556873.449 2784632.916 2424441.213 1495775.547 1889870.882 3520994.441 2559162.09 2344412.811 3182611.091 2774246.722 2659987.341 2953501.177 2932284.526 1213177.2 2364589.366 2115538.826 1374157.923 1828413.791 1742045.381 4221069.264 2105436.969 1117959.928 3933675.298 2568080.731 5495465.76 4147199.987 1255924.467 2294529.457 3391232.457 4073998.26 3359080.708 2805393.862 1537570.334 1244202.036 2709266.542 1080082.589 1404807.922 3393381.589 1922375.474 5103755.485 1742987.714 2322134.232 2666053.734 1919996.726 2618124.152 3400924.541 2861173.986 1655747.877 3064402.86 1568303.76 8266502.952 1567941.682 733432.3493 1821216.699 1760166.632 3014271.952 1800325.166 2785040.102 1436046.901 3569369.892 2622787.8 1186195.065 1694313.461 1693213.782 46139.87079 37405.91542 1648209.764 1596603.568 2801278.933 2177814.992 2990773.329 2497207.179 2742580.996 2599031.156 2921193.313 1922800.321 1991135.186 2681081.369 3268225.103 2001666.218 3466196.78 2788819.119 2015886.286 1437899.971 2074356.073 1968390.037 3496793.337 2545298.509 3321383.483 4201239.733 3742200.97 1966249.686 4336651.058 2198262.888 2019175.617 1501498.526 2874349.111 4757524.104 2000962.325 3995850.187 2579581.369 1997095.854 1947338.082 5555135.629 3166795.28 3894529.855 1307783.551 8525320.79 2221803.91 3794653.356 4352565.127 1620477.069 3722321.671 1978523.483 1422626.117 1477188.54 1749420.088 1670839.785 2223093.776 1588099.166 3092673.325 1673351.435 3169978.304 3157874.767 3333285.106 3390921.33 6830720.793 3301377.523 2971313.885 4108328.41 4508978.383 2700448.254 5889551.718 1322945.299 2691825.079 5747236.057 1880290.552 2095975.296 1956578.595 2019355.737 45968.941 37219.3189 40920.04117 36754.21997 37166.64924 Cortexolone 36919.40193 205074.3651 168684.0784 249886.6619 264306.6633 140357.449 176367.5351 345137.8743 173191.2999 264159.3894 322310.1797 52146.73393 214991.4319 49620.52402 336948.6319 402908.7151 407845.4305 249755.6384 302153.6725 173653.1936 172974.3994 159411.8097 386273.8655 318888.0277 529043.7487 142500.9558 240301.6151 41789.08536 107860.0256 715253.1018 216574.1569 670746.5208 284420.5631 437506.4184 241008.4352 177292.4744 259597.8013 236282.9735 611882.4527 293603.608 299759.0375 229084.336 238684.2364 320700.0496 331335.2082 219873.7813 236513.0589 272230.8436 304833.1428 190713.7122 270169.1672 434696.2305 306182.6866 370322.8301 376976.8097 382163.6901 389245.9016 68828.7499 211105.3525 354601.8526 506717.0275 334487.0455 406868.7577 206778.3367 253851.2069 134965.1345 274041.8101 126001.8368 179263.9027 189089.9401 466358.5478 133873.2977 180419.4788 267980.1817 157820.0672 106087.0593 134598.2205 472873.6173 197101.9026 124576.271 166694.8435 137432.0788 218554.4648 184115.7928 164108.5843 144887.9858 172388.8291 136656.8012 142957.683 134937.8447 148200.6973 303800.6284 49771.49639 98786.18546 170941.6521 34221.87513 29452.61955 136632.3763 329926.3157 382935.3486 160055.497 381904.4759 269607.8683 81185.58202 82011.78403 119856.1215 101481.3096 181326.1846 150048.8715 116670.4771 192188.3494 109480.9538 309314.3071 81514.72741 518579.3918 120471.8433 131630.5105 159881.4561 201250.53 61515.91851 249034.6994 205429.1764 204979.6838 122201.3637 59154.65311 332354.6891 35510.32578 132523.6916 539424.9519 147635.4552 541510.5854 335614.7526 150394.1072 146032.4778 279257.735 260902.3407 328801.6139 180815.0422 275807.1925 177455.0403 230863.4964 132301.1263 371682.8641 150182.3732 158626.0243 409998.7839 374633.0879 110531.6159 274163.0767 197205.002 212732.6156 194008.8087 112151.3933 270980.4289 62254.04514 50740.46864 240918.7322 267737.7527 199392.7862 141850.1256 253581.6379 127525.5969 182658.1381 179872.069 251666.5024 199727.8206 148532.8425 235998.3066 173772.866 185839.2451 244100.8675 35519.35561 35673.30455 38704.30939 33570.16863 33375.74399 Cortisol 50082.12679 7681492.238 7191534.458 6526567.101 8710858.672 9576514.92 7674618.63 5722716.498 9572958.754 9082474.471 18513227.27 17138111.75 5020896.328 1155964.809 10394562.31 3392994.285 8504464.094 10962362.6 6830826.642 8774265.701 5357527.14 9293768.445 10989653.78 9335518.559 16438926.23 6625506.025 7240825.182 6371914.266 5357323.614 5592423.602 9596208.079 16462197.9 8249323.407 4462400.16 7669807.859 17164840.18 6574835.366 15968871.39 7865574.531 2447702.327 10496384.6 8306049.091 6458550.691 7973855.639 5455582.137 11236777.95 7890112.933 7303426.02 7324591.926 7550048.892 3140977.357 17083869.85 18244393.15 6396419.68 18243864.63 17745307.82 17486389.39 822849.6085 8583422.249 20639744.43 10915418.91 5695681.383 9088331.763 7252965.608 6254904.613 8435737.828 3897591.221 18159402.51 5432612.196 18355101.7 9095181.859 7425662.44 7745690.249 9530310.696 15781710.91 8612474.066 8944217.304 8908818.721 8847445.05 8690442.345 4212851.667 6121789.866 8290988.76 7210069.514 16987471.35 7649055.465 10118710.63 2633050.609 8882746.635 7960986.849 9440975.626 18107105.99 9575594.392 6735552.718 7630135.513 32067.60136 34690.95311 6687182.752 6970631.563 8741116.371 4874309.382 8300132.44 6106175.908 7989163.088 27927442.84 9854239.463 7111952.562 15119002.38 17704660.54 15892550.22 17136387.24 16657653.26 5303144.608 4294744.801 5312838.803 8726209.28 8464099.997 15030280.01 9367759.718 8043842.006 8838822.634 6746633.361 42379638.15 7078733.37 7217695.575 8245840.621 25756029.5 6080511.742 5850927.736 7644603.098 9181196.405 18292314.75 7666809.841 8296491.423 7875231.416 22181771.44 11577296.7 8964113.296 6140948.534 10259032.38 6133778.887 7188753.515 19350579.62 9817088.818 17132288.44 18452270.52 11098471.8 10717127.44 7010781.515 8292421.831 7056411.466 16833566.08 6164684.041 5606237.352 17493678.6 20639128.18 3520917.762 19774901.39 17304358.49 5531501.612 6876047.999 11408829.81 7064586.361 5142430.877 9853917.985 6835240.819 9139185.514 8474434.11 7820863.532 7910241.942 8085082.462 33123.71609 34344.90605 37088.11931 37846.28921 33452.37086 Cortisone 83357.14558 75457.81106 77787.46604 75968.85411 115057.4593 420150.2095 70423.69339 61685.91075 87001.21119 11447651.84 98734.39128 1294727.369 186057.0779 76420.48867 74260.18534 53776.74442 56026.97522 70018.02413 78360.32829 54665.17592 68673.05779 80980.46137 48678.13192 56030.19968 62341.16349 71793.3345 64726.3174 66549.79813 46209.08035 50646.09342 46846.30436 65435.56268 69425.27058 57360.13855 78216.59268 47389.94575 10546360.22 11606079.66 52433.28454 29159415.2 79852.45367 91653.90421 49911.05106 61420.66829 59032.47028 72601.13926 47805.39626 8706491.271 64118.97875 70181.27565 57350.61754 44512.68334 54385.70435 52812.14518 49057.35432 84299.86464 48396.2459 89590006.05 77574.51061 50668.8541 46904.17098 54383.31727 62151.31981 46912.16153 50921.60316 7571307.207 75929.94691 28680.07554 73735.07396 7539424.978 81426.52612 9410488.24 67399.62119 90591.26505 87213.41249 121362.7295 69668.62619 81621.36559 109625.1039 88680.96271 124890.9653 138312.9944 132943.1653 8283134.311 4772488.288 104091.2017 117310.6062 31331477.84 93654.32806 103533.4295 101997.7658 144972.1318 139176.2517 142961.8009 4187182.439 56653.46419 42450.99058 235348.3226 170887.4563 145390.404 170606.7395 325680.9341 165503.4008 175858.4725 168174.5785 148821.438 167563.3487 169905.5519 222800.982 231275.6489 213798.8103 210048.2796 208403.4226 232676.2159 210733.2994 224659.5677 320630.3047 365430.8539 218236.2581 223590.4178 159924551.4 677902.5391 258463.2453 242866.0676 249307.9324 239843.6951 221288.3705 202210.4332 220443.2983 298108.9061 280461.0552 388151.7155 278001.2934 235023.317 241633.8464 281869.006 238758.6574 262839.8939 229768.3664 251459.0884 215679.9266 302682.5158 164601.0384 324587.4667 180683.778 186587.2228 277486.1609 231383.6006 205139.427 273165.6128 223190.7083 211641.0915 255307.2653 241990.0736 221764.2534 251414.8659 227923.4367 422358.3893 191804.116 255149.2906 151334.8224 208774.5222 215382.1162 174479.0841 199418.5057 211355.549 482765.4348 175102.3987 186782.3184 230176.8097 197816.012 42021.95656 45958.69461 43924.18599 41405.46208 41445.64363 Creatine 48826.87146 52786225.53 59037184.85 82202530.69 48336798.38 47638088.75 25614139.64 30520101.91 45602488.4 30775701.99 113910760.9 69540353.65 50816148.24 20053556.68 26141833.39 114020271.6 138884545.8 34405982.43 34580444.84 32948512.86 105467592.8 83477758 69940652.46 99104990.37 20491628.05 59942093.54 72452050.89 27177195.15 46907350.06 90137499.71 70941671.35 106056333.5 38349075.4 29837752.69 75373807.65 59954292.56 90009066.31 24301779.14 51323708.85 84802033.71 107577741.8 13918963.6 34039192.03 79371605.22 63922330.22 29682031.49 68983276.86 22428079.73 56649356.88 72988082.68 29715945.53 45585790.84 81104151.92 112871217.1 27726454.26 117611424.6 128934073.1 26889528.58 82831298.75 57933296.48 79280572.42 105329737.4 117403043.1 51751312.36 56339287.17 17695861.4 89224133.68 87745364.02 82438639.4 102363365.5 20063445.95 57723095.46 73187359.38 96762217.43 26684610.8 60650704.16 42181607.31 45439813.2 91709816.99 20925028.83 66154014.99 54451009.52 71455864.5 44396912.39 48352246.29 24111848.83 29059824.78 69825037.57 15962284.52 16373176.05 18664173.84 51350371.11 18434340.28 56797518.13 71327252.04 255282.472 179124.7382 52273008.5 67495128.8 64615034.38 63886369.92 27159929.23 31173807 59705716.81 43324160.66 44301627.03 28998434.24 68023541.78 63076718.04 35826054.5 61082328.9 11698121.7 21814562.62 27139300.06 81280127.79 48475914.4 67016583.45 53025514.83 28129697.02 33894294.27 83559777.92 41872915.5 74012243.62 17613147.93 61819986.69 30557552.72 86277847.63 25284348.56 59968335.52 35685166.98 71721402.86 27806233.01 55225174.74 70668200.1 11493958.65 95967068.11 22222157.5 46425075.98 25723046.72 14807504.86 127114470.4 26342071.49 55194309.51 22494599.14 81564152.49 39273212.82 21396904.83 84515722.25 95561358.97 60745320.55 70748057.73 43901602.67 40966744.37 85101089.75 81724987.08 38763161.89 45838236.47 26195141.96 42056918.14 62673951.45 65022970.61 16339081.26 101259657.2 34771400.83 83266877.54 36637979.75 17933119.78 53846405.59 55990079.9 59269709.27 56082994.32 166472.2832 181082.4672 150511.5977 164088.4888 169700.5329 Creatinine 2735352.945 125793898.4 152431066.1 178861575.4 178412059.8 157443398.7 122218156.2 141971902.6 129761129.1 138074247.3 193134222.3 129564109.2 184675633.2 212499163.9 157328772.7 171140922.1 178273326 156031070.6 116672956.1 134909238.7 145382387 111812211.5 159299081.3 159440100.4 169685758.2 153662668 168211333.7 209371457.4 127701475.7 157839051 174066692.5 151476425.6 144081447 208500283.8 132354492.9 207529225.2 155344516.4 132039531 167895476.5 159799970.9 142028401.5 156248796 193082957.2 181888648.5 128046358.4 237882296.7 130590178.2 151602374.7 165596278.9 171253308 171302351 136161261.6 100607014.6 107100564.6 142362240.1 190965242.8 178539198.5 171793849.6 125358528.5 153729787.1 163438342.4 149852259.8 146701689.3 125693147.4 134194511.8 131015819 125322191.1 260982689.3 111594270.9 133931640 166495514.8 154626583.2 169105583.8 139220517 136419300.6 131677624.9 246232650.8 186181908.8 134411755.6 173316056.4 97341385.38 180271918.1 155217622.3 147801951.6 184208304.1 98801666.58 141392211.2 144890282.2 149979389.1 198972537.5 129747822.4 151309291 144101135.8 148101395.3 160415941.1 7552151.809 400801.3694 155759002 167002979.1 131004262.8 106636241.3 169227614.7 211239110.2 182065754.2 239980760.7 106989275.6 147138894.9 117241732.9 149349046.8 194116228.3 170765270.5 183151170.7 173910226.1 168510501.6 166700813.4 173074867 186767224.3 102297879.6 143904849.7 142288124 148836202.8 154688087.8 188863528.6 169136066.9 139178798.4 131849392 153497795 167942701.7 134625410.6 272976858.6 163680704.7 180586775.2 164772597.3 172132191.2 140738734.8 197286390.3 239250425.2 150584660.2 121610050.8 185118834.5 159588969.7 228813613 187533556.9 132096343.9 151287583 152491922.3 274776790.5 175366089.5 122868398.3 167567823.2 172681692.6 189855176.9 185947833.7 126285892.6 128176963.4 171622513.1 178539972.8 224158676.4 146101781.3 140746521.5 147229472.5 142873223.6 124185167.2 158283563.4 122104038.9 147617446.1 164185760.9 184901887.9 157295482.3 175959483.7 122463148.8 3890672.134 167414.2374 297775.4019 7605955.505 156891.4193 Cyclo-(L-Phe-L-Val) 32775.29104 1651313.966 282440.912 133768.907 1627146.3 1060667.74 600212.9261 1391027.203 1513968.521 699697.1978 1925805.997 957703.5822 1890512.732 2215641.733 1380708.601 1538999.474 1236095.698 1911300.086 690521.5232 1662234.004 420762.5279 1408653.78 647202.0216 1381313.67 1584172.035 821989.5863 878932.2639 1497256.141 1434643.996 1477447.959 2358813.325 1479093.355 1758926.998 2077373.132 1939626.856 1951542.696 1127488.937 1263877.882 1836229.255 1353216.234 1824735.022 1277764.576 1439220.277 1780605.26 1663229.879 2155101.935 1989700.724 1772283.076 1101998.722 899878.1135 2036187.206 1448593.127 2007873.205 1585705.821 1558759.269 2086165.551 2032004.092 1986857.782 1764206.857 2297108.276 1933574.621 2034508.28 2289648.476 1503501.761 1702903.886 1412709.491 1807835.771 1830125.795 2042979.702 1835233.4 2099231.434 726910.3992 1174006.316 2422795.171 1531822.773 1646312.628 3205455.87 2226933.776 2395143.417 1807230.197 1387673.057 1931360.671 1643644.834 2324796.6 2237645.863 1527998.557 1807579.127 1585125.446 1731075.185 1860909.51 1476215.269 1838851.534 1552273.455 992299.6266 964050.2246 25723.58187 27603.67676 794047.8136 888406.1429 1747880.175 1506880.3 1160715.948 1077757.108 1572843.301 1910215.086 1752616.251 428424.37 1302004.472 1165147.712 1748049.896 1858577.256 1953162.827 1395968.53 1217590.381 1636979.719 1226921.825 841181.0316 1368782.074 1873802.397 1842098.292 789414.3735 1945447.162 2058852.58 1364980.777 2096212.798 1407557.208 1610349.875 1596957.064 1958173.839 1904666.458 1981267.495 2190399.894 1153167.347 1265107.941 2008047.069 2059957.303 2064629.12 1671352.103 2057166.523 2205774.424 1939932.336 2159235.265 2109048.106 1929428.215 2424236.299 1945706.089 1840012.001 2252014.782 2126416.231 1137803.983 1152613.164 2344293.275 2850391.592 2074677.725 2095066.32 2000800.628 2323889.171 2308262.556 2217976.895 1858817.334 1907435.153 2111219.963 1929739.144 2358013.938 2099509.597 2057775.705 2143409.754 2155418.395 1201018.184 1086752.938 1903083.014 24484.26885 23730.73956 23915.08173 27603.54705 24304.77876 Cytosine 27182.91 603865.2 139620.1 167766.6 977446.2 730057.7 412614.5 481694.2 877748.1 635881 469519 328676.9 1049381 865766.3 1230795 468548.5 1798261 972397.2 965733.4 1450792 265784.3 529752.6 361008.2 887667.7 426408.5 405830.4 526595.2 1164035 1641884 648615.4 1455784 775388.6 1190236 1620202 1149268 825864 824987.8 940481.4 891923.7 502806 751015.2 1795895 726564.2 890774.9 989163.2 1537238 298118.8 636466.3 598901.2 512609.2 1015849 794884.3 481770.4 956971.6 1053683 680133.7 849721.6 2277066 1171028 1152729 1091195 915854.3 1655033 946411.6 755396.9 690934.1 889536.2 1258947 524741.5 867395.6 2803945 208090.9 781002 1245873 686418.9 261433.7 777920.7 309086.3 1369228 2201475 903457.4 547360.6 935508.6 654859.9 900445.8 951670.2 474892.1 267871.6 1194023 937353.9 1723009 730219.2 1922937 520911.7 472187.9 22571.22 22893.72 338523 329820 421300.4 325175.9 377952 438038.9 762477.4 1092451 3052779 318189.9 206339.9 408856.5 1469423 431684.7 1164977 721472.8 1114108 415135.9 561870.1 410730.2 116219.8 577126.5 1038534 698410.2 1361297 695880 347590.6 1299177 350347.4 1241994 506865.1 869495.8 535197.7 912577.2 286955.6 484502.2 759775.5 1382871 969794.1 767732.3 1447686 760687.1 960657.9 439957.5 383239.3 1082492 947437.9 700973.4 823351.8 866844 1621538 1371897 370696.8 630392.1 960636.8 782750.4 758385.9 834154.6 943609.2 919053.5 666481.3 866906.4 614460.6 706326.8 719987.3 1560203 800663.2 1652273 1819442 1041783 683307.4 587183.6 743095.9 716793 21764.62 20223.64 24591.47 24028.34 26293.8 D-Erythro-sphingosine 1-phosphate 1471429 5062877.296 14930875.26 13070856.76 10427299.83 8753533.869 7393952.257 13997295.97 11688078.16 9098030.836 7046138.098 7698883.475 10413919.96 6759917.295 8208081.407 10895911.83 7170684.291 11920306.27 7309954.957 10191181.11 7013083.638 7766776.516 8895386.349 8095287.454 6812862.126 13602748.86 13977281.51 14855091.61 10649240.19 6991953.844 12310150.96 7329301.004 7343485.328 13157951.73 12348446.11 9881427.946 12410971.27 8266069.342 8229418.322 9417573.832 7897655.568 7182313.4 7392909.118 8942277.199 6676448.866 5849876.528 6532143.038 4256417.666 15100182.14 15541727.59 10079444.3 11074263.41 7733983.842 8295458.178 6534522.606 8682993.378 8413097.459 8568708.365 7413047.049 7629953.38 8082124.191 10246962.28 9605862.024 7677633.213 9379512.323 10144074.81 7383732.142 11410024.63 7714998.116 7195915.852 9420410.297 15252112.17 15662620 10367903.12 7146808.95 6608334.144 7351620.669 6905798.508 6259336.064 14783557.89 8072785.748 10371735.26 5042058.075 12939296.02 10147333.82 5203370.868 8355240.737 6933213.915 7424120.274 6989853.995 8163487.74 6206036.585 10647266.79 14511462.22 14044403.08 2009987.578 689376.1723 12796888.96 11329113.24 7695167.308 9917333.791 7796343.994 6439613.506 11536958.22 6775364.819 12552276.99 10345495.52 6718912.558 5551700.741 4346899.523 8890635.104 7997451.497 14985502.38 13345347.85 9572434.684 12893394.6 13171783.36 9527168.425 6516691.003 5581766.721 8127328.164 12492613.95 9350687.249 10465940.25 6494968.501 5967683.052 6075811.885 6513079.622 10668212.32 8857398.738 8518473.039 6371814.26 14399775.09 14289185.31 8704345.34 8997617.013 8008367.251 9064322.307 8885678.925 5741407.577 6092537.99 6247207.751 7236932.468 4846895.019 7523205.562 7221812.323 6779691.708 8845560.71 7104197.441 16704203.59 13068419.89 12368966.9 8199487.287 9076873.41 7630070.704 6448968.57 6117018.86 7253044.598 7326319.22 6529116.473 14038408.76 10772190.07 6267474.725 8427927.532 8762571.999 13483408.47 9471365.42 6954672.893 17839600.67 15519827.95 10960747.61 1100010.996 374475.2816 243558.6127 180917.654 85014.87722 D-Sphingosine 3043471.036 3233818.243 24691480.19 19583961.67 3608403.949 3846362.222 3134063.286 3788099.271 2849158.637 2481328.433 3002420.346 2767157.112 3105997.167 2963364.605 2973642.278 3153657.342 2932829.337 4028213.357 2812950.617 2793737.337 2841697.88 2792162.504 2995676.678 2993413.608 2762099.258 19774141.69 16759349.35 3179231.157 2790734.494 2683921.017 3060487.147 2886325.455 2699036.953 3235429.66 3014804.139 2840304.801 3233393.578 2685365.042 2600299.384 2694333.151 2710148.663 2573778.619 2527442.049 2796341.728 2147117.658 2816297.886 2916746.271 2655062.79 22710044.52 19751296.67 2330503.893 2630585.127 2490003.529 2937826.311 2514778.992 3045062.694 2941247.564 2748092.241 2308854.005 3211752.82 2769205.046 3225303.805 3621613.344 2285750.827 2519136.618 3229808.16 2811731.665 4716214.248 4170379.869 3016144.874 3399789.763 21882451.56 21392546.67 3345975.844 3379566.341 3584295.962 3144827.448 3631852.426 3044256.031 4153894.958 2510073.813 2835825.467 2989948.816 5191927.278 58996.90954 3190628.297 3438227.68 3501541.128 2801346.468 6427558.343 3462444.305 3398290.727 3022180.387 16880664.01 17579459.67 2322651.949 2213336.715 19313500.9 14171153.19 2944986.013 3608123.01 3197414.617 3471451.513 3394404.216 3375955.763 4983140.389 3466459.909 2978622.604 2544611.235 3281555.601 3401643.564 2952340.074 3516325.455 3119826.551 3057255.36 20210497.49 16335380.41 3244526.258 2944626.2 3132111.044 3014108.609 3867010.388 3502134.934 3659973.601 3050531.301 3219237.137 3330623.341 3498054.463 3471046.377 3293890.938 5870657.935 5966800.102 18530597.44 18826558.7 4375054.064 4287513.644 3608535.21 4051975.639 4067636.398 4142827.736 4370169.649 3785746.23 3956288.666 3698497.668 4353222.97 2931713.261 3561101.168 4627850.787 3962152.298 22754466.81 16339001.31 3810384.642 3901414.23 3680380.072 3753029.205 3949578.387 3870964.935 3703618.23 3715285.71 3090197.38 7358337.454 3605501.54 3629596.868 4538925.785 3794938.575 3867071.542 2737773.08 3656691.23 23771106.58 20628874.05 3625263.853 2364542.436 2589695.206 2671078.66 2461465.505 2586357.556 dacisteine 46270.18814 1780500.373 1337968.855 1625250.073 1014004.569 2203514.947 5008661.281 10198145 2126009.608 2019891.747 2824744.834 167691.3998 1014912.586 5498227.835 1885766.989 4802583.608 4474363.708 7598409.308 2210962.768 3893783.689 931757.62 2319489.367 2633527.116 1382318.808 4075202.418 1350713.958 2124513.582 169146.2582 7594155.701 3685310.08 2076159.869 3621805.396 3778773.152 39340.93551 3562871.878 210517.0022 3184365.331 1061229.151 1221941.29 2389050.84 4310435.481 3911154.118 1380162.564 3276620.95 3215567.168 1433306.789 66567.79687 2136039.431 1362127.651 2243372.618 1374470.038 2325935.09 1994128.952 5278399.995 1264571.038 1770302.189 706219.4822 2954074.15 2963722.558 191267.0462 749568.2699 675103.3924 2237249.713 263253.2777 539568.8713 825841.2293 213210.6136 395919.9795 1604287.486 1223495.332 6987354.327 1146753.763 2222604.642 4858582.309 2351763.953 1573165.798 78715.05889 1625726.659 218766.1674 69095.87709 2547631.358 1587683.551 1411654.978 338120.7965 221189.1339 1911688.755 1020484.885 597320.3692 1023099.828 333199.3088 1536871.762 5863710.348 437564.8041 925190.863 1689516.178 51341.71436 47240.03389 1306567.12 1891150.708 5126257.232 52454.06857 49235.20352 2522082.914 2997862.881 3229045.944 3465525.607 1482427.161 4388483.484 472641.4539 2724776.849 1710658.142 849586.3227 3024295.432 4897470.173 3695379.378 1182056.113 1599073.297 894681.8113 4711374.383 1624650.397 4521776.586 473619.7148 2684439.493 2663076.664 2229559.32 2210577.366 1656669.597 1031582.072 2944052.296 1993235.535 2672970.675 680579.5861 1314089.964 2214286.258 411624.944 385808.23 3738292.26 2271088.003 2760708.733 2783307.981 1996099.838 1522511.541 5331095.066 2935047.036 2043663.472 3294706.192 2085926.847 214628.9054 2228474.362 1080893.627 1330246.2 695923.358 628181.0165 2103247.324 4031068.38 2012526.619 4034236.098 2461016.739 1139450.901 98657.46359 3562057.245 1511202.562 1687934.456 1094875.124 1155149.272 2228263.087 2142937.487 3448147.149 1568907.569 2318441.151 2008772.718 50850.62039 45545.38115 45340.55377 42116.1615 47439.10468 Dambonitol 32170.87324 192778.8083 374467.247 133046.5756 7279438.575 5208573.535 4644594.267 7828613.291 6823298.925 949829.604 6699118.741 2371744.214 8217827.286 9612761.293 7301028.735 8593300.504 9178874.364 309703.1831 1637873.048 9017466.13 6188840.991 431555.428 12727445.73 4037046.655 9592512.769 255534.1519 522163.0751 5216450.814 8295130.228 2528808.319 7692706.796 8928858.994 7933284.009 8271660.693 6209281.05 8384140.929 4149373.987 5711852.695 9602826.484 11067801.87 6253293.564 7198705.381 5605182.713 5364527.259 4844519.517 4296957.991 5507035.898 3870165.013 287354.2815 1340240.95 14291315.6 7461471.956 4907103.853 217922.4726 5152282.31 10482834.07 7885178.957 13501229.76 5056442.735 9060860.126 5097243.79 4338721.782 5102715.232 7853384.372 4826866.898 7669772.15 4549906.964 7405551.532 4473990.298 4634378.021 4425546.67 766626.8453 278162.1412 4853973.759 188118.8133 4706959.72 4483094.572 429624.7518 4514538.369 9714219.368 10863309.1 4998327.981 13799591.95 3151056.512 6055883.837 5537104.995 6653383.849 7943213.261 5264186.071 5463866 12217702.69 7222347.065 3677515.447 546835.1665 468331.0116 64649.10914 27320.08916 307345.9066 302845.3912 8951887.63 533262.3129 60024.65263 6287529.197 4278366.203 5417383.122 7462818.501 6954235.212 7718641.357 184742.344 9537720.623 5968342.984 202689.4158 10577692.86 251856.7981 187634.0435 246918.2419 1104210.875 7152926.407 176588.8918 10198855.04 306289.0216 9612362.988 1547866.729 5914350.797 6057749.754 175340.1493 800565.0564 12481318.68 10668825.65 145180.0436 5902285.472 6457298.708 288396.7699 818892.8743 223497.6725 323136.121 243974.8983 13193143.37 11863990.69 225883.8143 173190.0095 8488043.576 402269.1515 6510746.135 6348048.642 5599804.228 4543353.69 10133205.78 12954069.01 284123.3791 303141.3101 12661981.43 5065843.736 5145250.175 7322225.273 200027.5649 959175.2586 3550161.026 962938.0735 8300049.529 5808493.57 13856597.61 8238117.831 7923190.535 7458262.167 9156129.289 205194.8603 4837474.598 341279.1693 276221.6551 296990.6035 40875.14086 35390.59477 39238.14084 143964.2925 93703.3092 Decanoylcarnitine 767434.9495 2008114.144 3238220.785 2619453.857 3116735.382 178010.8872 1999147.982 3157803.202 2379465.039 2701589.639 1719725.609 3186881.946 3366378.775 2060914.18 2441022.686 1117035.086 2365126.171 1838130.456 1765186.303 2266967.277 1739861.004 1661295.996 2478716.867 2408043.3 1213084.959 2229477.219 2261988.369 2886962.259 2203773.425 2403621.09 2138479.938 2108693.804 1488271.851 1781685.644 2296103.697 2522730.743 2369364.095 2051355.908 3569163.064 2682608.009 2967739.567 2265592.32 2741738.267 2634264.871 1118202.58 2635974.316 2158248.471 2016677.333 2380123.904 1928137.099 2382619.331 2338509.645 2594539.974 2009508.718 1776392.145 1738307.923 1731762.542 2083580.659 1914952.653 1917542.978 3604105.301 3276179.4 2542548.197 2382707.22 2718118.565 2252702.699 2734418.991 2355049.814 1807165.55 2296906.744 3064586.341 2140758.462 2148053.23 2460933.663 2611994.218 2050853.852 2122689.166 1782465.917 2548832.597 2881096.55 2315333.965 2443860.63 2832485.765 2713936.581 2111214.303 1974734.721 1771565.6 2301488.297 1977096.859 2726300.733 2238650.052 2768991.137 1811319.344 2247283.005 2102203.27 76249.79777 90868.11775 2660077.632 2341328.182 3027042.244 2600400.496 4090054.919 1656087.731 2937745.96 2006169.39 2989196.767 1895714.26 2476844.785 2555849.114 2590254.583 3563700.938 2057306.372 2276384.65 2937621.876 2776918.856 3266213.833 5586915.449 2443622.895 2336118.034 2497287.849 4781121.51 3430923.967 3038686.25 2224230.618 1959945.33 2675633.624 3387132.244 2504876.977 1971419.752 2719141.29 3077373.985 73322.36823 2526439.542 2440785.26 2418246.151 2652300.315 1315005.617 2299860.908 3566343.197 2266812.606 1559039.399 2188321.926 2562210.688 4104487.624 2281453.66 1519859.244 2377304.768 2631947.26 3033644.642 2741531.808 2435579.291 2203791.551 2654132.013 2791190.59 1919589.868 1793546.232 3473230.366 2130361.923 2696201.305 3425407.956 3046277.53 2588855.592 3214759.857 2236518.752 2319363.932 3439646.253 2610328.511 2649599.761 2478904.259 2482827.905 2179607.424 164857.9247 81490.63771 323641.3014 278327.8435 247395.6135 Decorticasine 49726.24558 4779672.926 4612728.087 6005261.732 8447009.721 5116310.442 1211816.661 6328075.188 3009279.613 5267940.587 2892496.495 4307821.424 6032860.857 1880692.787 4096820.802 4691254.942 6550473.562 7617807.543 3306898.807 5710973.468 1920585.441 8393915.994 4938556.164 3832194.546 3985867.863 5310596.1 6466849.318 2843683.33 2385590.631 2341164.693 4823643.565 3781005.448 8991643.287 4121282.9 3861968.658 4394913.034 3499867.654 9504391.267 6614982.916 5779890.407 2909881.482 2251552.311 7057220.694 3029102.923 4020901.224 3562604.178 1820102.112 4952383.01 6312686.513 7887106.424 3071974.157 4139946.294 1443432.348 15125152.96 3241907.295 6047003.914 3372553.708 3265228.356 8436819.628 2376239.698 7166821.666 6926936.24 13602093.53 1446302.024 3829775.96 2717460.981 2728641.361 13213639.77 3677255.73 6859907.307 6266371.448 6239585.604 8500369.497 5718636.177 2885520.417 8972750.893 2515378.49 8944683.422 3494858.675 14564759.21 3483321.723 1953658.978 5397541.696 6617645.339 6893554.572 3952521.96 4911101.559 12964844.02 9009930.351 9778475.941 5619191.29 14369659.42 1552438.101 5037105.365 7231567.343 44785.93308 49569.92513 6111443.616 7643850.089 5255178.721 2023593.295 1636590.379 5968520.751 2854815.923 3490185.462 3400390.966 8575165.495 7766089.663 3800333.374 6637309.476 3229357.809 4566722.427 4150961.997 1707798.034 6627135.94 7092974.754 8232943.508 6667946.665 6561748.03 11513149.15 5498939.12 6402774.839 6419063.786 3880978.904 5846361.522 2413102.729 6818997.936 3328908.69 3750100.896 1859594.921 17225260.03 4137887.94 8180389.569 8749384.136 6765322.869 5131611.495 2507111.116 6220993.289 9336731.187 4377290.213 2924521.207 2007084.701 5388304.155 5033978.389 2690338.428 3630961.426 9769467.405 5513046.18 5308550.627 6820044.514 6768929.636 2908744.726 8357383.577 3466955.339 11618889.73 5460563.285 4239509.275 7285861.063 4027454.838 2939425.505 10054159.52 4946862.195 4350576.862 6537024.471 6009977.639 4485794.708 3981105.127 2882774.543 7918419.708 8917970.603 6770950.815 46203.94668 44431.90166 39347.3189 42494.06175 46641.65668 DEET 2325982.702 5723990.579 3418977.269 10120238.8 1823832.91 3233661.594 3010667.733 1503437.594 1755044.035 3791727.924 2088891.128 2855397.56 1664174.106 1816775.472 1691441.223 3869661.452 1914218.036 1668086.177 1971013.804 2077873.259 2598127.456 1905675.269 1703591.24 1755390.87 1881264.574 2988495.358 10590364.61 1904219.693 1693100.735 1907871.341 1898971.737 1754291.263 1939258.839 1382132.728 1851840.974 1935071.106 3117389.283 1706665.592 1531080.965 3176221.189 1760346.612 2561413.604 1863462.931 1902306.11 1703193.832 1635570.929 1357789.794 2946275.48 3100464.369 10665516.41 2332190.985 1486304.869 1699116.597 1920697.818 5571772.496 2228163.983 1725604.823 2321935.634 1995285.789 1466268.224 1795616.174 1471294.113 1963298.037 1523835.108 1570654.251 3212653.397 1884367.961 1270172.867 1626513.13 3028831.25 1050517.082 4312650.279 10131764.19 1477703.133 1574119.215 961776.7033 1261861.271 1437594.214 1111336.844 1135886.947 2665343.234 2585783.977 1916176.586 2735787.887 2050791.656 1141079.812 1043171.527 2351248.602 2379174.957 1723738.319 1977701.546 1228800.504 1104039.576 4242294.04 11450485.02 1965917.936 2337205.635 2950081.284 9572293.758 1360167.11 1748934.167 1253419.343 1418765.391 1309754.904 1221332.655 1702416.085 1692094.836 1561815.969 1519648.517 2210150.413 1896640.678 1674231.104 1179933.068 1257971.531 1614432.832 3485683.745 11702341.3 1635180.658 1702977.96 1594573.672 1786561.156 1410821.588 1300323.573 3766657.951 1853042.179 1904773.583 1590410.772 2244828.646 1996331.041 1913613.06 1349654.27 1733840.681 3588105.666 11227844.39 1653538.974 1289817.125 1514586.534 1404625.268 1611930.357 1888055.756 2126627.718 1527084.874 1269776.045 1454433.956 1258405.016 1901029.021 1461358.802 1712252.39 2071324.292 3665711.67 10290305.07 1696443.867 1497148.732 1700738.444 1720607.645 2073910.399 1765486.865 1770107.083 1614384.97 1461219.152 1482858.533 1331659.078 1930337.417 1541915.584 1749364.026 2200600.153 1806787.864 1798698.784 3213279.613 11123447.14 5708573.216 1363714.099 1385670.648 225796.4773 1661865.782 1530455.769 Dioctyl phthalate 7949655.891 117621799.7 4342687502 4258908035 21581733.59 12733016.76 5465617.059 3820393.401 1541278.805 112554864.9 1502671.959 14703038.51 890383.819 789501.2908 493054.501 609316.8923 700373.2028 778100.2004 566233.1928 504071.9982 617265.4652 731352.2614 502813.3956 578257.7799 574239.0451 4975780261 4972682624 16601472.85 7461084.432 2724844.069 3032787.568 1773189.973 1398872.784 801752.0317 522298.6334 672116.6028 132556543.1 142542816.8 728508.6803 312083264.5 1068818.017 3121788.108 653520.8759 204778.5571 672755.9427 656123.3553 549726.2364 118654112.4 4961325595 5313210910 24030733.27 9230198.207 9847627.065 2305397.696 2301676.059 1507852.801 1675784.788 1183588391 2608689.523 1543801.805 871163.3285 764639.0832 2275988.419 747194.2748 509873.8998 115055753.7 880122.5312 940038.314 848382.1409 99780466.33 777423.2628 5321381802 5679954009 18519001.92 4608558.023 3351357.202 2604880.286 3246496.396 248782.0728 1143099.588 1035388.323 866808.0827 866997.1084 125186084.5 68844268.05 689573.361 690313.8318 420338280 899489.1042 796580.2504 567820.2284 2944476.83 747915.4528 5336673803 5622086115 132012301.1 3023174.533 5845224039 5636947346 26633402.41 14381572.22 8034077.256 6369981.036 3259804.923 3859752.237 2919617.874 2908463.787 2788961.232 5487104.362 1923050.233 1954521.106 4858946.058 2245404.14 2191240.183 5605985.01 5548891053 6065187416 21687485.54 12684408.37 7724408.64 6922797.39 4312940.896 7742606.692 3342095.707 3230765.147 5084348.752 5544270.369 1982229.941 3492136.588 5558301.805 2809653.21 2514921.006 5988366648 5792443450 31763015 16669337.28 11524509.41 6008255.65 3833139.829 6971979.942 6134764.351 5492465.018 6915772.965 3113049.586 2596630.642 1103115.077 2876005.77 2371355.35 1690129.341 5851848046 5621444132 26179815.67 9242213.911 7292044.739 2952483.777 6650479.687 3082790.909 6019052.606 5197984.019 2536569.072 2890865.169 2205879.671 2597041.94 2165455.978 2519606.264 2017370.093 4586839.305 2259376.137 6014117310 5727644278 153168894.9 10352861.04 4608407.008 2758844.937 2397743.837 1923850.177 Diosgenin 68780.3136 492761.9441 557003.8984 323162.5161 483989.2962 407936.1611 1239443.403 523530.4607 564347.9798 484311.5029 193314.349 581872.5339 378824.9139 99388.41698 1182573.837 1201193.748 218622.7231 262857.7336 678060.5474 912779.9063 296410.5618 175516.191 400709.1865 647179.0889 411093.2266 521124.8755 333768.4906 414205.8242 593213.1557 488959.0022 361183.5248 418074.6365 408893.344 199635.6329 645693.7887 645203.312 759143.4128 659009.5997 797298.1734 539140.6998 393105.2275 1183396.39 945425.854 871741.9268 959478.4507 556407.4848 597923.5712 829781.7384 583056.4512 355413.3943 1196244.539 1021423.22 1228578.112 346339.0711 1195044.622 748534.6349 858357.566 134004.5976 866530.021 243323.2161 1023513.512 799841.7053 611570.7126 417146.0624 92024.72837 1251222.676 182237.5934 306869.5979 644141.2475 369740.808 723997.011 689225.3199 439873.5062 1083522.624 547017.2409 225606.8115 608180.8741 495009.8725 658897.9442 629055.373 431151.3163 562330.1263 856383.368 631950.8624 1613042.2 781214.2902 691323.8677 200229.382 1333238.92 692862.9954 1008831.639 362652.0778 322596.0155 596176.5035 349183.7138 40188.88842 40088.70212 548990.3696 362791.9287 563513.5219 127386.8408 1936148.431 708494.3901 468781.7303 378562.3249 876631.8738 889315.2388 364003.6762 449484.0109 447110.6825 1036204.204 309019.6925 886880.6431 987493.8099 535101.7943 608776.905 377423.4912 330235.7172 582634.7793 536704.9716 742449.0848 842315.4618 200298.4149 667496.2522 872443.5251 324745.4585 155970.0755 319080.0155 818160.6483 550878.7324 546562.7601 807341.1292 645339.6647 371321.4466 963806.4093 123325.5112 841679.0539 534167.8099 664493.6821 1504145.536 749806.5831 373812.5204 402103.4801 1197892.488 206574.4772 1226512.255 330675.254 428377.0118 664959.029 641275.9285 347483.9172 615207.2709 311770.9374 1047145.98 269445.2857 231718.0439 713404.6466 337768.1223 300644.2875 679966.7926 588652.4546 578854.7651 417471.4235 988364.0163 312441.9023 819987.3576 682504.8669 533460.147 681957.7616 407071.6204 596900.4355 53125.64127 44764.07444 43833.10581 48005.525 44347.68617 Diphenyl Sulfoxide 353910.3612 143552272.6 52049636.64 76329896.47 153499715.1 285675940.7 153716008.2 125594826 142177683.7 275467800.9 148714683.6 221412952 178133511.2 147491536 128238459.7 161203202.2 177719011 169740819.3 247964974.8 137745868.6 158488916.2 146106071.3 144280889.6 156038996.7 151377575.7 48923205.11 69917040.89 143653845.1 128751403.9 224486852.7 173750077.1 149713217.4 132737337.7 139340982.9 200755219.6 143895206.2 132082831.2 154016396.4 152331653.3 144423136.8 161899377.8 147399832.6 126302911.4 134884636 155306333.8 409132254.6 142349416.9 140011129.4 49585385.77 72214883.25 149270040.4 115006574.5 502023542.9 128239929.3 146326835 131056226.2 136452240.5 553177692.8 151513487.3 170556653.8 150716467 156726348.2 132972532.8 176323082.8 148551177.4 146966730.6 139150735.8 182376233.1 136952508.1 156194698.2 134547648.6 50923406.64 78324151.85 170618059.5 143436966.6 137497716.7 121209818.1 181915281.7 181137592.3 131073076.2 136895875.7 159580958.5 182634282.7 172781746 172616074 142243189.8 133092314.7 147285622.5 122227591.1 113579928.6 114171673 130224380.2 93839358.59 49061151.88 72184719.91 220514.9375 358803.6416 47137116.18 70792650.03 139405563.6 128972006.2 168633061.8 148191598.3 144872350.2 134823109.3 103431305.2 139096757 139634528.6 158089493.2 172980056.5 367212615.1 117861059.1 135479582.1 129472254.5 167705451.9 53805552.03 76448753.52 585272139.8 142475461.7 135607189.1 146067160.2 150884423.6 135772142.5 126162127.9 202110612.1 142798993.8 127227010.7 136873095.9 139999613.5 156978059.6 165813670.2 148705479.4 50315340.22 74745344.66 149864959.3 119196381.9 162245429.3 117644222.4 106832973.4 137421206.6 152157951.5 128399959.3 150407518 175569320.2 167530126.8 142691773.1 116130145.8 147972882.1 140597708.8 52825003.12 70229799.66 121131934.5 378070241.8 144620572.1 161736618.5 109720310.2 141990505.4 144891608.5 150418824.4 167588318.1 146295626.5 128067240 133549738.3 121035808.3 132892619.4 127084756.8 128319449.2 295620534 52629620.48 72662640.44 148845313.5 333459.5881 362725.1562 319100.9312 328684.6245 339926.0748 DL-Carnitine 45413.81791 449196121.7 378318094.5 411811211.1 517543185.5 399921058.6 376592111 299414179.9 527367176.3 422348404.2 554021177.8 499944528.1 538540391.8 439048455.6 412536298.9 541125666.6 348594147.4 434542489.7 478939961.4 451097418 572025280.4 674696947.7 455083728.7 437873988.1 420086612.8 386717432 393148555.3 502201981.4 407666338.5 506100675.2 520012384.4 573792114.3 568983146.5 532090295.5 500732121.4 585678920.8 453503704 379058214.4 476223360.9 520874794.5 577841151.5 441354106.2 540998166.1 421983083.1 565807013.3 410504832.4 488733202.4 358611915.9 383328418.1 382370531.7 481393102.4 458023089.5 383615391.8 390291374.7 391983002.2 470698857.5 440987532.3 327350059.9 478184762.2 503529232.6 446152063.1 349265244.5 546871181.1 405115492.7 395588664.8 530328282.7 404796167.9 374760657.6 538927454.8 604779899.1 670411721.1 367296612.3 400623793.7 475832758 341152573 460827668.1 426933612.5 445888804.9 577994387.7 470132827.6 374648454.2 457451894.9 563934508 885776647.1 359877676.9 530949920.8 424450711.5 434279585.4 410204940.7 345519339.5 135777636.1 486499193.3 356924260.1 374247688.2 392164861.8 2007116.072 132021.5165 321238325.8 372566788.3 362281960.3 336958014.6 563184770.8 511305400.9 505902484.2 449540839.3 376057811.1 445084712.9 538541835.7 251555556.2 440375948.4 508928260 374885622.5 471574072.8 384061220.4 499230349.5 329379919.1 346468531.5 296685014.2 367665114 437275191.7 601494229.8 531921475.5 361283263.8 526492842.9 408333520.9 577018497.6 370842557.4 495076016.8 497176485.3 324850061.5 639058783.5 468408609.4 353230047.5 380561153.8 532973647.6 538632425.4 424262966.6 507239462.3 384273620.9 384217618 525412395.9 562792780.5 391648305.2 355254701.4 567029765.3 600934760.7 424289113 439379447.1 424895015.7 405233651.6 374809653.2 464899635.9 343468557.5 471526458 495882619.7 364364747.8 480378749.4 349670789.1 462847306.8 604597167 566708302.6 276268601.4 434080306.1 448715851 545006767.7 420642101.8 341872777.7 372667864.2 376043776 367733873.3 466313425.9 154835.6822 168424.5979 139990.6667 152618.5178 157838.2736 DL-Tryptophan 51051.22117 747211855.8 785259015.6 734638417 1099578647 1011637198 585008032.5 677806180.9 784763799.4 669269580.8 954518687.2 847748667.1 1080554681 1581641353 777574135.3 957411684.6 440879135.9 864435121.5 490325077.3 901281527.1 1057028242 984580737.4 1139536028 968156841.8 963919203.5 760867353.3 784426366.7 787655042.4 600249410 853413849.8 1363279368 892273062.6 994994489.1 990839217.2 1109324318 1306922000 794761661.8 799206264.6 833547867.6 949821777.1 1038808674 749419863 911969578.1 1102103147 913738621.2 1347940258 993020199.9 1093605782 812738427.7 830528793.5 1053402085 831468004.6 1015290715 869533529.1 786539518.5 1035857263 1029035014 684017710.2 1152344951 2031548446 1137609370 1049031924 865254265.9 907822951.9 955829640.4 771537689.8 931061931.6 964671400.7 1057838885 1153085385 785702428.1 803182785.5 824027592.7 1300305054 665167124.2 1011813712 1349542347 772064415.6 1189014994 967351309.2 698717188.6 1042680587 877087086.6 1075791646 1110475314 714499988.8 786797155.1 888541156.1 938847194.8 1122302671 671013534.3 1401520521 680582318.8 749999686.6 794198546.3 135828.8923 48311.02277 716226247 756913256.8 926791998.5 943715297.9 1075102546 873557892.7 942541384.3 1073402321 682369372.8 1035313044 1097474290 757708222.9 574806779.4 1165000454 1043632790 863849943.7 473184420 849361208.2 850572736.9 857220475.3 882968619.5 960302172 877833832.6 924561851.3 1094208113 1001210851 931283249.5 1343106232 919256791.3 879313304.2 853666529.2 1031387351 1260343915 1134419734 915921518.7 805294318.2 839021604.5 1225187333 1613187837 1132134915 868791023.3 965163650.5 1188684600 927898773 1152838143 917389307.2 996641190.7 1078757800 908173932.6 977554029.5 1126335707 899882851.3 893141028.8 757040015.7 1188784410 1360859613 977631808.9 1096139777 1167080608 859859251.7 1319360498 1278104971 1264328921 1011991246 1048579233 848517043.7 1047301984 1083298536 798010597.1 1004907638 1262463288 857205863.5 860809839.8 853737896.8 33251.55068 49619.45712 38613.63179 37790.60881 182716.9265 DL-α-Aminocaprylic acid 51783.52397 4123993.794 4229838.223 3888601.921 2548044.173 6654888.706 557440.6274 5629572.194 11846965.29 5374285.772 6943695.997 2747547.67 1304124.237 2547156.015 6190566.899 3015040.917 4961658.885 2590751.597 5970013.611 3965381.353 501610.2985 3314489.736 2460524.767 1509980.407 5676540.81 4048408.514 4194486.442 1206724.429 3257109.033 4465105.457 9900432.915 2286065.696 9450463.448 2119513.156 3024935.197 4100532.312 2787096.953 2031300.725 2367942.668 3747779.314 3391004.661 3686299.351 6026520.96 1903388.001 4442142.274 1647469.497 5942705.775 2520234.122 4297519.827 4359354.152 8599763.902 2463345.06 5908081.785 2374566.746 4270243.594 7015349.555 5522703.795 1583913.186 9305927.973 1185538.549 2315718.962 2366748.033 2733456.695 548584.7461 3319124.724 3871318.759 5122111.515 9149207.725 5959591.654 6219736.465 1697435.15 4549164.656 4648279.252 4019868.135 1201993.328 983207.5913 1266674.764 1928620.326 1758484.375 7337567.126 1035792.192 677503.3365 2750817.903 309766.194 6136647.266 11468134.7 4171251.117 228036.4394 27052842.75 2571002.198 2984562.406 2228378.926 2978007.212 4070773.524 4289212.699 54000.3472 50999.51887 3818220.911 3968606.529 7757969.282 6150790.525 9119337.509 17144904.13 2176047.769 2142150.764 3391221.938 4127406.758 4951664.533 3858422.032 2295865.346 2162236.436 6460445.875 3317619.338 11507912.11 4428454.09 5043357.142 4648210.664 2470100.167 3499339.042 3029112.322 5905119.141 1601647.506 3896875.736 1601102.772 2522732.276 7164165.971 5941389.274 765814.5232 8792754.394 4981034.361 4933814.279 2692836.311 4801005.311 4462098.627 12042087.2 12227054.26 6183857.257 1364120.262 4236988.546 4427939.372 914475.5012 5315584.512 14138801.91 5792007.973 6207288.609 5787208.95 3600012.042 2399212.904 3625396.771 4845993.749 3972846.507 7797005.395 4034545.178 3642192.373 7733657.308 6517574.649 1774276.241 7711381.04 7996161.811 1099889.683 6116405.707 11869103.26 3761975.78 6827006.271 3958372.536 6336476.149 3747690.188 3648865.856 4922710.14 4618637.395 5016029.713 55116.88466 47977.79567 51021.39543 46386.50979 50378.89088 Docosahexaenoic acid ethyl ester 54887.16652 14401746.94 12861184.54 24180186.07 5916615.498 14483238.05 4719369.19 194293785.5 12965023.86 1609863.517 33803269.69 22949462.02 10943735.86 9664502.161 6921480.139 80727160.05 29407784.17 54833085.52 8373133.22 13642625.19 33231985.01 8112960.262 8042078.127 12299975.58 18453198.02 12239953.45 24721433.79 2637378.719 21904219.43 15952674.45 29344272.04 14957583.93 20909851.1 2134618.49 16496824.61 2305169.305 3768227.333 15170647.66 6687294.604 5371468.789 14492349.09 14927155.05 8003938.889 39548131.14 39933363.85 11260675.17 1721130.351 33643954.19 11671530.11 24054669.07 12698873.36 11125676.4 25512378.47 19121578.62 8689031.722 29027193.31 24039293.55 6668868.982 39114569.97 5157510.78 6997695.732 27732444.79 17741200.57 2169444.876 15023992.37 26212296.15 4019690.169 2135471.321 13907456.2 25924519.5 6491199.447 13096855.29 26346820.88 78533836.82 12712728.54 10904696.19 18139173.44 25194315.6 16060259.06 6805511.01 10264124.83 16759183.41 21056163.72 831362.3747 508680.5904 4391174.323 2197390.717 6853057.583 187155306 27988219.25 26179835.9 32927607.59 15039688.84 11028199.88 27035737.05 49349.29239 61737.51405 10911759.43 25427629.14 29938081.48 3568857.432 2853628.72 58723053.79 25202665.97 19349831.83 17222318.78 2618870.58 13321688.34 6048934.024 18417554.77 232866.0159 49736749.49 27391430.36 5474117.013 6161697.487 14604053.69 28144833.02 7110070.921 4040979.35 10386822.68 20318520.75 13218408.39 9393803.093 30048056.48 32262519.44 8699306.922 12327635.45 12776040.74 10422775.3 3948404.661 17778166.43 2627272.149 13743500.95 26570459.28 5253599.887 14151372.55 20521506.11 7421142.25 8940810.565 428809.168 7925535.713 2128330.992 11564267.02 20589993.67 80998201.75 50271682.54 19225432.3 187619.8041 6936797.607 13407559.39 22123367.49 12575384.4 4870809.121 16824373.5 13173148.89 19866744.5 15721528.02 20841234.16 32713532.34 490099.873 14464861.72 6388853.057 2197085.773 21209733.74 24722128.46 11460236.21 14534833.5 15240841.12 14488443.45 25487447.42 16831759.81 44250.08096 43086.64113 52066.65366 51980.6427 48574.14892 Dodecenoylcarnitine1 50638.63779 7363044.486 1116880.392 927785.0337 8299923.912 5543526.189 9825202.941 26105026.81 6523359.7 11797815.32 8813550.868 12213531.74 4692379.799 6110210.308 10529924.94 7032618.275 9240351.064 7370614.129 7135292.444 16513628.88 5501781.436 8616592.351 13876199.41 8233522.72 14574665.7 3124707.774 3250882.054 18930732.2 14889141.53 5621647.772 4020554.139 6249401.763 11029648.4 5707455.221 6467265.53 6923743.545 8059399.576 12893066.21 20198447.77 14696758.19 10013084.82 15798674.45 7481694.561 7569762.827 6151576.431 11214962.97 5206172.793 9827918.444 2260654.172 2709757.254 4430301.998 6178625.604 3279093.05 14765860.72 19780337.75 19087212.19 21957598.28 10578137.08 6808172.879 5644109.556 7515910.58 8073595.828 15013681.27 6407787.103 2114986.827 15355784.13 4552517.874 6922688.8 6048020.618 8434501.027 28628113.88 3008349.955 3922916.412 12488091.8 11883532.73 6322662.283 6941050.291 5330798.273 2863147.362 14470045.68 4219201.273 9848920.243 3653141.923 837354.3843 8604893.826 4339589.988 21307337.54 5204340.896 12820200.2 4263683.334 15669555.21 7832996.797 7170501.085 1944777.711 3681423.03 45712.66132 41019.43006 2744530.686 3158501.432 2798352.675 9167200.629 29095557.61 12954169.16 12099935.94 4106714.574 13803032.93 3326240.297 10456516.24 15776381.19 3757018.509 6104254.97 6460010.779 6271891.076 15052411.93 2230235.543 4120908.524 4680659.247 11839353.45 12950706.47 21886510.28 6946570.191 13275312.72 11240515.36 17372139.98 7626219.863 10529695.39 8969456.082 5173884.614 12238232.3 2550893.024 13422006.78 10748034.75 3326764.129 4182093.437 20010253.02 5115787.527 9883860.632 7608569.992 12453605.5 5392599.43 14228240.59 13115532.67 5629720.578 11736644.32 7433663.329 4110240.754 4394818.802 8037606.984 12193468.26 1416898.081 2615727.547 5556085.297 6787099.983 8453283.053 14232715.44 3777298.769 4664268.695 15910689.13 2958275.486 10975318.11 14401867.44 11463048.87 5306474.007 8889277.644 3615265.368 15290057.73 14399086.42 5149149.681 2492996.988 4333285.302 4341760.383 50789.10994 43056.40649 39472.9027 43416.50941 41362.67406 Dodecenoylcarnitine2 3707646.059 1626587.249 1767967.636 1755148.657 1499090.482 1844640.151 1802942.421 1856394.641 1521328.283 1726696.986 1778826.031 2131448.837 1804122.674 1712241.749 1631635.473 1579158.52 2996603.006 1996515.739 1837234.069 1648299 1956532.975 1652930.538 1662352.657 1505287.67 2096499.708 1888076.434 2101348.624 1675536.274 1628078.403 1734201.347 1584156.555 1711541.659 3958536.767 1871407.593 1557189.317 1710993.271 2452573.013 1835805.173 1639820.025 3609006.356 1680970.834 1979268.046 1741763.551 2028555.661 1796289.419 3243881.642 1583479.591 1918545.131 4636576.996 2426486.811 1800892.226 1650551.125 1594654.787 1651589.938 1648580.552 1814570.064 1544663.536 2157117.437 1697739.587 1848109.008 3385559.174 1563704.84 1543112.968 1724784.92 1786158.148 2318778.921 2996854.962 1749645.962 1514991.784 2311579.931 1692934.035 3118720.294 1575292.483 1389381.608 1447865.636 1547223.29 1466895.442 1743769.905 1401423.389 1662059.557 1773562.783 2024064.663 2101310.354 4520719.599 1578580.162 1976501.939 1482286.155 1605628.239 1551213.494 1702094.24 1331150.867 1508125.218 1327671.746 1592371.924 1813645.978 1627028.584 2820241.35 1831962.212 1728391.822 1410445.426 1570553.888 1529093.264 1523116.557 1514125.607 1422979.717 1715516.454 1315891.843 1623075.796 1768921.353 1680973.007 4535370.203 1454055.227 1569236.997 1857317.33 1419210.497 1654772.662 1929083.502 1552665.109 1345920.564 1934073.379 2338145.621 1466670.25 1465890.599 2155131.919 2007844.41 1870445.253 1600238.742 1852031.958 1858250.796 2027794.037 1533276.319 1956381.558 1869654.586 1805138.816 1285488.843 1486413.11 1482405.981 1501923.399 1404040.978 1301329.226 1473745.986 1509395.9 1325627.819 1807707.095 1854041.987 3153224.701 1433930.669 1355229.197 1447857.706 2357109.244 2292213.67 1377307.013 1234221.741 1529937.382 1776222.802 2221770.583 1422026.915 1254430.969 2251365.843 1741911.611 1815613.251 1365913.852 1777999.131 1257416.613 1257125.086 1849635.948 3988488.322 29931282.65 1641998.882 2714476.93 1394890.517 1591761.048 1422075.502 1741810.409 1538710.254 1950938.453 ethylbenzoate 45047.78894 903763.5439 912001.9045 888449.8714 473577.876 1721970.925 867555.2915 803893.032 350484.6669 523548.9423 1362361.958 1059971.775 1169228.384 628782.5666 1161584.639 1420949.59 1829044.499 621067.8476 492840.4987 1761754.439 962294.8599 590880.7275 711020.1733 1593539.223 633673.6292 1290749.196 995713.1031 588583.1802 1121024.809 1173788.7 695903.6664 1187017.72 711016.5511 1318548.829 1557007.371 1373207.559 839917.7605 1334532.205 1489288.28 956927.0419 462737.7719 1594716.696 935191.2303 2117109.593 1496303.941 1071657.194 667728.1598 889310.4948 1268337.038 925785.5918 2023149.584 647679.4234 698254.8898 859985.4209 377913.776 1750486.039 1368401.743 2150920.126 3300366.108 1649423.921 927472.6778 705619.1433 1589307.249 878623.9948 501309.5467 277929.1897 952445.1821 841389.8697 888810.2268 1361679.82 1965240.012 828002.2326 1095227.735 2610184.963 404892.9366 517248.9868 986083.6004 1590348.295 1233532.633 1147368.713 1389337.866 2027642.615 2318730.282 490458.2251 870930.5768 840314.0008 502124.1611 427560.8891 2349944.308 1033899.323 597035.1917 1377670.123 862854.2459 1055865.827 961474.1279 40665.67366 45949.98119 791566.1332 1144016.712 1872536.732 1007563.19 777514.5577 1678962.654 836834.7711 1465697.464 1172362.251 793363.7492 1085196.153 1043746.096 1127309.844 1008814.557 778696.4231 533937.7761 601002.3598 600444.9945 1234633.887 1116813.377 331437.6659 591664.6588 487008.6401 2372243.546 1014137.802 330081.6084 765640.8794 931485.4046 312206.7234 584658.7314 1033268.97 755684.1933 678175.5364 1527120.688 495039.2011 781730.8588 1025937.428 1627963.653 833997.3998 1015943.85 496817.3228 1320961.036 1123663.532 750228.6415 329000.0307 1085688.739 1041570.656 442067.4031 903091.3379 2154424.343 921536.6146 483099.8278 1347234.209 1414311.644 1397949.591 1274033.566 905727.8869 286648.4029 1454971.157 944760.7728 1466059.518 1390510.194 1282270.197 768089.8654 1495748.462 1053511.544 1934407.625 806408.0003 1074711.304 686827.4261 1067856.001 1252965.398 1041822.248 1082285.255 234244.5412 37273.83563 221599.5432 42708.91785 36795.95448 F1839-B 93124.23541 3519654.491 4388683.921 1630698.848 1787902.344 916670.3178 5693852.793 21163078.77 1972881.632 16702766.08 3374970.901 917204.2088 348861.0404 3893270.575 5479671.862 580909.5837 1888861.888 10632619.06 9972938.335 6748942.49 1611021.451 1799391.254 2144205.604 2712097.901 2889457.998 964428.749 2571343.991 21836595.15 4383211.37 1442189.396 990421.2852 1659192.928 1413661.934 4101324.843 3434446.615 1602940.251 3285808.78 2638946.16 20395352.16 394336.7424 22518009.87 29817303.64 2274078.042 4484445.397 3757525.926 1676882.526 2910996.298 1497781.995 3447127.792 406504.5407 1424998.008 1701720.011 1044265.739 1130393.528 3279342.369 4755427.36 1806362.648 13891405.09 2695802.74 1217604.974 469636.3896 1600281.449 596160.719 1628292.353 2995707.777 576028.989 1129141.003 3443557.249 458571.7844 2197177.788 19776424.85 4130784.659 2879706.011 1800843.163 30470026.71 4804316.796 4078725.956 2437369.487 1050968.328 7475170.026 6684935.129 6396410.596 680821.1049 400561.2968 8277951.218 3441062.228 40023626.15 4871300.867 1433297.825 1533906.265 7214796.29 2557113.45 6929746.11 3836995.548 4416471.008 89878.08406 64665.92776 3019671.362 3954170.612 5710457.54 1041984.137 1171042.069 1121891.338 41108514.19 970126.9869 5106511.522 1263274.517 1287077.405 808180.9677 3666790.023 2741642.625 2235260.262 5249571.376 1108001.817 1208677.149 4064198.53 4299524.345 1339083.772 2086199.868 334007.2526 3999619.974 8220924.491 8550187.698 99040453.42 450356.1007 1561228.346 1408116.077 4932955.135 1423860.059 1030828.242 1164974.356 620356.5105 3454483.997 2905052.13 534121.5698 8237694.863 495792.2351 8140045.465 3652413.375 770415.1476 7515505.68 2486774.74 2543809.157 1025392.825 2961987.512 2199189.325 2355369.687 1999037.337 2809597.253 4610405.068 2912393.87 3004886.735 766312.5862 1442618.502 1974323.759 1341559.131 815618.4091 908907.0819 1876519.439 18612252.44 1150237.468 1600113.467 1855084.026 1619615.701 5688119.142 23199442 2059624.37 761452.5813 4319220.792 2864684.902 3617263.637 64566.80573 65171.13275 68573.03575 72170.03153 68810.6938 gamma-Glutamylleucine 50567.56024 173609.171 183515.0331 152058.3544 55822.79508 285649.3686 147782.3927 273618.4671 58365.87917 61334.27808 449019.5129 60322.10517 60683.06347 59270.63554 853438.1256 155584.0719 67666.25962 274736.7684 327514.6651 85531.06746 66450.01272 1306081.991 424618.8905 92016.48175 706550.9744 1442084.762 144046.2342 733576.676 60978.80056 332057.7534 335133.6449 332912.8352 600951.4806 68103.96873 79561.64681 418463.2047 214573.5063 65221.54963 602915.2462 79057.37381 493070.0539 270267.3744 663799.796 373574.4792 264669.1889 350246.3038 844160.1428 444442.1305 244221.9358 217454.8606 80095.02179 135255.4743 249579.1644 2971237.163 652041.619 889747.9475 716475.8771 420337.2023 9906373.95 877013.4064 1533151.677 2717197.584 1177060.336 343404.1721 113763.9357 78716.62348 433477.1922 1735637.466 575589.3404 2925813.944 177240.2649 952068.9839 1090531.74 1769771.663 2106573.043 2350425.19 542884.9537 4680830.09 161479.9904 844940.1612 3544425.926 802380.9602 1654354.833 1091872.899 1893020.713 1218794.861 2818835.689 672464.2775 4006537.878 919612.9591 2001373.333 2276775.555 311472.1629 1034716.564 1133526.052 47670.9419 51130.60034 1008042.11 1267926.86 2558855.985 244910.2456 1241524.218 176886.7187 499669.9479 3852866.997 805755.2464 5482063.633 9991721.307 3855870.717 1411869.856 1229091.215 2088657.182 372645.0084 708716.4998 1378489.879 935457.2324 1185482.776 380672.0537 6710373.254 729942.6574 2270186.699 735670.0325 903484.0209 467373.6704 321680.1938 1681124.834 270306.8313 199599.0724 12964979.41 2906263.97 509346.8038 515641.4371 1142175.308 1200422.055 10961994.77 71404.32948 664204.4192 9281355.582 550139.5192 1437512.964 389702.6248 723450.4149 9585756.279 1023712.912 2600100.603 2779654.492 2874485.437 1207611.673 1297028.529 1083940.743 845112.9847 75962.47816 450583.0535 769421.9884 4235589.861 2810846.209 281647.1596 1061421.939 2523204.694 741105.3832 296272.1708 1938478.583 517450.7748 1594766.142 5331330.469 1290296.43 272837.4969 325547.2951 802051.8845 720106.6952 1434624.321 43114.80828 44008.88906 51776.85974 46097.67339 47753.98567 Geumsanol C 68152.74719 5243634.628 3808953.003 5518174.303 2116567.701 1051731.361 1847912.439 144915348.8 10024366.54 696500.7101 20000950.27 2207670.271 1084349.202 1366471.585 885980.1522 40140614.64 4431934.092 18312595.37 1868260.437 1498025.683 36415250.56 2488776.645 692012.9949 1725583.686 1655359.855 3467682.61 5538758.67 1157221.184 5448879.315 3616886.844 15959295.99 5119696.013 11439297.98 3812889.264 3102210.91 3999834.927 6127997.332 1102622.148 302504.002 4660510.969 2973995.702 12294965.27 13118432.03 13068230.61 16264505.66 6435996.376 3130772.186 11907505.56 3941712.021 6357304.891 2406738.694 13136578.47 2286351.405 19361586.85 1517745.353 1248397.3 204042.3066 336571.6934 31643464.18 4422358.381 1869221.994 3261744.544 25730830.98 4461082.431 1719753.503 22339151.18 593488.3853 5285961.764 10522226.61 11254784.46 1780714.206 4234914.629 7746193.772 65618477.69 1947861.261 1121185.863 1517807.633 1355198.73 11935964.29 3240436.196 18658738.53 3859249.207 5151860.475 543705.9303 7767856.474 1025379.776 1197734.594 1554184.321 212307939.8 20474841.17 58553290.03 8598760.901 2923165.123 3662067.443 6185039.522 76694.59601 93879.94015 3219379.609 5665586.953 1447625.29 482549.3936 3484438.317 557830.6196 973783.8033 946589.7131 30474427.19 521319.8469 536825.5943 207068.4965 1939454.321 31401681.9 29827067.38 5955574.736 1433167.527 945836.8924 3259312.898 6276706.126 44873522.29 441756.4416 1292721.651 3934948.758 692908.5819 1063632.446 1565874.469 905726.0271 177647.0118 1103740.111 1249294.075 1108577.473 189937.9369 2489549.939 685060.5541 3676048.194 7163248.107 1981166.41 4280148.29 25462309.7 6351763.254 945689.7961 3362918.223 4896716.065 14720474.68 1468737.798 48349728.43 31668869.28 92038077.87 1972935.838 1833438.706 2008156.692 4641008.887 6732936.865 2026310.715 2433787.408 290228.5958 3805734.903 2604477.978 949609.2966 1040823.007 12077707.26 3227297.508 26919775.76 3873122.636 9018195.828 3729344.755 6746012.991 1409004.803 310478.5295 3177734.302 3809220.5 6673453.481 6637511.502 64733.99342 61470.06061 55396.84414 70741.05954 66388.98026 glutaramic acid 522835.9231 7653742.558 64120912.44 15149625.33 8133896.741 8864740.336 7058374.975 10100703.92 8137719.472 10041967.47 13729243.84 9463207.672 10002362.78 17320046.6 9907642.087 9866540.336 9641655.07 11064323.69 8675927.465 10803420.86 34077959.25 9526342.627 9159945.319 10175119.75 7637164.123 59049355 56626767.22 8264277.72 10129137.74 9306852.418 11084800.02 9465839.431 9928875.761 12984109.55 10075096.45 9425910.26 9514634.116 10275815.5 7747797.833 8200871.321 8337616.156 9522579.823 10730820.77 11137860.91 9804826.289 8917518.091 9074252.203 8266328.332 55683711.39 34762031.6 9337679.346 9372711.051 7181215.437 9014204.273 9472250.098 12066922.66 11974658.28 8157197.037 6778527.146 11182246.78 8183740.373 4399939.34 9954529.122 11935535.41 7201604.715 8305280.923 9504646.647 7101491.567 7295054.464 9377260.871 11403440.32 43473893.9 47116242.98 6986193.308 8209160.701 5040573.117 7850653.132 5519868.097 9234822.601 7564611.14 9729643.64 22791942.74 10107021.31 7940583.63 7699130.555 5983997.09 5941134.159 8264398.747 6202301.993 13872210.09 822650.4544 5103186.246 4654474.313 12144026.64 47672917.75 638420.0573 882019.7048 44967796.36 45759547.55 8006702.941 7345762.506 7287136.088 13792674.4 9041838.46 8724345.213 7851633.737 9671106.414 8532980.383 6254359.93 8235796.647 7880167.246 11232837.53 9882201.5 7632841.173 8755536.678 30928174.53 44502277.74 4751884.882 8502188.031 8116070.861 11232568.15 8602703.697 8481567.39 7023133.99 9574056.486 6772316.544 8902501.447 7006066.795 7953392.854 9186959.566 8809132.567 6460515.743 41741292.69 45107532.57 10350933.41 11055116.36 10631743.17 7970840.975 9286940.527 6348505.996 8357183.924 9712499.704 7690505.104 8917576.203 9042233.409 10815705.25 12740772.26 7660237.139 7287739.93 52168686.4 44395139.84 4897545.521 5520858.205 10464875.49 8767260.117 354350.1075 7795278.143 10947113.45 8765249.412 9639001.207 9715724.26 8796309.455 9060593.512 8117450.362 7619377.2 6980710.593 8193090.889 4370341.199 46279483.48 25328266.9 5276829.331 1299284.883 236828.8964 488085.1134 200375.4599 577043.2972 Glycochenodeoxycholic acid1 59525.37689 18603727.13 31403003.75 31518090.18 3977359.181 7086593.6 2322107.247 28631039.23 3224107.002 3614981.053 8249153.597 4305298.719 2829053.951 8135727.033 4122932.593 6822863.725 21233625.73 5912048.366 10337320.85 5838007.817 8060652.145 36591340.37 15127722.25 10937280.07 5208179.751 27863605.56 31371100.15 4372926.955 7352146.627 4488602.97 7010952.376 1809264.482 12370258.29 100160099.7 3789092.425 7483989.249 12480248.6 4315415.039 1289453.067 7490645.381 2757329.291 32739382.66 2719729.114 19597881.68 8257019.532 8568227.126 7522062.44 5843603.311 28992666.17 34616406.14 16725112.36 28788164.4 5604139.704 24190577.47 12780450.83 8125840.79 7215963.629 4175935.044 33610140.5 7866901.849 1814561.709 5858815.717 24394384.82 4670526.495 48651398.29 10228312.61 3445965.222 26076274.74 4288340.853 7368383.744 12592832.22 29839542.06 34751680.74 9354913.932 4066648.684 72313984.38 10962043.13 12568927.08 12488096.08 123596231.6 41011859.51 4827906.713 1727437.176 12705840.23 16999521.18 12464928.33 3873280.46 16626439.07 13966682.47 16608402.48 35609005.26 25711168.51 2052778.389 27557447.7 33397134.37 51077.79472 45270.53307 26799020.34 28605011.07 2331597.859 1801533.995 1946537.362 3917061.38 13221250.05 1555187.23 39033864.28 1071211.933 1838936.704 2780177.921 6539442.857 16385416.1 5582960.63 69816731.8 24737797.68 818974.7405 32465572.51 35681766.11 22817966.12 3637976.889 1122011.03 3111226.81 4978867.852 6480166.953 47369205.11 2829036.401 1551433.62 8122004.642 12390228.61 2324479.786 2334951.789 4730597.25 546215.7677 28764502.46 34761436.11 1761263.625 23634440.79 2776142.846 2114924.494 9808599.683 18151889.12 18007933.39 7919182.488 2843602.874 37977552.44 9979909.26 5646941.757 8325532.553 7591624.971 388968.8989 32353026.59 30401381.41 23541602.61 3010427.069 3105251.211 22017422.57 17331243.39 21035676.3 3511369.938 20988743.87 62325400.82 3351583.66 13190850.15 1719729.686 3660756.505 11603945.38 300380.3307 6889020.773 9343545.689 30785972.12 34384117.57 18559433.57 48348.44074 53497.83761 43555.13048 50162.6328 38976.20591 Glycochenodeoxycholic acid2 46849.26995 13174973.55 18448370.32 30056664.18 2469949.671 4110878.053 1436327.194 72680885.35 1241457.727 1468286.912 10356299.31 4711665.144 1526536.209 12010892.68 2343494.046 9329115.579 26782464.83 12340520 6599837.473 5567292.02 9077443.165 35373244.19 25044377.17 10058211.25 9582687.193 17941088.1 33499528.24 1363773.466 3167425.825 6186717.444 6899049.702 2724706.028 9118219.92 34654824.53 5544490.238 1090338.664 2402721.742 3426575.035 2478876.234 3212253.18 7640867.041 31501608.38 1802020.328 39586662 6009410.332 7656895.211 3347585.579 3700370.306 18466417.61 34403715.55 15539531.4 15788365.2 7322845.191 13440976.92 7365177.429 8177827.087 7369400.551 5635110.028 20767552.88 4522827.836 1579717.735 3070344.883 9655954.105 256822.9235 34120080.19 5525047.224 2358968.496 900364.1003 3623654.919 6346829.705 8668707.393 19208813.51 35376228.23 11280415.86 2612383.676 40512338.08 6441227.536 16901583.05 3261063.627 48312513.14 7678518.439 11508324.72 1948726.056 5336196.713 385688.8184 5344214.747 871051.4685 5165619.779 7179871.902 5782841.613 11027954.36 47450954.16 1967492.551 17162582.12 34601426.46 46872.24413 44651.65319 17247992.73 32417008.57 8174873.524 1004038.994 1588901.188 5929800.096 18658356.59 3589985.997 14999974.72 698816.6579 3808288.033 1570416.852 8999224.772 102510.565 8254756.152 75790022.47 9259617.242 1650138.935 20985284.06 36687380.68 4890585.71 2960153.269 843684.907 3733247.688 9544586.266 10451732.58 40040381.48 3045154.309 2172862.946 8462199.54 10598610.99 3672001.703 1681720.524 5485592.487 568425.3619 18807555.2 34037155.16 1894530.958 9681392.471 2012458.265 1161518.181 8846166.37 2336697.048 7302370.11 1343739.849 5891085.101 29249382.7 22049114.8 2363458.729 7875082.654 693612.2696 589097.7309 20446455.88 31103325.88 6750007.321 1969143.702 2466242.477 26327994.08 20260034.38 28079607.49 3168024.454 29190072.06 226409.2285 1064808.455 7852504.71 371835.7612 8782410.777 6706093.356 3372396.777 7191738.286 11324363.93 19893898.25 35133695.39 14128287.32 41395.20001 43600.23256 42117.98902 47086.15549 46901.82436 Glycocholic Acid 75208.98935 5827135.148 10606489.51 12415742.68 2952031.076 3817894.357 591083.6158 32895246.53 1068382.655 2005726.083 4180167.742 4524926.991 3505298.63 4616163.048 544207.0944 1707672.81 11532212.43 8933200.771 2405274.028 2249860.263 4390452.491 14227504.72 7711863.487 4033718.085 1238242.797 9914741.293 13310388.46 2612711.579 4045464.509 642423.3995 4510142.158 641328.8613 5565071.77 86098964.17 2334827.078 4608344.699 3607936.514 2598831.64 618194.2014 1020246.104 3187637.114 19424702.17 3455831.405 5433576.254 3294811.237 7348417.587 6292950.855 1352151.828 10465726.58 14309978.5 6338214.714 17032740.14 2770020.025 6318328.132 5140181.127 4805998.078 4335552.601 1114717.285 9235076.778 4881157.708 981009.541 3172456.812 4656983.545 2891275.62 18656217.67 1931039.752 805194.8935 9910885.801 769375.6931 3640548.765 2204478.89 10691353.06 14057659.8 2637971.298 1193526.234 49682489.18 5341988.471 4385279.672 11716809.94 64020678.77 12454549.22 4582088.507 974844.0352 7479102.943 14300528.06 2418465.562 1459713.844 8858206.815 3209972.566 6948573.878 9056231.349 15491059.16 1004864.97 9763625.231 13085326.09 81839.24893 52436.6323 9249118.002 12708768.22 1989405.041 827209.591 494315.7717 2261851.274 4316573.621 1415939.073 18441995.4 242414.6625 1219533.787 1657962.352 1650956.447 3285778.185 5473295.125 16053895.96 7815088.799 336290.0919 11267421.09 14534545.48 11812339.72 1231914.202 1420344.003 594113.6894 2092440.122 2388396.698 24063501.49 1097070.883 339482.6354 4271711.789 5530092.724 1462599.454 1664462.673 1987588.166 528188.8566 10630613.74 13813556.94 998722.9802 11842706.6 2413402.872 969863.158 9333759.074 11017735.69 3476826.96 4388161.775 1280294.56 14211708.76 4476697.008 1711619.18 4622025.614 8745318.495 221040.5414 12309483.98 12391028.29 7118459.663 2330397.852 389528.4686 9681814.697 29738592.81 11023775.62 1463475.534 11694231.55 5745760.909 1080326.939 3585260.636 940324.3912 6029603.319 5431482.262 987223.7707 1014443.781 6956756.279 11192620.69 13934958.67 5894625.502 64675.1756 68340.18989 63910.23286 58695.03655 55166.87674 Hexadecanamide 28558.21464 149958.9642 105276.6274 59008.68894 280498.1919 212800.7823 194201.6666 559378.5706 180271.0167 456756.7114 215806.853 357529.9761 444194.5769 361252.8808 964377.0221 150880.275 119953.3127 302560.0629 234955.7096 468878.9999 411986.801 240164.7055 430072.8747 401888.7939 579142.7714 74793.62856 80511.23703 1485200.18 350585.9144 277136.6191 145116.2566 288711.1815 256595.264 324131.0683 270969.0073 282904.0014 529359.4055 289541.0869 345475.8124 800306.9932 507721.2871 295895.8715 282762.2822 219564.2216 151912.0544 230985.9129 312259.704 142451.4246 83760.90214 105412.4533 275754.8598 100147.9529 159255.431 568904.6017 370463.905 366474.6667 381792.486 312903.0992 345793.7896 193249.8239 559686.5781 722350.6923 586817.7776 338348.8121 98813.98434 430395.4681 159043.6045 297788.9461 830706.7609 127781.4481 588428.4043 97775.48495 66686.19572 464358.8068 103989.6916 256659.8478 499438.9259 68687.2098 198392.8179 366008.4054 225931.9003 342159.2347 146637.363 82591.83247 139294.1142 388328.7533 374027.3358 432239.7589 428704.466 230977.0315 429253.1218 226953.4151 137000.1685 41532.9898 60357.33136 25127.39075 24869.95302 71671.26545 75569.25069 137611.6628 306196.8301 538615.6677 223449.8773 432697.1673 115164.831 347247.982 213137.5929 232286.726 275318.9678 432149.8742 332555.2966 266286.9245 428750.0443 342568.4817 85549.17182 83946.34614 109179.975 302950.6055 243916.9915 506129.92 258474.2447 613587.7471 558642.2654 578918.0912 135541.1675 231801.5993 146456.9326 735133.7971 389428.2876 149297.5306 450677.4681 337554.5833 85969.64566 81580.46961 255652.6205 168614.5471 227662.0315 257712.2464 674018.8942 162818.9676 677387.8792 270044.0023 265762.3399 303676.9705 320980.5492 201805.5412 165032.3195 400443.9448 340621.6892 118762.4714 105139.067 379407.2077 339294.6532 211321.4015 659622.29 145336.2147 138096.5346 363793.1486 160858.7038 1089339.538 720699.3698 278746.435 307493.8391 890778.6098 306231.7292 259192.6497 755795.0274 286780.2987 106949.3655 108444.1514 163447.75 26203.68278 31097.16475 28018.60012 25595.8664 28505.83593 Hexanoylcarnitine 96368.56633 5846186.948 3665080.688 4270230.039 9720699.108 9497151.97 8309720.315 18549022.26 8102721.746 9298677.069 11462404.45 19415236.58 15734176.51 10167024.07 24689427.25 6758476.359 9652637.258 13023617.32 13865221.3 16882548.1 13345886.22 10667113.6 13657298.62 16042234.39 13547747.72 3491125.004 4448486.767 48085973.32 9641284.869 19631039.18 5650044.884 12443220.59 8457023.797 9987118.5 11637520.33 6940902.09 16020062.04 10412854.32 13942724.86 22447222.5 4898036.716 7090768.7 9422726.925 9871934.941 8001705.067 11194206.14 10812490.54 3606803.515 3532752.702 4589788.87 7305441.875 4667031.337 8763585.687 20264475.42 13178606.26 18193924.84 19986353.08 17968697.57 9819942.975 7790526.856 19611701.23 24153641.51 19749918.92 13415326 5278306.43 18955221.41 13799422.55 14351195.71 19447398.84 8346492.855 30134716.14 3468306.184 4466278.94 11069580.46 7196574.984 7581997.707 11614507.11 3875617.324 9675499.311 9260430.4 10378084.68 7494859.99 6319842.083 5485696.573 3602381.368 12933086.15 11877662.33 16811925.79 11568379.86 4311266.916 9843690.431 7425742.035 7732542.073 3209223.906 4288361.215 98882.91108 96773.46863 3221482.275 4145529.599 5660296.879 7998716.398 25781758.4 7652156.026 10200932.61 4606782.099 14792113.31 7504897.898 9481092.507 7799808.825 13587472.76 11453379.02 5665031.791 13754832.79 9366822.183 3296775.683 4321374.886 4825612.537 9393879.256 5591910.555 16803504.04 11095960.43 18226082.48 14128801.48 14473452.25 6070100.064 12097735.51 4306882.44 20942141.48 11218880.73 4181611.963 14066137.84 10218395.19 3823403.787 4730968.312 7019277.943 3052179.389 6311013.827 10312298.14 13412548.07 4038784.097 22824162.51 7457421.158 12081353.89 10824363.95 12066213.66 7284334.877 5665521.115 14112521.43 18698141.25 4495079.257 4387567.422 10846303.11 14359075.15 10785992.8 28319466.32 4005291.61 8373623.735 8437762.91 5080357.556 29006918.47 28122427.83 5839711.23 12038931.84 16757933.86 8449159.635 15788782.15 20136935.38 11346268.45 4101838.618 5005119.953 6790270.396 95988.72753 89038.48236 96285.17421 87312.86126 88800.69148 Hippuric acid 641306.7989 9474587.892 9697784.334 17576010.45 18496408.62 7087789.69 1864613.134 18845688.34 9436589.309 7709936.46 28505188.97 7352072.857 7647050.044 1671672.571 10407929.15 8719057.728 13995726.64 19209695.88 15951263.34 10375315.7 27037741.87 11047620.31 18124749.85 10034758.39 27761033.88 8283351.676 18013238.56 1613026.572 7700983.644 21139276.76 9065388.857 4134346.478 15980038.05 7829985.41 16628422.06 1697735.724 10509483.04 40665208.91 4791509.636 26911806.24 2688212.596 7348878.867 2975322.094 6355647.628 2525138.389 77247982.73 6712340.39 6431297.907 8875564.223 9312628.792 2950679.086 17976757.47 1376433.997 30921504.9 8771453.731 6499175.383 12667192.54 5631897.855 19482264.25 3071833.983 9086221.888 1893536.521 15432784.69 4162750.496 26202222.93 24174966.47 2325118.557 48031035.08 3901005.358 7261497.987 6840642.445 17310726.3 12525599.59 6846410.561 17095413.83 8542813.683 3612463.671 6549164.988 2320268.631 2673749.827 21280262.87 9775157.913 5629813.583 33168821.81 3285228.803 7897911.31 7597061.97 8715302.605 8649743.844 2954264.282 7143734.928 4544425.816 1988523.409 16864675.95 32365482.62 93419.22545 570297.1357 8310645.736 18722398.74 10495950.46 562250.3409 1373947.163 5809350.043 7928559.026 10453069.23 3438181.786 16484485.08 45571343.73 3798261.014 51537910.8 14518494.92 53725861.19 11701507.27 6140898.871 48727883.98 17797005.66 33786044.87 16597961.22 17308670.54 6241383.265 5546543.163 2926264.32 10473856.04 4665670.686 12704114.35 15163976.22 4903263.991 9619132.116 39445125.51 44692522.49 33403384.46 14799677.7 10082465.84 19207431.56 2224225.156 27656689.16 14030550.26 18259390.77 8630452.751 8236827.671 9590128.259 8443033.836 4271096.477 7716450.835 9770292.021 13082476.1 18737337.74 2675952.377 5171902.733 19847255.78 34891811.06 47787548.46 8553646.061 20058559.11 136305682.6 7198823.965 4619647.746 17579365.63 51547145.83 6403844.627 32144547.71 74501000.19 3010827.19 15683217.41 6338904.983 9797522.635 5560780.338 24579275.99 10346030.62 19440897.2 10784287.16 407941.3031 283821.7111 169188.1648 104576.4007 101338.6805 Hypoxanthine 809395.1563 4578513.019 5444554.098 11960116.92 102921217.7 46937270.05 36375787.24 25890152.7 63429223.62 69206364.03 58473765.81 44025411.19 35325573.96 93448341.63 70075528.86 38174390.19 94913482.41 11370464.34 30348558.89 72285944.18 35717370.59 15808273.14 84476177.45 7707541.861 35502673.5 10468946.18 10256110.56 102728522.7 52509889.14 11456079.35 24512544.97 83845430.99 71700643.07 27192876.99 118500095.1 104929804.7 71519356.11 34436401.61 24396274.64 44280357.94 8554775.337 18787013.57 117062846.5 49454607.23 10359912.74 17062540.81 53628182.6 24954186.87 354088.0673 9330154.186 32072123.86 186935908 9599526.748 17719172.64 9630513.087 128000058.5 93074966.64 33146530.36 19093873.77 37533626.54 21536114.15 29251475.92 65708972.98 10533767.94 50071084.87 91595459.81 33973602.84 16746782.45 39393508.03 90555501.43 59766948.97 6603641.445 9031917.078 31639769.67 44020346.81 29489030.09 67823045.78 14924389.75 11289510.11 92687951.53 49207222.76 40499413.67 9425650.859 91763169.44 31152493.04 9236410.764 42467839.68 31394738.28 46443555.87 25226630.36 140881797.8 66593285.72 31194422.2 6199497.48 10085767.19 1549500.425 321328.7148 8072988.466 9710561.086 86263074.23 70285358.14 40385225.41 10978429.64 19615769.14 41274229.2 125882506.9 50607992.58 114898303.2 10610844.13 40762980.09 94917227.6 27142099.19 42667005.71 57301256.03 133358022.5 7969994.053 9669653.165 67587329.91 9363883.511 105458260.9 10061303.51 65076573.31 30707720.91 124013908.1 27458985.47 17260950.32 16446860.09 62719433.27 68595791.45 68760983.63 13951027.31 11534890.74 7625696.883 10562616.53 25268137.99 174420959.3 9784526.631 190669678.5 82872089.83 17138957.44 12406357.72 50221873.83 21406537.06 9063039.529 47387991.08 59132793.32 27921428.98 72357428.99 42097769.26 10185373.17 10535876.25 46231946.01 25817862.49 27557472.14 60088206.05 26715552.93 27470801.33 54528431.82 66593876.76 18527367.58 153572338.3 38959837.24 8357474.778 62422828.43 81461016.65 59379658.97 10525426.78 81486603.2 9900942.078 9596713.812 617951.065 1369086.998 151696.8324 1627378.51 935711.0038 1057393.609 I-Urobilin 32098.41000 974808.80000 605884.80000 1044461.00000 1012380.00000 1904418.00000 638811.20000 15360761.00000 795896.80000 768039.40000 137215.20000 4209690.00000 112862.60000 2627604.00000 303144.00000 480000.60000 35201.17000 427012.10000 1058413.00000 981458.90000 131769.70000 104159.00000 31314.87000 30774.84000 75659.02000 558423.60000 1136401.00000 914576.80000 4497289.00000 228913.10000 140495.50000 27684.75000 395946.00000 812981.40000 318164.50000 582636.20000 477003.70000 1964838.00000 401315.10000 382922.00000 31423.12000 12805050.00000 1781132.00000 429529.40000 1530027.00000 1067445.00000 132833.10000 1759803.00000 643641.10000 1335625.00000 329885.50000 5098391.00000 3269747.00000 466323.40000 1461050.00000 1607885.00000 1308437.00000 715101.90000 687723.40000 52427.00000 339344.90000 1606898.00000 685924.00000 1720693.00000 33135.52000 3747890.00000 719084.70000 668003.90000 283617.70000 713345.10000 3005065.00000 704674.50000 1419706.00000 222036.10000 154803.30000 31088.98000 70674.84000 169478.80000 576482.50000 1113461.00000 167837.60000 427128.90000 474109.20000 496800.70000 968124.50000 658616.00000 220490.30000 33845.53000 2183806.00000 2807097.00000 16985711.00000 2242043.00000 247400.70000 692371.50000 1482871.00000 26297.68000 25606.65000 650508.10000 1279351.00000 62697.22000 26967.64000 3280354.00000 567311.80000 33665.08000 31750.71000 10360987.00000 27957.64000 71098.76000 1061145.00000 108351.50000 262064.40000 734773.40000 983435.80000 2770450.00000 351470.40000 927576.00000 1943212.00000 637070.30000 42208.67000 1165441.00000 254956.40000 28579.18000 489591.20000 1037195.00000 161884.10000 30337.73000 571540.80000 1252962.00000 432035.70000 33024.38000 808741.20000 844282.00000 745999.00000 1485869.00000 238459.90000 417582.90000 462083.90000 589740.90000 31358.94000 120468.30000 1277358.00000 151964.40000 29715.44000 118120.00000 530551.80000 247786.30000 859377.30000 84575.48000 30705.66000 773709.40000 1267211.00000 79546.36000 34568.67000 97397.84000 101329.60000 82386.90000 869877.30000 170864.00000 208075.70000 1210621.00000 5777223.00000 244770.20000 2296625.00000 35637.92000 525984.50000 110899.10000 1664863.00000 303323.40000 961397.40000 1862329.00000 1908222.00000 30881.18000 31015.03000 27657.59000 29186.53000 28171.96000 Indole 624049.9015 18021523.49 18443706.43 17449763.02 26108453.52 14975132.42 13644642.12 15571193.9 18945008.13 15631174.03 23148310.2 20818621.65 25789897.93 37007316.1 19297221.77 22488624.41 15039423.77 20406302.37 11566204.44 22199272.99 25519122.99 23176027.39 27135745.13 23220984.81 23326223.7 18190962.71 18741820.41 18982256.35 14501477.13 20476969.97 32371919.19 22513061.46 22797874.08 23575011.8 26953217.17 31939488 18249870.44 18846627.68 19958789.16 22654426.63 24876383.74 17546975.24 21635646.63 26425994.33 20943947.97 32431985.98 22429442.09 25077582.76 19219066.91 19956396.86 25227526.06 19526262.34 23612453.41 20849930.22 18211502.89 24903131.25 24099579.08 15737418.94 26787365.89 49319988.86 25375968.76 25172401.01 20017019.14 20638203.35 21954354.43 18266768.28 21105981.56 21372242.58 24126938.85 26548917.28 17912460.12 18212658.73 19223810.23 29245227.6 14793237.56 23731738.42 31063061.26 18269277.48 27050021.25 21571594.66 16122365.39 24029050.17 20653304.4 26487308.33 25417616.9 16038561.93 18247397.81 20049932.59 21046603.78 26542399.86 15761341.29 32147409.25 15456746.73 17682252.96 18059780.9 603226.3367 593533.2034 16689135.6 17487872.09 21398270.12 21639445.91 24818029.43 20123004.21 21708989.95 24550025.68 15607826.14 23038029.82 25487840.67 17660951.94 13724757.4 26781156.54 24303863.1 19467274.1 10827788.4 20272830.37 19198449.08 19760726.9 21773311.82 21105476.86 20736004.2 20905794.7 25278699.17 23835276.41 21482627.78 31249120.67 21198021.48 20462491.14 20509210.9 23804828.3 29615808.65 26813069.73 21095587.29 18749038.75 19127043.31 28396957.51 38862498.78 25771937.19 20106893.29 22234655.74 26945767.44 21625772.27 25997584.13 21396784.11 22814262.56 25279617.75 21237426.61 23850571.52 26570925.44 20696928.56 20876059.93 18540083.93 27934883.69 32202707.02 22531708.46 26215369.9 27080294.82 19844406.98 30811249.92 29941817.08 30396557.31 24434073.07 24856495.37 20188257.27 24403236.88 24703445.49 19181632.06 23934627.24 30933550.79 20209991.8 20743788.66 20104920.73 2456319.087 605877.6556 564964.3615 514628.9822 517114.6106 Indole-3-lactic acid 40810.21041 2852781.974 3193759.881 3085298.267 2463324.523 3155382.664 898428.4726 1877666.153 1061777.504 1224857.229 3676954.078 2071655.1 2664854.253 2900633.368 2491651.175 2830355.666 1275466.685 3419335.555 785475.2784 2312257.698 2916168.653 2186499.276 3536133.095 2228460.348 3317838.218 2917535.302 3222522.237 1646787.463 1324794.159 3437111.573 5483817.061 2260222.138 1922653.27 4371907.763 3916480.183 3936934.302 1831390.992 1510406.952 2061650.435 1581007.321 2763226.349 1644819.2 2391719.069 2792962.032 1640748.295 5760790.811 1943760.532 2421892.341 3056314.733 3315339.392 2356724.006 3127234.926 1451133.59 2729908.491 1263673.401 2568450.727 3158469.502 3402525.28 2595115.962 12342118.98 5042308.661 2784341.993 3595893.379 946495.8086 1738245.945 1046197.066 1386132.795 5348987.189 1875571.264 1711177.865 2428728.843 2961926.103 3332774.156 3306757.43 1266611.048 2742804.112 3799662.521 1497772.88 3894608.73 2137445.153 1046282.712 3241588.206 1972399.219 4243246.061 3567914.092 1079475.712 1732272.166 1996282.214 2102251.895 4294364.866 2610996.234 4439911.442 1071155.336 2750742.056 3271823.724 40397.30283 40864.34206 2843713.286 3253417.109 2191583.74 1422817.063 2730864.424 3485842.396 1664842.985 5155245.918 1270822.597 1632833.078 1795185.967 2208498.469 1121790.9 2200557.204 5085631.065 1727608.819 1209638.727 3325424.958 3432181.365 3730890.182 2234292.554 1947492.388 1424843.304 2798055.812 2643220.188 3437170.413 1988898.39 5568464.867 5470329.544 2566406.944 2454640.971 2732038.878 2182671.153 2401603.803 1143371.256 3333816.682 3410652.611 4567536.329 14671078.67 4620095.896 1997811.716 2781173.381 3001166.163 2003759.34 3326791.292 3178528.108 2583931.863 2319994.566 1125891.069 10195470.98 3205766.921 2789269.08 3513850.211 3175165.834 3148063.065 4059602.803 1341219.011 1790729.64 3636801.83 3624128.184 6608633.192 7506620.117 2561779.644 1865070.875 4216451.874 1698180.925 3135432.939 2870082.979 2050644.508 6072741.08 2494828.073 3623100.213 3619772.396 3230808.459 42217.36571 42496.24262 37986.29884 39501.67203 38992.11654 Ipronidazole 116684.9096 5098685.955 4803735.817 11010062.09 4727933.371 5550864.527 4567875.693 11956830.48 2753570.517 3938314.93 11256058.7 10080235.7 1339497.888 14609184.01 5084281.914 21686847.31 16967126.28 7268831.059 8532242.721 2071804.276 2673884.455 2876413.64 18916691.22 14078252.24 10101239.39 4637250.198 7551370.596 3012779.7 6026665.176 32252554.59 2975487.787 8796969.432 7325590.799 11400165.24 14457635.29 4032661.534 9386013.283 5018442.259 2061585.422 15124726.76 9373490.68 4315677.409 7128516.474 26783464.43 6529072.761 19615672.72 2276554.147 7422605.288 2533214.281 6976231.948 4762617.343 7553744.701 5914659.658 6693522.178 7004337.529 23907699.63 31913197.3 3166321.223 5117634.565 8925298.18 6509212.733 21171572.99 4520286.253 3842406.073 7494994.182 13133498.61 4292491.92 11228889.46 5895422.528 22153675.18 3901585.423 3381584.071 6160978.039 14459549.46 8548648.937 4752164.147 7650892.458 1466700.454 4219567.822 6415063.195 1893473.825 2150713.493 5713949.684 1602687.783 9511643.807 5830130.501 5044559.567 5727348.562 4797530.633 7156958.295 5532614.777 4745937.249 2283189.344 4722240.598 4551630.275 121835.0633 323771.913 4282964.272 9150365.781 982301.5951 3405259.903 3439605.607 13894842.85 12641091.42 9297615.5 5139074.359 10225492.19 1870963.049 5192607.548 6527682.758 8368225.72 2395113.408 7907787.954 8685547.153 18042997.6 5001300.004 3938171.425 2122046.446 1177314.799 6961528.921 13179662.85 2334913.457 5799324.892 4840562.881 9771635.266 5794927.582 6931675.805 5036265.373 3646846.803 13753037.68 3316532.902 1607737.574 7873936.359 3408243.529 4626408.018 6510389.287 5983572.612 2932254.367 4538862.059 1609720.186 3851502.425 9222681.735 17751105.44 2269607.849 5533921.322 1434090.78 12659335.18 9813522.726 15196758.99 4876941.209 6085754.826 7877899.193 6783840.988 6941770.292 9499041.231 8369236.636 8773027.697 34264598.76 5875466.573 5141956.19 5762692.427 3949707.855 6697639.424 7842195.392 2542163.438 4499424.715 3604482.232 5143493.119 4486130.621 5611366.607 3200546.304 341101.9379 307152.371 358004.0658 362305.4473 329802.8075 Isoquinoline 38680.24337 2120124.184 2328403.468 2164713.587 1477296.954 1823760.281 1964518.433 1776102.625 2512461.856 3518255.606 1666486.608 561502.4855 4036336.13 911026.3323 1591120.374 2517959.942 1840919.521 970363.4439 2638964.131 2604672.738 2921337.377 2169931.345 2129776.375 1255918.078 3059187.112 2159071.512 2126138.136 395494.5139 3076959.608 2744117.88 672930.404 1432453.499 753362.2727 558870.694 2155873.568 7005545.95 2074994.392 579168.645 4968317.181 5030204.984 1555989.168 605766.4347 1476360.997 1441793.197 930433.6256 1698552.422 1124100.004 1428821.663 2366630.288 2251675.255 4106154.123 1731485.841 855895.2697 2932968.387 1792658.462 1050688.36 808108.7386 2315654.921 2892516.736 1259140.218 2689131.966 1020454.127 1514257.876 636778.3791 11843513.49 1541960.642 625976.1951 1780010.105 886294.4958 790371.8464 2388465.051 2330600.192 2429200.024 1999149.574 1048013.121 580060.1463 1672472.86 914369.2898 2973508.263 399231.9592 3849119.572 2964697.802 1121309.561 528620.4848 2709388.121 1395993.526 1085083.416 1033855.152 1709202.866 773212.2764 1226265.926 2982723.587 879972.3532 2375384.848 2189073.46 40262.3489 31193.70318 1997443.197 2092037.235 2144482.805 1859201.571 2064356.396 1534626.396 1434876.816 9605736.129 2221286.032 9489414.3 1970538.065 2471194.102 1429264.655 2805758.788 4102810.253 1188231.353 1707087.644 1677015.724 2357101.045 2532580.762 495972.4365 4681049.519 1223581.729 2395719.536 1683815.796 3870261.995 1603455.62 1998575.785 7761472.329 1660065.783 1371433.246 4123742.996 13912781.94 5380927.554 5427082.847 2301015.44 2093838.133 3298619.373 5024860.195 3816356.939 2383785.088 7023924.153 12469949.6 2582699.819 6111460.26 3582652.773 3189617.991 1920260.268 2881116.978 4128442.375 599641.9455 3023974.3 2736614.526 2224182.303 4496622.103 1653262.174 3291615.123 2460740.507 4695742.205 2823825.701 3531489.632 13354283.03 1575060.975 2915368.238 7895700.782 1981650.222 5982974.391 1343145.16 2437549.719 2087077.111 1584912.182 2589029.822 2327093.837 2179627.719 50929.67114 46096.53096 40683.72001 36444.78066 41207.35763 L-(+)-Arginine 113416.5624 139290635.2 27366342.72 33445068.68 74196296.74 60690057.54 60969751.16 60653785.64 100534777.7 147544507.4 108827470.8 88513900.41 94209222.04 64659338.04 83969588.4 87531789.68 47039740.51 81354289.74 84658006.84 113933821.7 123488607.9 127738829.9 66931046.58 96887198.88 99224819.04 28864034.71 35099256.66 77285115.03 140461595 73229340.16 69734703.22 83461244.17 104384173.4 110255239.8 94682743.57 104763289.4 109912190.7 82797711.38 107822584.2 125468201.8 65041035.34 92295095.5 101487346.7 58139800.38 114108845.7 51707984.6 95538764.88 117739602.1 25211417.29 42741233.45 110201254.4 96034267.97 89219572.42 78743243.57 105648523.3 47868606.02 42053176.06 68669384.1 115503505.1 116337985.2 78317837.69 79268980.5 57169181.39 87742687.2 84285953.53 51496530.98 101315159.9 65966920.49 97874801.88 59652083.48 92681618.23 25418913.59 34168844.28 72402023.64 113704221.2 118117370.2 66825258.37 133055344.8 94072092.93 66094471.65 89405431.86 88097038.39 82195999.93 88064617.19 96392914.89 110747621.8 74114573.27 121011773.8 104680143.1 83486234.42 70449763.9 89094939.58 93919618.2 26766140.82 36346725.33 634456.5071 236038.0299 28392094.87 33298488.99 87191815.59 87996535.16 73137906.04 94491646.61 113085669.6 69103881.86 28319511.52 67315328.16 94298382.13 87978183.03 98422056.59 83606345.03 73672460.99 56720114.41 76130237.41 73711641.6 26763965.09 33252473.17 58746501.5 95324001.08 65435248.34 75138210.72 80446745.46 88031945.79 68072115.93 59145837.28 71895105.24 97368732.14 86675158.36 51785926.68 71737937.3 57041880.52 61301114.83 29586779.24 41623025.27 96302485.68 88817210.13 100346051.1 70231930.18 60406152.43 86998932.23 109965111.2 97074152.74 106059810.1 86923162.38 84267757.37 124897589.6 69495747.4 65726770.88 60479768.17 27782136.59 30021295.97 55178753.59 102546894.2 63890995.33 95447114.62 85031759.14 69574261.15 76426227.52 84472213.52 90039031.76 87548227.89 53417720.11 80151600.77 56749092.77 88411599.82 33557157 37108864.13 100421201.5 23508661.87 37232791.9 113596729.7 254519.7628 438881.3746 258402.7205 278324.9614 262129.124 L-Histidine 380676.6521 28227367.62 25121843.87 27814400.12 24476812.03 25944073.34 27563243.86 37376036.47 28298771.67 24887997.96 36201103.42 34204142.4 40959537.01 30698601.49 21873123.64 34139866.04 31967155.04 36755229.69 20324951.22 30137641.11 39620753.78 32835563.73 33547014.21 26375145.87 32331354.62 26534517.85 23449829.12 32741739.34 27621751.68 31799429.79 39117313.37 32257528.35 29838123.18 34977396.36 31802283.54 45029658.8 40368144.94 22216590.55 43843168.44 30874487.8 26434855.69 31696567.12 48257182.31 27998439.74 33083170.59 31462798.44 30822960.58 33398492.37 24371128.61 24732384.98 33959703.59 31691505.84 32329085.4 26494966.11 27404845.1 47554125.33 33392645.46 22127945.58 31367653.59 31793409.21 27080898.97 31848158.99 30462452.79 22447292.69 32162033.12 20762338.83 34466291.45 34219154.2 34448831.57 26961355.64 28568046.12 26104430.88 25379664.93 29370278.17 39251209.35 33083611.05 31483134.87 36009249.5 36267291.24 27895504.24 25404554.3 35257708.54 28625454.56 35764425.49 38789199.06 31984378.32 34054007.82 34292362.61 36422084.53 34894138.49 28569343.89 33521385.35 31431253.25 26620561.38 25893363.3 546130.999 341715.8958 22240066.56 33303143.53 36211554.13 34179903.56 47462325.07 46780214.93 33478534.23 39410413.28 32493288.2 28164223.69 38733182.11 31184377.42 31270726 31874134.88 42849183.03 32254609.38 30710312.26 33362030.25 24914235.6 25194869.41 28531137.23 36556595.94 28871113.96 41500582.07 32344058.86 37673873.73 35397969.73 31112309.68 33254192.81 46409759.23 34453699.08 35788538.87 35156484.89 34709823.19 27489365.18 32451616.69 23894089.24 41331118.63 41582492.26 39497124.22 32514301.73 33969343.72 38466650.08 42668179.99 42537858.66 32875325.12 38997440.88 47186183.69 30987145.02 31549308.64 21103332.16 29206679.47 26559425.71 31187108.13 40332731.35 37401618.96 33765125.4 36670942.14 36013650.25 31393953.48 43047586.84 44524666.82 37244974.26 30514815.49 35121057.21 43009760.08 31887996.39 32764199.26 34380424.91 271718511.7 37094381.1 25063907.56 22288036.04 30453190.65 301973.2525 601362.8411 354300.5888 358557.4734 305730.9174 L-Isoleucine 4126043.62 978594771.9 1076207143 1224264003 1103977315 1574380082 981268663.4 916424108.4 856795013.8 1066223348 1246592371 1350382588 1485261380 1761092457 864771712.8 1306656774 1371061497 1121963048 1241900282 1207618733 1161399369 955445138.1 1015948173 1459905977 857474962.9 1257124994 1333104600 1019057339 888177753.7 1587283467 1384017092 990817297.4 1021875135 1274074605 1450803359 1485667778 1231975977 1101055287 1379028103 1429768318 1209549659 682536627.6 1025443889 1192334131 963834016.6 2157521024 1094972564 986536602.3 1490794728 1518268109 1016072439 1204755119 1689678922 1059072812 1033691379 1321549304 1730712148 1656748006 1320624038 1489859605 1442196166 1830905168 1345719092 876911195.6 916279039.8 977474444 1279429168 1735863033 1375105315 1480239783 1036236688 1221258022 1970850789 1932625435 870084712.3 1391804740 1395304924 1085721216 1225256556 1305199597 779738615.9 922345250.5 1074402443 1325023252 1496750206 935604894.6 1358284532 1194043720 1105039713 1263351306 1862760661 1740546123 1024324668 1401536760 1481119402 2466308.241 1553243.577 1109665199 1276544227 993982134.5 993487335.1 1422596152 1162606519 1165093950 944238930.3 1044490455 972734171.5 959441713.8 1021236376 850947680.4 1711117155 1008527112 925310869.4 919689028.2 1165151107 1186519413 1378786000 1750689657 903690897.5 861282152.4 966614390.4 1449815570 911925870.2 768407696.5 1629670955 998529942 799626472.5 956316946.6 1135696388 982400583 1024113739 961279388.6 1261865476 1437168399 1338426818 1318581640 1364106544 1172834828 945203366.5 1143034646 1091725895 1030715494 1057870177 1129041711 1316532326 997322036.2 1428320339 1466930324 1322934665 1354957693 1380277812 1629070732 2019088940 943056171.5 1205480836 1127455977 1162395606 1416952121 1628363760 1236502461 1071383755 1151286583 1131008164 1505929355 1382261890 932043234.9 852066554 1797637205 1275907019 1791366147 1420827700 3004668.716 2035650.477 411274.4623 1787757.213 434836.2628 L-Lysine 96893.31599 41116162.56 27893160.79 33155702.7 36335114.45 57943372.54 41281614.92 39376502.13 55654851.73 44769508.2 80249073.77 53591293.65 53371372.2 48539313.62 36871302.3 55516524.39 66176891.18 54231574.06 50451049.51 60652030.91 43920888.38 53550812.87 44816745.74 54576471.76 46501107.87 35611534.05 34679360.69 29042269.69 49730656.98 64431519.73 52785035.51 58919836.76 45623971.11 55626164.81 56122641.32 50348357.03 48589022.75 36338941 49655102.8 49678733.38 48419837.76 34691244.56 49911117.74 48681070.02 50468787.36 47786659.88 46145566.86 51495916.65 33563773.42 34363435.39 43556036.52 42631993.23 71844877.36 47464060.3 42974139.37 43403959.8 42993699.88 44282385.39 48887911.76 54397990.44 41679652.65 59518434.64 50942355.18 46231455.37 46408610.38 41382153.7 51254908 56642108.34 57517189.74 45962051.87 42539398.48 28794164.23 31830520 47494075.46 43136750.61 43374301.23 50338694.81 57488022.86 56178893.94 35414228.56 41587004.59 32298436.94 49871641.28 60519553.36 65595013.48 40617621.2 42923050.17 55286134.6 35118291.85 39081398.08 43820439.8 42332313.43 37521557.35 34209169.62 35049890.06 288376.3254 275871.572 25021397.4 31777880.36 38755231.81 44040652.73 53834142.13 45714962.32 44037918.65 33535652.57 38371072.42 44136437.21 47132715.93 49885138.42 40970790.36 51028561.53 33668404.96 41248527.2 51459198.76 54406231.88 25430981.29 31627520.99 39944661.54 41617197.44 41480218.08 47555321.4 51096780.42 45993910.52 31673288.14 52329853.69 39668274.83 34451424.02 34153635.49 43996505.85 36636268.4 40207907.38 33416880.22 27299417.92 33202724.33 48376977.66 40920263.31 41588090.61 54924399.18 39392152.96 34872167.56 47346350.2 46945763.71 44993618.07 43504254.41 55956329.39 43803102.63 30720093.8 41140234.43 42860348.94 31587111.8 27991350.48 49562879.1 58829495.73 48906442.02 55655470.69 35499553.22 48243267.94 46942027.49 48366231.91 46224343.79 43584659.27 36352282.34 58570860.46 37565199.05 54532647.28 41207017.62 29948970.84 50560271.76 30421224.34 29875145.44 46985565.48 281449.0608 283423.2382 313315.4967 334315.4498 285060.4903 L-Octanoylcarnitine 27665.49499 17069950.22 10643592.26 12302149.36 39304039.87 24370048.95 24078236.32 55233745.25 22411754.05 53974758.96 38901274.85 50310994.83 48136965.6 44017152.87 100431633.9 19299598.38 23455890.87 30856900.28 34502361.8 66820944.38 62019768.71 31361815.65 61791877.64 54366309.79 73762353.91 10002639.09 12378698.66 197499451.6 31925164.57 44528145.57 19910672.05 36119683.31 37350631.01 49113103.37 35771033.17 29886670.2 75321592.76 33720241.21 40713975.05 124669771.7 58546633.18 33307561.61 34087320.32 34058233.25 22673287.7 40551513.8 49024511.38 19223056.35 11110929.05 13432181.28 35634184.32 11454363.65 21568793.74 58406583.39 60052400.27 56441060.74 54185400.57 34970675.77 40205245.03 28773710.08 67538611.39 77527168.15 63674592.75 59927829.48 23694708.39 61041998.42 30880034.22 46791941.58 88466779.42 16430262.32 113328922.4 10830385.38 13048136.35 51706914.5 17516600.25 24114097.54 55687879.55 10417970.9 24705223.23 47694637.32 32414674.06 43755015.55 19410496.26 12251754.33 15930181.99 65970934.87 55680562.39 48736435.8 62680031.49 25526757.2 59267063.62 27768542.34 25150717.92 10412899.91 12757036.84 161139.5457 26886.54056 10110228.8 12248835.82 21109077.8 26635573.18 79113904.63 28755623.02 46776341.61 17729488.25 56880223.42 20705859.37 29953227.26 25480028.57 57875414.55 40018734.63 31252368.67 57663025.76 30184044.77 11370245.16 13042536.83 14405902.44 29564709.44 21207299.06 61538196.66 30516360.9 93020097.13 74489951.13 60980223.16 21007700.14 35404789.62 18233655.61 86593368.08 55888500.03 15153931.33 51516353.91 34783196.37 11261623.69 13730781.56 30537156.08 11473414.32 26824909.9 35169968.67 60007391.31 19013944.99 81818597.79 37853164.87 26032186.64 41228490.71 28110308.71 25988633.77 19353674.34 43648473.42 44626593.29 13136423.95 12238581.42 42644191.55 44509902.8 22961203.14 69863231.11 19941515.36 30438495.82 39605171.68 16151734.12 120720268.4 84634582.35 27863511.07 34436160.14 82731848.54 30551665.56 43186153.9 90591845.49 50476141.33 12629105.92 14410814.18 18728052.92 37462.42292 31652.12758 71218.80289 129362.1407 155749.032 L-Phenylalanine 324295.6411 1012468075 1010413572 916143684 2449825.543 949986204.1 579596593.1 1074082797 1005814305 647846695.2 1381031337 612516440.6 1283055483 1826003886 998453888 1125589568 1006905083 1522477570 566212666.2 1120301118 988732533.4 1038927284 1127789391 1163412847 979904142 1299707645 1329379043 1018099881 991877523.5 1130096383 2004826611 1036495740 1276145703 1335495292 1538111496 1444122013 869531535.1 932043121.3 1379419798 979430065.9 1301326545 873669857.4 979553834.8 1365193680 1078034769 1720720837 1320086669 1115061411 1622133838 1445397936 1469961236 978068547.4 1141263501 1368120110 1108896632 1435658731 1490122946 1303648591 1389725941 1773626331 1485822312 1552714654 2056731149 1038902610 1367499385 979616352.5 1352443851 1646106095 1535165912 1276695558 1286491864 1316277321 1935093697 1840992411 1080140059 1349509031 1658781443 1480544182 1429616457 1315603164 911260469.4 1378407183 1456539954 2052926276 1698718568 942109808.3 1250332767 1228857444 1315404210 1320265305 953773579.7 1622954609 920258032.8 1564074660 1408861137 1385350.071 305358.1044 1197286124 1135706220 1150791727 1001747172 906965004.9 929997798.9 1076483.585 1239689938 1176051775 810277819.4 948222054.2 830483576.9 1217079272 1393477606 1303748106 839512.7786 801031045 1255900686 1336997763 1191180880 992929100.5 1265744542 1055003885 1076608526 1526029970 1468797072 854281002.5 1500317050 1005842884 1024210162 1026888935 1288856399 1165042247 1411145214 1332608731 1364027453 1463261639 1443122278 1537678296 1564938721 1075214950 1231563825 1423154574 1168970676 1296201159 1338947852 1100567920 1797514697 1296327330 1136488769 1346097907 1325984653 1524259351 1392901353 1504289983 1886228604 1389730214 1581469364 1137216665 1423277820 1662962541 1579970793 1216145606 1246441140 1440762970 1346112402 1520394405 1425109154 1332539331 1249220829 1445127627 1698542494 1769295349 1409909754 240010.3157 724664.7496 611034.9647 291935.2079 900745.1762 L-Pyroglutamic acid 996055.876 68587913.04 139467549 125843297.6 70840563.25 43759065.19 88973175.36 71667619.31 13557212.98 62465885.17 71201467.57 47219847.19 47641415.32 59052750.94 56844741.85 47399060.96 57613256.53 54720362.21 58629437.93 70088471.19 45257261.76 38981268.76 66960745.58 65152370.45 60150604.96 140411228.4 128061102.9 63434095.91 57034626.02 69436254.6 52363342.46 64303740.39 47071170.7 39718507.13 80593749.04 71698661.29 70789070.64 45983040.5 62855455.5 58430230.21 54143176.73 51445617.86 43050057.12 57652850.95 39381780.39 39446847.08 17729186.54 41695465.67 123807962.6 138329072.3 57564685.86 95694730.72 16410023.05 50239017.68 65784530.67 63910941.79 50342569.61 46137979.89 14868208.51 49011502.98 55740512.92 62088469 53155774.07 54907612.62 45790383.57 98855590.6 58378510.41 63074042.65 8969728.563 49267126 68197863.99 145061046.4 102132486.2 53652123.27 72775236.93 25837097.15 49831660.26 51580356.64 7871290.863 82132657.97 65525430.54 50521315.65 23223698.35 74011149.7 16151294.1 58939970.92 11999331.29 64920633.63 52586360.97 61785520.52 11522963.86 29720630.57 53834292 114752654 128496855.7 1764236.022 930849.9577 124431494.3 123086484.8 67004179.26 64312247.45 68993320.34 69861990.41 67396626.63 35036179.13 73119025.4 61182958.56 51471481.93 40050179.68 18379343.72 43096809.75 52975035.56 57860173.97 50440738.97 47263422.09 121789384.3 123937693 16707378.9 40592590.48 45883142.84 13250142.36 45815837.71 54117780.95 50975552.4 54069566.82 43107819.3 39229010.19 42724860.27 102880971.9 56178433.46 19956983.53 40343984.9 134671339.3 127843748.5 15967300.38 68567270.4 67376766.08 91316859.94 46834279.41 53435702.02 64576750.15 70447261.11 57502224.71 56565515.94 18373263.33 72518280.82 73659757.74 45614234.92 51770968.64 154678916.2 124610358.3 8402010.12 21476917.23 52959889.83 74577612.77 37480918.64 46414250.87 70182243.76 17701036.32 66590725.23 80768374.73 17618326.4 18627346.82 56145585.57 64708169.33 60296424.35 50280310.57 51654562.96 123345796.7 109525042.8 69220148.51 1299026.099 1090541.378 1616804.078 1053227.508 1550869.911 L(+)-Citrulline 428196.7893 5266945.41 1043003.903 2467313.935 3501896.778 3575050.447 4297246.722 1607661.609 4533221.253 7191506.103 9110060.229 3200570.312 3285852.402 4227563.307 5238402.432 5326973.645 3995146.728 4950726.097 3485271.236 6250339.116 6167095.628 5566901.92 6005616.842 6480841.99 7010262.128 1052301.111 4983204.679 2341970.247 3409756.567 4853380.527 7554630.318 9050604.865 7238014.013 6921555.37 7217400.489 2792281.672 3772966.069 4107229.136 3550632.676 4684764.731 2429113.167 3596175.136 1106746.598 1333642.755 4487962.994 2558150.117 1772002.758 4739450.206 2990027.949 5982666.294 5609795.661 7992098.945 2454247.385 6958354.47 3356086.075 7899126.222 6622156.549 2389323.442 4423654.084 5683372.659 4348257.631 3741120.654 5136274.723 2423604.297 908400.0405 4221396.979 3589214.684 3387254.676 3913822.2 1438091.965 4285643.488 3012996.407 4972913.12 3470898.357 4633852.472 4039791.918 3102011.1 1721729.114 246468.2492 3732064.601 4044983.261 1167324.687 3591267.187 3143702.838 3118726.083 2356749.546 3034430.423 3660930.214 4597818.174 1635453.663 2344750.127 6140823.186 2045335.851 3211974.331 4553321.296 1760831.927 434117.1781 2269941.807 4167955.896 4718004.938 3982192.204 548791.7333 6304411.034 4648764.078 4329071.996 3688715.54 6333756.187 5415547.225 3156569.495 2905986.196 4231601.442 3560529.448 3954258.294 3637407.051 3330080.318 2403285.102 4099607.579 4880548.449 4626875.563 784548.1186 6774776.691 1394081.349 1536592.025 2811965.719 4045977.647 4941630.419 4024204.475 3914092.687 2210218.749 5399716.623 2746040.788 507538.8439 2854569.806 4421225.537 5370955.331 9406968.215 3908943.213 5453485.128 2998122.368 3768953.92 4772759.387 5063980.549 7823097.896 6454596.429 5395241.551 6629004.171 8942182.677 917930.4373 2679073.845 3211915.773 4962203.068 2906587.521 4358747.835 1433973.691 6123943.482 3407911.024 3648747.92 4262376.208 7220102.976 3883669.127 4652002.983 4179661.791 2425021.606 2071730.607 4573184.92 2829247.273 3662988.329 4676286.35 2776387.154 4282466.154 1752541.355 403453.3617 470145.9914 389704.8204 397676.1245 411277.1758 Leptazoline B 1238793.303 1175123.163 1334621.809 1393018.427 1740922.692 50109890.43 34078885.94 2088259.923 1674140.879 55196325.14 3702404.413 39667834.32 1980208.757 3184989.922 2364946.862 2735472.327 6353515.796 2969474.827 15670625.95 3803661.524 16229819.02 3153987.441 3234489.771 4303657.87 3259242.079 4993750.148 4888388.845 4244397.01 3352781.037 17513221.31 3139881.982 4153297.187 3870578.129 3753621.457 3823306.77 3759805.125 37249820.67 11076505.65 4120908.26 39257328.39 3938308.699 18482019.11 6917751.556 4783863.484 4834008.216 5961397.357 4562366.826 27406615.4 4982317.416 6750481.398 13691808.8 5204802.85 5337397.136 5303577.355 5431175.66 28453853.6 9336607.732 22676596.06 5394580.098 5048693.48 6708921.781 5592622.588 5580001.798 5919229.722 6079015.108 29895332.3 5962215.58 6646634.661 5985962.356 46320761.59 6478718.015 43066812.18 7226906.807 6227669.557 7060819.911 5578589.819 13427003.05 5938063.854 7140057.902 6827293.25 19006294.85 34102134.18 16823638.11 40829347.52 28655782.12 6814405.539 7492886.323 33591000.13 24281832.58 9920851.395 6839189.623 7946577.618 7375230.434 28787620.89 46151531.79 47045.13736 56112.32503 2704981.368 3078488.082 3217855.832 2729577.042 3187452.515 3248528.423 3402214.034 3274922.921 3551287.193 3543351.008 4986023.367 4457524.723 4567726.419 49101938.03 5399883.496 5098639.315 5628907.799 5071543.561 5855377.649 5745430.523 12961154.29 5131647.792 5738592.485 6263301.464 5743462.06 5882798.506 65079910.33 26638329.81 44710386.29 6732948.359 44341293.41 7317751.924 7690627.987 6826041.811 60559680.19 18698331.78 7931745.589 7454106.161 7448051.199 6484126.389 7522268.83 6781495.453 7001481.212 7467334.582 7850420.231 7808797.722 7320769.203 12340460.64 52179283.27 8203288.637 7490208.223 6763223.126 8424092.707 8479265.863 8228924.541 8341383.989 6980898.44 32918129.07 8335834.134 8226803.289 7910467.67 7405059.012 8342282.545 8068644.491 8660224.882 19354874.82 7478475.371 8132365.325 8488807.935 40030448.42 7573787.944 9504518.765 9757557.658 7630353.984 46742.86243 45978.38453 50444.56832 53688.62928 49347.02262 Leucylproline 41252.64923 62266560.37 57706885.68 63844960.39 82821006.72 60146806.61 84185396.27 74554187.43 66250793.6 76007057.82 94057896.43 77425828.99 76904839.35 169815794.3 83662450.14 62059952.71 79183820.63 96920294.23 88926543.93 87176174.91 52896291.86 83887294.9 104501826.9 109380254.4 84229540.36 52887950.08 61159253.94 116840611.5 88553922.51 96388618.57 96977737.05 100308411.7 106444318.4 109882425.2 70316947.88 90273185.17 75539042.93 113537892.5 97144565.01 82171293.66 72694967.72 107105415.7 107934895.3 109338667.3 74873372.95 110604536.2 74857774.64 81059913.02 51190567.42 62912059.08 61769110.74 78059577.93 39881272.82 55464689.22 91533927.25 99369494.05 109511719.3 224873774.2 55622420.36 67448197.27 90212905.36 80697691.91 81733526.61 58136028.53 55694710.22 108457531.1 65861022.13 107239256.3 69018295.36 75994867.24 117358492.8 51467898.94 16927851.31 76084384.58 83834757.75 24763129.47 114168531.3 84388071.74 58346254.63 80806456.17 44113732.59 51719325.37 61376459.76 610748392 79672586.68 75798161.4 62425614.44 61697070.83 55909606.19 91896795.87 87732571.29 66621173.17 66606311.45 46693185.46 59885094.5 420312.4676 49240.61157 47531965.64 58141854.93 80255959.37 45742742.23 102774848.7 126762047.1 55222821.93 90703591.57 61539305.7 75667157.3 76117680.94 64165543.2 78966899.31 63529159.91 87924557.8 87104797.24 115503135.6 112344200.3 50406694.13 63641852.58 33673423.49 58284021.15 54376138.82 79964416.39 79467109.8 88954179.06 75459400.55 60029072.86 76666951.35 60300815.79 84741210.9 73880835.28 71468567.86 69214538.15 104076278.6 51984003.71 59305785.76 81915643.78 90731888.05 86095197.22 86158615.98 67464692.76 85808655.02 82843604.09 103178343.6 77987627.2 53815441.47 82720554.7 62689375.42 93181055.05 85775550.08 59738063.58 57939838.83 58350504.46 68855487.63 50928881.44 79869704.65 79943158.94 86083588.38 65758856.93 117859945 73625360.23 63925629.44 60201778.23 70537917.25 50391262.13 76249143.48 97375302.01 58796926.43 41987954.6 92665497.89 50199579.63 54184201.33 68973292.92 121878.8783 79654.22055 465025.6413 64370.74962 85067.87118 Linoleyl carnitine 60597.46548 18551196.35 79786806.3 62688545.61 32251760.93 23933046.55 23176731.2 60018745.52 25409751.17 23384426.53 20976690.06 30084791.21 23942036.5 27650239.04 44113545.68 32797854.1 30873026.59 31090477.84 36974197.76 37076743.88 22492084.3 19040653.9 28728664.03 41018228.41 25354449.66 68438130.4 60716525.8 30125946.43 28659373.5 21943961.54 47217808.36 31145826.63 24985311.58 21570807.49 29331287.95 23901467.96 22525643.74 23062325.72 45877017.9 23574429.53 32026813.47 22984571.02 23599441.82 24562140.06 15400927.99 24834813.48 27901232.73 11941944.98 69613224.8 65736897.45 28534744.73 39018235.37 17373442.5 20824264.76 23972219.41 31505180.38 25105439.04 24201558.42 28423410.97 27160816.4 31599072.96 38052477.64 35341627.97 25888508.45 18788894.81 69198522.02 21928722.06 23646063.26 21689712.72 29039856.83 31261410.34 66787452.28 64841498.57 33548852.8 19757111.5 14151710.88 25611436.59 13797176.24 14544177.53 46056769.29 35021421.53 21464977.91 15006717.34 17244117.74 15853581.02 21651747.13 28649511.35 18539158.29 24152160.28 32582450.16 38102914.13 26920298.31 23602440.59 61347909.98 60187336.04 50241.27416 41405.88797 64731695.35 55951665.69 15074284.95 22472604.37 59546803.9 28230520.97 30503504.45 8669688.238 62043811.24 33221902.55 20571896.2 16722550.37 18859694.84 25655464.65 19315963.24 37107298.1 29433688.13 16825624.56 86481954.07 72551367.31 15803577.15 31909698.86 25362354.23 26663132.17 40326570.16 15282111.62 32453930.31 17828019.45 15493926.68 14905318.07 36276182.14 34280944.27 29225273.21 54884251.61 25739083.51 78842031.75 70493562.31 29479240.74 21175632.43 21407536.12 24876880.63 22282452.02 20990684.95 17938751.26 29545824.86 27237709.84 26294879.97 17157877.24 23069312.06 29298014.41 35576982.55 24620398.28 84134558.1 55493224.88 59199167.81 42105342.3 36290233.38 17352984.97 11492311.24 29272080.03 26613817.27 19288956.47 35761378.33 42350063.31 52096567.31 30011486.63 22436978.45 17484334.58 39300969.09 25455088.24 24145788.84 79458209.58 65356561.15 19176034.19 39444.84175 35512.87612 46142.43638 42689.73611 38417.87988 LMFA08020332_1 50962.16083 512828.3049 255821.5676 177265.3813 981820.94 699405.2909 529025.6703 1382566.769 568220.5651 1068985.064 505318.297 996170.7806 1066669.672 944224.522 2228863.756 487080.4952 430765.3185 1321713.046 510895.2933 1353842.348 1318204.857 529635.7131 1325047.242 1243083.919 1878180.959 302803.2921 188696.8791 4605554.489 602989.8053 893421.1927 582146.2155 795474.4917 836126.5205 1033374.361 893720.6383 545583.3178 1883737.119 785064.1048 835304.9856 2457677.359 1528914.8 945990.7978 573840.3888 942433.5483 511722.8742 40434.40184 989651.2928 713218.5271 277484.2313 185879.2898 805969.2763 461481.7499 604085.2309 1904848.671 1136200.628 1579762.729 1410044.874 993952.9516 812462.302 556078.9767 1494991.942 1717379.295 1441795.116 1314854.687 719584.0896 1241576.833 726644.772 1055824.989 2499019.756 537582.6049 2273311.499 464995.1612 253705.471 1345696.488 502742.8513 825463.8718 1389237.845 465833.2017 823523.1799 1079447.169 639132.0219 780284.4238 883739.3507 527510.162 743073.6063 1419502.455 1020500.394 1272540.475 1331139.352 643308.2189 1396888.967 583261.8788 584184.9934 325129.7703 219653.7245 169242.834 92970.81701 198941.0402 241532.7565 857865.9806 839648.1778 1560704.451 690494.5382 1158269.424 531902.0934 1143331.205 520464.3497 787350.9724 866166.5989 1260962.949 820047.2048 835738.489 870536.9992 1009146.348 292015.4519 219014.5345 283473.2772 894333.4933 734832.9986 1382430.175 847909.6136 1713879.785 1456214.355 1692286.504 828550.2702 819885.432 469243.7759 2242572.353 1627556.491 362536.8466 1229392.042 755406.4582 209571.879 250790.4595 919136.8301 402837.4787 863645.9555 804055.8123 1663893.221 579136.6047 2311204.497 977293.1907 937633.7421 1026684.961 1220625.494 713619.5642 661400.8745 994136.759 896857.9633 407703.3416 219958.54 779410.526 1023507.474 777634.8027 2208114.402 652815.9347 896743.727 1307929.49 649638.2586 2454651.581 1986998.387 817300.6783 875894.194 2488435.986 787218.4327 1071374.669 2945688.153 840896.836 272952.0805 384708.4322 448604.3075 41618.2313 47177.90515 36372.61432 38482.7593 75959.88091 LMFA08020332_2 50505.7625 2954932.255 1410485.723 1158856.588 5100167.368 8459461.262 884137.483 9553215.629 1265100.637 620887.0325 2258557.792 2061291.132 4372776.734 3615822.02 2552211.84 1056356.04 3398254.876 8777883.184 2004668.957 2210144.505 3172451.454 1317754.066 7830786.563 1472252.5 8010956.695 1295862.554 2788097.476 1195281.028 746855.0748 1964943.497 6272218.848 7327736.82 4640138.286 1724272.835 1142864.726 1451483.36 1476271.549 2896860.422 2070434.821 2188296.128 5117790.575 2637900.153 1114806.295 2586446.437 1761396.12 1120582.765 3430294.491 713401.0268 1212815.741 1345605.467 3406753.736 2359335.171 1236223.253 2420128.96 365044.1436 9272503.631 2120569.747 2032279.908 2621410.615 5559025.952 2784597.706 2630237.312 5077699.088 1923916.632 1941270.894 2596102.737 391909.5894 1333209.925 2304764.104 4764758.231 1997815.099 1392966.745 2852945.659 3478453.322 630216.7369 1981458.517 3433605.931 4822983.705 2534585.925 3615941.946 1737188.31 966599.6344 1106413.504 414222.9889 3737822.125 2464333.083 1034659.671 1610811.154 2855893.417 494656.8109 2194570.477 1546751.892 1019448.886 2972935.051 1258696.937 72145.94266 59037.22533 2687856.142 1278557.889 6091070.715 3562166.268 1999023.991 4837033.551 667742.1257 5966650.731 3130046.867 2485425.733 2807672.996 2996168.11 3851569.938 2074968.963 5992102.809 2738710.01 1987916.481 1178827.628 1655903.09 3068619.13 5386243.313 4593568.052 2755148.231 9580699.108 3687141.17 2091980.361 1911302.601 4457318.741 3069462.087 2460914.312 2858534.383 9395803.587 3995424.606 5403542.898 956162.8129 1652256.865 3123088.273 3142307.193 5983516.506 4633381.385 2093998.805 7405370.995 4072091.716 1902234.741 5478528.939 1473822.15 2373460.927 1548291.411 1968284.84 1291166.562 1810141.785 1392375.268 3104077.987 3241226.721 2117646.523 1407452.8 3744813.169 2434284.033 7208564.73 1842395.77 14379650.62 7945610.135 2739438.552 1560307.138 6347082.686 1793692.766 8964085.868 3248461.378 1742251.97 7302960.38 2257540.72 3005334.841 3568885.152 3002390.631 123744.0783 46036.78661 125959.1841 37811.15361 88714.50647 LMFA08020333 39738.79556 4857040.313 4513681.241 4475210.488 12961964.96 7957336.003 3622090.692 23510271.4 4732684.504 4977573.345 4657787.71 5892890.981 10555599.21 18514494.82 17231277.63 5420559.981 3523895.775 23400841.5 5117249.585 6411809.194 11187207.08 6843049.591 13110092.76 7814732.259 17642648.99 3790603.732 4548644.174 11257204.64 6563574.075 6428809.95 8765324.83 8430788.693 9070929.159 5777867.992 4608517.724 4768194.162 8116210.268 5322518.707 5263053.745 7088912.535 7059123.41 8032450.579 8161814.076 7769792.393 3108480.42 11286521.96 6493556.284 3956383.236 3982277.521 4787136.2 10029179.05 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7951607.283 8802677.483 3210402.758 19214384.17 7493594.513 5933431.32 11248612.05 9596945.457 11608387.82 4376853.847 3665455.865 2153958.717 5891370.676 5031702.466 5004606.623 4323027.963 8679576.664 4602609.425 6233506.705 5768814.408 7576059.675 5779458.862 20457223.02 7379863.7 10372078.13 8782755.853 23617628.76 9451987.554 10398027.36 3616700.638 7662069.829 16076021.56 5197648.786 4692373.681 5674126.648 5253063.361 39176.00514 38727.25685 37997.49166 31445.92483 31220.67992 LMFA08020334 51844.54122 790214.5849 757988.4899 1075715.193 1485630.623 1462044.898 1318924.827 1607520.048 774079.142 672255.3221 911227.6086 561262.2851 856832.7615 760824.7683 2312454.035 635006.4202 699144.5354 2183208.186 631325.7408 721880.4244 731783.5109 1030359.303 645347.7545 1186772.833 601549.7909 595397.2387 1008692.921 1585642.717 1610072.1 1055622.912 778697.3768 610765.1598 778185.6035 790581.9546 759725.4753 440554.7865 733718.5408 798831.2111 1584797.453 871065.2497 970090.1675 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31096.03078 576262.8506 601965.816 936084.6968 818463.9742 977345.245 540063.6649 783186.8556 989136.9794 998741.0107 427195.511 51036.53486 491130.5848 741667.271 42022.98298 1089784.732 625059.1396 970789.9482 954310.2878 462620.7549 595598.8941 958394.8894 1302526.518 1050690.746 1463738.512 1346184.49 455486.8448 597212.6813 832853.5396 639590.2116 195572.913 475304.0035 2185708.527 387049.0159 888487.7053 802865.5455 1619586.878 815570.4286 739054.4194 615900.2443 882312.4748 1620201.63 603436.2703 988554.2615 1045655.74 205795.4377 54534.23047 54436.28226 51585.80165 17661.79079 48288.3099 LMST04010233_1 65254.99199 475920.6114 231447.3574 264126.0076 897162.8247 230407.025 566887.7637 19037621.96 2208541.448 768388.5374 1882885.414 477811.9453 563915.8422 888982.3674 311315.3931 1125612.853 1599028.7 4919265.561 1169513.48 849212.3595 1268773.909 490542.6715 153447.0018 1635893.261 325222.3563 106474.2954 362248.8422 583343.8482 370772.8086 1724550.231 1852869.828 1223177.26 1313253.502 323166.9966 1332184.813 597212.1938 307791.6639 1080686.638 432794.0337 362933.8064 1340029.194 1265440.297 1161126.943 799759.3183 1622165.518 640179.8709 386044.9912 1303753.42 184176.8995 393377.0853 999456.8336 577661.8936 733087.3202 1374178.405 394177.9782 847792.0158 1490540.352 591350.7096 2928464.735 119160.8195 236591.3994 524950.1612 2484985.352 1729153.973 394201.8468 1221677.216 339296.0219 1039583.111 743492.8555 473577.1354 1871287.599 223748.839 408407.6126 2234145.707 506770.481 214817.746 342176.8082 625197.4453 1200446.518 738616.7864 954749.9041 725266.8258 747571.6877 141065.1357 2017108.853 245449.8942 1999946.738 371465.9488 4387767.305 930816.9043 1685154.869 1682864.438 452621.1853 245752.343 361729.8241 63643.08937 52684.81571 199168.5757 316260.3767 891371.7839 153051.1889 353149.708 592735.5509 351926.8522 261485.5586 1989926.559 147457.7293 963125.6722 107609.6794 1047901.562 1225305.885 766196.0392 1010203.622 359045.2098 177724.4602 146818.9948 336922.3086 1462632.013 104895.2903 235460.7694 756498.3684 371864.2239 505024.8959 550009.8934 255289.3911 150742.5509 244436.8225 324004.8306 263744.5644 377685.601 614514.9272 154187.9362 213281.8737 372768.4699 396602.2671 328605.8817 801032.8751 2397602.876 188819.8253 195706.3002 648378.1198 490040.4407 389221.849 1114651.307 2521086.278 3202911.448 626274.1228 353850.5762 452604.9412 308491.2739 349673.0905 163164.5536 499459.3652 335482.7559 1629761.567 64818.20845 384756.321 66072.58129 955901.0412 866713.1372 1627866.159 160105.3849 1004584.609 314758.2957 960271.928 494697.1189 131588.5945 453508.0457 242151.8619 390727.7105 678404.417 63407.31715 51338.51479 56443.11076 50696.97999 57195.75998 LMST04010233_2 65076.54669 357420.892 301188.8469 267711.7148 66706.43194 258887.5757 148721.7016 2678122.703 80580.46342 86555.36433 123549.3867 481915.4419 273699.8032 166356.1807 139192.4069 676453.7693 1474552.575 789049.5276 145080.1974 298235.42 407098.8309 272446.3385 190478.1295 141391.1747 720258.6927 221251.1178 471438.7891 72075.91482 1042222.062 335590.6592 425688.1936 529304.4549 863372.4394 62344.18906 364372.6961 137123.1384 71093.62895 93444.27818 286246.2636 133778.2113 323527.1537 418679.0202 565986.7408 415958.6541 868162.2866 265631.2754 56274.2087 922863.6922 231429.6367 541860.5528 360273.277 432530.1569 818114.3933 326811.6779 260176.0786 1063758.909 760399.5444 194338.5827 1102040.017 69568.68348 198600.6382 627539.604 339510.8843 284106.4172 855240.458 354667.922 284237.4548 346475.8102 80791.96505 431948.4863 301515.708 120952.5617 526511.9391 614386.9365 269681.9717 76102.57432 113878.0086 865095.4805 284550.8551 58136.79361 407563.0606 537126.8656 306455.6124 64011.7998 370042.2218 79664.33051 193052.9365 313298.3739 734418.8388 48002.49006 366743.0866 368813.1449 288493.6447 259008.4246 474561.7652 63697.91307 63329.85568 225534.9243 445152.0257 1087378.489 93122.23658 59074.10813 2859298.104 624373.8438 746751.3948 294580.797 61087.34401 309919.0755 124123.6791 808041.6322 1407650.625 884007.3938 586180.4086 80686.0757 195988.0989 283699.9637 529199.4826 67090.37391 473271.2613 180552.4323 1013028.504 686625.7572 379371.3131 583373.8557 461970.9944 94909.70929 257247.4447 179125.4353 609884.5232 211750.5808 482859.3019 68845.18627 278181.5809 604814.5971 284734.5667 841086.9166 390988.5001 78003.04345 254123.9599 80854.0648 186199.5248 71940.57057 523972.1781 242432.4338 623900.9312 247749.6163 514512.9661 67231.20887 61310.75956 253726.7329 528613.3513 580743.062 63609.17368 341964.5176 145791.3093 1028482.807 321829.4143 474846.9151 653729.4301 60269.23003 570522.8487 199721.0159 72150.97648 412446.4105 461746.1204 357213.6492 385482.7198 403851.3575 149636.3109 554928.4877 436702.1904 67697.15225 60868.53919 54815.75756 66056.7276 62984.56362 LysoPC(18:3(9Z,12Z,15Z)) 122052.5337 59288732.26 59909417.77 55821757.81 35697019.3 39308010.45 45671188.36 54282579.17 26674608.49 42101758.17 59713992.3 26520965.99 70824117.13 34979603.11 17777829.26 41890205.78 36161490.77 37738907.3 8642045.378 25523587.28 46768900.89 41616031.38 31895278.71 31107156.96 40917402.45 54965055.12 57674613.75 20555058.64 22177207.05 24163501.53 84630372.39 38281974.58 45646200.39 32868107.52 10223531.07 32910215.03 26358849.66 5944999.818 22962808.51 29306807.18 34812826.36 21417603.88 21546107.81 22786993.23 17508487.38 64348371.05 33711297.03 26302068.94 58825288.11 63153420.12 36291163.05 48233922.08 30698439.02 34454461.55 15677408.65 34302713.09 25085550.66 23467533.14 62144978.8 135505100.6 89613776 18287971.91 35527307.12 54333176.69 29275481.16 20648463.95 28550301.35 15017565.69 42909530.18 17491937.81 7914673.228 61920657.13 64556279.29 54160747.44 15856071.25 39370431.07 17302167.08 38449521.36 55675870.47 25377843.99 37330641.57 27821562.52 66203057.63 46559934.94 63438525.71 38477294.18 15045096.61 55072788.8 21754601.58 16669365.22 11858006.84 80277414.6 10960608.05 56295357.89 35426579.95 123446.6577 115565.4345 56507283.78 56226145.27 68337557.75 80719965.77 50179585.26 50957912.23 29001668.94 20921738.8 35473124.92 42955793.9 59575451.58 22036625.14 33722414.34 40872466.81 41753964 17240972.8 7962018.236 71136144.87 73556769.6 70531312.83 25710403.87 37015930.86 19166318.59 47734003.47 15844323.24 13935517.99 29918375.6 117269869.3 129967330.9 21879955.56 82985454.85 56184595.01 32045415.54 41406636.04 12676100.08 63380492.25 64183808.08 63484707.26 264596122.9 55839359.44 15677116.73 45162741.64 110635373 22260302.69 33316644.76 76180524.6 41735302.31 35167071.67 21742427.3 100790495 22341964.42 21631398.31 69068965.14 54953659.37 46176587.82 87324869.07 31502105.09 22056277.1 53088355.99 34706756.2 162632254 164238266.9 31838346.89 42020874.23 70660356.05 17662007.85 40841521.62 48090817.21 39170535 41936241.44 46543113.38 69140319.23 63479523.29 64333933.69 112022.6838 125177.6601 124312.099 142629.1819 120501.9311 LysoPC(20:5(5Z,8Z,11Z,14Z,17Z)) 84899.72173 40997656.39 62559519.22 68790420.13 21587811.67 25275681.76 40633528.73 45309795.45 22501584.5 41324653.05 49217697.55 24358284.53 66276296.12 34522312.63 17255625.92 17771382.28 52146851.44 17004149.57 7543279.546 13826901.86 66656843.91 23146899.81 33444257.55 27521841.8 37958748.05 59132569.39 74172947.59 13796213.72 12558479.89 20545319.25 47830189.01 17073759.08 18418949.45 32294963.32 9629076.963 27150414.99 12246269.42 11038018.16 21795080.35 22115843.37 26144183.78 8536606.366 23182825.96 9895700.537 20869672.2 73691212.52 32333442.59 24381809.97 59560153.08 79679463.97 19584742.46 20400544.65 12234062.05 32568047.37 19236937.76 29179564.99 30258162.93 70196285.91 32769472.55 181628611.6 68134935.79 23151064.38 23317190.05 63072851.77 24503916.74 19818299.32 25463938.78 68875226.67 45637011.06 31353266.21 14025716.72 61477899.37 78656216.32 43558953.14 20303339.87 32801117.51 22001121.53 33441549 60337862.18 23654237.61 22329000.34 60798340.73 46931737.18 78408400.81 31380357.86 27268758.38 10690023.64 38568507.32 10818766.31 21195396.82 20515099.37 64034861.98 5790106.062 60625865.43 81209235.81 85869.47412 80387.29662 58416884.56 73125211.34 61802830.14 51271149.26 40529092.89 51964981.68 12393484.54 8855943.291 23770842.55 31964459.5 47368882.3 14829607.78 30375170.48 34188724.48 18976333.34 9715682.644 11497857.93 63111078.67 72141514.09 82836165.61 16078455.16 40107621.21 11947575.8 3086984.64 11141834.23 16566254.66 38092006.95 52415861.77 82063663.47 12511295.12 68335605.06 47372269.77 101206701.1 23905840.42 20396487.09 67782045.09 79786147.62 41036805.51 129034322.5 56823883.38 16683995.55 21324929.84 32216147.94 17251777.53 50002385.77 65119137.5 33513727.68 12013435.32 16497448.83 17546174.63 19282330.72 19737660.41 70755463 68507510.18 33492767.34 51984484.56 18953198.98 10406880.49 17927788.45 24446351.22 64566806.05 129177352.6 47533621.6 18512411.59 38232484.73 31005359.61 20135456.27 29846386.93 20665798.81 29208416.69 22609671.13 67961003.08 73568513.51 45617001.76 77922.95981 87073.5591 86471.47498 99212.83474 83821.12279 LysoPC(22:4(7Z,10Z,13Z,16Z)) 73010.08101 23778924.65 43031292.5 40514212.87 15988730.96 15107238.68 15866198.01 15894488.67 12765911.28 21121669.43 14775810.73 12483167.12 26549215.62 18193747.46 18616931.42 9144723.046 12086823.18 11288679.38 7708782.157 17372316.86 7400086.777 14988438.38 9162769.344 12018551.96 15431670.99 39418918.23 41670240.02 14944482.77 15960722.67 10388690.98 17408442.34 12215953.85 13243198.24 10745874.8 9186784.676 9369101.013 15224482.29 6436414.298 10505860.92 15271213.45 18358188.51 9939128.238 13203144.98 9552404.837 8252416.54 24432737.26 7754299.252 14873786.63 42990202.32 42270349.43 12953092.48 13614504.2 9210872.272 15853809.36 24825736.28 11758419.87 8043120.922 23722894.45 21504417.18 39999432.19 33450326.38 13784550.15 10685223.17 14820793.17 8961155.979 25189261.79 9755557.156 11203587.85 13874207.68 14219758.57 15288267.12 41100214.63 45636094.19 18863211.25 8899695.846 17314887.28 14093807.36 9693042.659 9192833.156 22048357.15 11317563.33 7886687.743 12253582.93 22196346.51 14601561.03 15841877.71 10236462.09 17828700.69 13377635.37 18691590.44 13379018.55 37699637.06 5516996.508 38045131.47 42369411.19 55132.38912 63459.29631 40206744.52 41623337.78 16969915.74 31983000.73 16065644.41 33831247.25 14383343.59 5256084.402 12328087.57 15145036.27 10457109.43 9482920.111 14314434.87 11456051.38 11452162.6 11061779.26 10569002.65 34219475.8 48596492.41 47034958.89 8192149.458 9438437.233 12201594.03 18042378.97 10147079.86 3838117.327 18329962.77 21286584.73 21626360.95 10806068.4 28292606.52 13381963.05 5846222.218 16351818.46 5327326.064 41088275.19 43978327.4 31019004.05 40419457.42 29241932.94 14684132.58 20645837.54 12997640.99 21315697.85 13044385.27 10831348.5 19461349.73 10479923.43 13285191.67 18350372.2 11723865 10774159.71 46124347.77 39103827.8 11125475.6 26030037.51 11771131.91 8532150.509 10000874.36 14669127.69 25463751.4 27133346.78 14311792.47 40568180.53 12108489.81 14666547.71 9738425.801 10670807.62 18457286.55 26139745.7 18597020.88 46045928.57 44069486.59 24605819.45 81449.19244 63371.80545 74914.52442 52111.32581 49060.37122 LysoPC(22:5(7Z,10Z,13Z,16Z,19Z)) 58504.30234 39272939.97 75739860.04 73565688.02 29615424.24 22974729.59 42333853.41 27130576.98 30882893.29 50005390.71 22613925.41 24134996.65 54124983.55 28268937.22 35298821.34 14441514.54 29558512.24 15369140.12 15823226.64 32979624.1 23127210.9 18971518.09 20791800.74 24495157.67 31025099.22 70126857.39 81506524.7 27436495.05 26488457.6 17964173.28 36090518.75 22369907.2 23506314.17 21335212.26 11201751.59 18366103.48 23950753.92 11851873.87 21112682.02 22664535.02 32943506.6 22444655.18 31233895.37 20894377.24 20244099.39 52940930.47 18579351.68 25593470.78 78293487.77 79870256.63 28008502.15 21976979.18 20345744.57 31132885.83 44337008.18 22138627.78 14092428.65 55582789.76 50987768.67 66853677.33 61777199.67 26142010.06 20437901.52 31112299.45 11888138.69 55652151.13 23244531.72 25287508.78 39403363.1 25251282.79 27861403.21 75617170.86 80850785.34 38734840.17 18759135.36 26543074 24329511.82 19274845.76 26709861.88 41054885.74 17753416.37 22593187.12 27011929.29 72709155.65 25995044.61 54484589.11 21285127.58 35877911.92 22581195.37 36650033.92 29789646.27 69911240.5 8503798.658 71753197.19 80270813.85 56929.32626 51626.6918 68291876.28 79794874.91 45386053.18 57726568.23 50131609.73 83019134.95 20480918.62 7317983.961 20284427.17 30460066.65 26969597.71 15427862.52 27821141.9 25258931.37 17111778.85 15914328.93 16187977.56 55265406.27 84415512.6 89810820.22 18069730.07 30627357.24 21132747.7 34641288.54 15521436.4 8740624.389 45450333.45 46251865.89 52339165.67 10148610.76 58811149.12 25692371.29 28616513.71 25862916.93 17723710.72 80539363.29 86908256.47 56655448.98 78285249.59 57820559.79 36479150.35 27981825.91 31636656.19 36868285.87 32961601.56 42126561.61 49549275.36 13799879.65 27660393.38 24601000.41 25327129.68 21972459.87 82170370.72 70212054.65 28652154.2 42848087.95 25039718.78 10350012.99 9770921.857 20972587.68 42213205.78 61156108.35 36491582.33 39979971.8 29297081.8 24439378.06 15988142.98 24637421.72 35426365.49 37389792.51 31419727.65 85136044.73 85745221.56 37244029.25 53031.19727 60959.46492 46286.37297 50296.33075 40047.69908 LysoPC(P-18:0) 50725.82895 48300.5636 44121.80846 50032.88903 45188.94269 54321.68031 127200.2663 759953.5404 46624.36483 510758.7148 42170.40098 252920.7938 182681.5959 382065.6851 306013.8783 330632.5183 417695.482 730029.569 188321.5752 688235.1016 192377.4113 138366.9022 137167.5908 241483.5804 207313.3341 157438.0343 157514.5616 146756.0755 385693.5695 267761.7828 285268.5566 206288.9648 50970.55503 177596.3787 784079.9311 336438.8072 105095.9398 204049.6094 694322.8982 125475.1195 38901.71142 497960.3221 226224.6607 521963.7528 336585.9569 423791.3886 42801.91276 412329.8286 157235.5394 177308.6272 379792.9027 249001.2593 539651.7183 218004.6704 375241.2547 416121.9829 384021.9637 1305781.5 607684.3478 42325.3497 221612.9445 79177.57648 374394.0938 613108.1829 266943.2135 362382.7691 497259.2121 162316.6112 179719.3882 148941.9051 682224.0008 45289.31312 53434.15882 601322.7255 169448.7488 180543.2346 308862.2431 42977.03623 211664.66 433551.9175 343962.0172 276157.7646 430592.9454 47495.57224 389520.133 268428.5986 286524.5087 159749.4067 408426.7351 451993.2721 445382.5826 40879.77101 304507.5495 46491.92001 132281.019 45780.90449 35690.30995 43616.13522 46006.98646 273804.513 46342.8572 238503.9708 135760.7506 207711.6108 40413.72429 317195.6 37205.40741 295441.8049 63481.73882 152390.9905 546768.2681 282901.0694 397774.3106 376092.6419 39277.66103 215986.673 50219.17593 40520.40552 36289.51172 179121.5512 46798.20374 238784.8933 39169.28325 313182.3738 314359.072 45106.3945 39432.56789 104883.9744 45935.75192 142986.3446 782518.7668 44578.70481 54644.76196 44603.71121 338008.9898 1022553.881 40698.53282 56887.39172 75465.69219 38691.85409 235916.5164 47610.30493 39768.88602 208405.8672 191668.861 343449.4397 387504.4229 226120.7104 296332.9164 190927.7378 46045.99318 44160.35669 368167.3274 358962.5207 209474.1552 36477.93414 371929.2684 39750.82534 41192.35311 486107.2574 513092.7061 206744.8461 75524.77459 217737.9319 83877.46962 301613.8852 41136.27788 320577.4133 191551.4653 49770.72536 47306.56889 46078.10742 37137.43587 42574.06444 41869.31515 41975.75458 Malyngamide H 84843.70738 456092.1625 103756.962 84581.02516 1383015.676 258441.4433 805456.1917 320155.1635 501661.4345 727987.1932 672999.6843 1050560.651 849025.1004 569144.3522 914424.563 1007832.446 884385.1772 304696.33 712429.246 998615.4114 962574.5611 1188575.333 700931.7765 1316568.299 904897.7439 134001.7352 84896.58157 844554.9258 352103.5941 1277519.85 940437.9845 1038521.21 776448.5654 812153.4781 1025341.549 1037549.111 773554.3893 994462.4317 1312288.708 847866.7266 778634.9065 817632.9488 1006314.825 1204588.75 899210.8553 739083.468 985973.8864 1088066.609 177052.3679 93357.42711 1151241.97 946674.6653 740960.9811 650496.094 666586.7603 1303149.456 1102043.148 399139.2368 834094.0228 1438262.61 1360102.917 1270214.558 976695.855 1476834.778 1071264.086 1346438.845 997360.4078 762121.7456 759717.844 999179.5558 1299754.119 152210.5529 80139.9435 1019675.699 691087.8874 554543.0522 1293532.893 500354.678 208455.482 1302224.129 818497.4026 920404.8629 978129.5959 370764.7263 1114861.744 938887.6017 1090067.144 1038010.087 644741.713 1179210.53 1122813.322 843751.6306 389352.5502 113413.5317 88839.79806 70343.79953 55012.29354 115416.7153 126782.1867 889992.9858 968993.5118 481847.243 526083.1185 915737.8099 830141.3665 833618.4208 693052.8211 788033.0663 935010.7738 1234502.723 1109270.051 1099530.97 1241112.987 1197627.446 828744.3174 382500.945 74541.67197 690789.7714 1238711.976 1244506.183 1290588.32 706352.6913 1485542.609 1126493.988 668033.8582 288821.0024 544959.9667 1098927.339 586774.5737 1352779.593 1143808.532 933867.7061 143580.447 191146.9734 1384932.468 1359521.306 994016.5358 205774.8187 1076493.59 1204706.19 748313.8946 1124351.423 813086.1301 860388.5936 686415.9524 846338.8099 1050096.802 1002606.634 793844.1302 111523.188 132710.893 690322.7378 956576.982 862584.2505 714807.9762 785941.6665 1344788.797 1214387.36 839183.5889 1528643.207 938769.8167 1140849.982 1409993.692 744930.2677 879529.3586 841783.2363 1116394.458 922367.3174 68112.07336 157360.8588 159180.9361 55227.50142 49402.82693 85936.65846 59770.74206 55636.45842 Methohexital 59771.54426 1273324.626 1548394.131 1479478.712 1085170.6 1022285.279 1173997.209 940111.8534 899297.5315 1466292.567 1237818.455 1360744.475 1642621.216 2672135.642 1167523.965 3155756.53 2403778.342 1590536.491 687607.4269 1211621.445 2397569.267 1580813.76 1012075.052 2101730.501 1489357.963 1442084.762 1479576.67 733576.676 1019424.022 2336411.734 2547086.473 1860732.069 1258533.417 1491816 3584621.318 2003334.294 1168878.93 1126223.938 2313436.858 1570648.259 2301940.566 1565333.705 1826585.357 2786963.072 1156382.583 3811441.145 1278644.254 1731326.284 1555892.438 1544790.462 1986753.299 1581804.727 1086873.536 1203763.074 1019200.816 1717901.905 2204949.724 1433890.028 1675022.7 1460351.309 3203254.654 3170031.298 1834114.614 1417915.653 1478431.338 1123596.441 1669395.9 2038896.075 2970129.32 1207454.892 1723134.909 1497000.885 1557509.563 8461307.385 909458.4253 1156558.053 2760468.981 1393985.827 1673051.718 753217.9364 783295.4801 971573.6959 2869532.949 2020601.429 2652219.609 1060710.018 955930.2074 1967829.266 1131904.504 1583507.109 1221497.131 1054637.277 919288.9715 1575805.895 1491911.55 57304.50092 49174.45487 1361697.778 1272063.733 1665153.041 1474552.852 2696852.31 2638250.765 1045014.339 2307015.796 992362.8238 938437.8566 1210460.849 1202558.096 2165101.964 1936870.818 1247607.083 1201245.523 1435139.534 2381190.484 1634951.761 1550963.742 353513.9398 1002835.864 917244.2013 1491192.386 1646733.535 1167954.323 1137331.136 1557524.721 1563163.039 1469342.911 1401971.571 1759647.305 2830668.642 1809465.207 1243093.053 1600102.344 1491519.68 2040827.636 1639565.244 2568850.908 1383321.918 1521251.965 1385726.077 2262763.815 3449869.884 1511847.521 1544325.89 1718820.981 1202174.775 2994016.483 1569104.262 2388423.182 1645367.532 1419550.388 2365194.522 2503616.747 1680664.547 2221021.048 1846744.113 1709006.853 2655386.036 1962898.882 1775265.454 3159636.741 1311264.138 1705173.576 1740796.538 2019051.79 1285072.732 1093660.352 1938874.347 1673016.525 1569577.111 1488837.038 51172.16662 48722.45174 48215.49705 49906.26082 50711.05283 Methyl indole-3-acetate 38079.75397 5018140.108 5985678.67 5010466.776 3104841.618 4374455.992 4689155.233 3956251.715 5414625.364 8473952.869 3691235.077 1269811.289 9687149.159 1068931.346 3675977.698 5795104.381 4141085.859 2038498.154 5716081.258 5750105.334 7608783.811 5226161.332 5015147.94 2295567.695 7383881.839 5378584.102 5181518.701 771582.2394 6432296.118 5690145.143 1360824.624 2993231.284 1117073.466 1067786.575 5328589.433 17863334.49 5015141.973 911093.9498 12562695.83 12202529.81 3345703.953 451568.8524 3228280.469 3276383.283 2311824.897 3804420.666 2877931.607 3495262.885 5941486.649 5456394.246 10236395.74 4082344.682 2168048.575 6637608.745 4008583.23 1895129.771 1495740.614 5737968.1 6586791.567 3211012.356 6736507.775 2481413.945 3344534.499 1494810.057 30687357.24 3443438.399 1158119.125 4719182.259 1652314.066 1566909.203 5535725.875 5688205.949 5596594.576 3751268.942 2232354.127 1094016.128 4177104.689 2284794.599 7619543.798 1019661.787 10122584.53 7461239.331 2282314.66 1571451.229 5988298.82 3697457.692 2327406.976 2668201.294 4420002.924 1540098.933 3123914.853 7278434.568 1565914.873 5730498.268 5505075.588 39637.29818 28923.26235 5500753.944 5306578.049 4978040.304 4950544.266 5017263.423 4141095.508 3804211.895 24239962.8 5455862.993 24071670.19 4462761.38 6454110.315 3367537.407 7043007.346 10743335.17 2072837.479 3675453.257 3800884.522 6141364.672 5806043.642 1165099.955 12083360.25 3139500.26 6151046.179 3909432.87 9790005.311 3671726.75 5072001.674 19344124.44 3867867.513 3525563.521 10183582.63 35611857.87 13195767.6 13875009.64 6128639.251 5641288.122 8143731.058 12968993.11 9768656.903 5711389.573 17277005 32391423.32 6064106.042 14865837.56 8476181.9 8005309.847 4355770.393 7052472.333 9741991.364 1075639.038 7314016.991 6688171.725 5307468.624 11468147.82 4233990.474 8369914.367 5536819.357 11659690.64 7068387.747 9004982.131 33624791.66 4518111.866 7537852.21 20370046.21 4716692.869 15185099.94 3331435.93 5730894.088 4851646.33 3178499.707 6378841.155 5571673.219 5330816.879 38742.43468 35530.5218 34934.43669 35878.99558 40567.63617 N-(2-Hydroxyethyl)-9-octadecenamide 77686.53098 3575929.706 6564526.164 5454906.419 8672467.11 8868826.096 7668847.279 12497122.27 6951690.768 7559390.673 4713132.388 7575340.954 6804994.519 4908629.541 6265524.25 5121423.735 6747025.859 5456792.893 5208312.367 6684807.719 4713779.545 8801238.87 5791992.562 7058556.602 5423718.46 5278733.004 4490918.672 6635170.548 5535369.451 6648085.337 5264894.19 5305541.379 5545612.325 5477138.592 6083117.095 5699165.523 5973714.852 6741885.435 8224319.504 6081747.947 7067852.476 5464223.74 7993996.237 7231846.447 3362987.671 6877067.727 5492147.033 5356478.972 5667215.633 4901713.194 3262580.07 6385370.981 5191984.938 5943322.116 5183589.844 6514695.381 7251557.814 6213602.583 4829971.116 5060260.674 8585122.9 10276973.95 8054970.567 5876692.487 6155065.81 6665867.378 7987752.956 6740130.875 4581290.93 7540268.29 8599120.646 4667325.972 5002740.538 5014066.909 7524423.038 4907086.227 5316935.985 3933148.895 3905968.827 7116570.792 5756562.909 5583391.879 4498428.095 3977899.759 3785899.956 4210684.757 4931099.896 5482316.01 3989257.87 4989958.167 7312233.164 5309472.766 4592260.018 4331819.886 4872005.161 149297.0706 366802.6834 4816200.641 4686887.731 5840499.952 5602051.892 7498884.776 3827274.864 5404083.429 4481505.264 7451871.779 5895778.85 6493840.952 7069786.59 6421908.024 5217299.053 3912640.385 6454805.59 6957293.082 6956426.832 6282337.262 5687035.191 5767637.583 7226306.826 8034854.095 5607722.035 7122182.422 9604546.231 6202943.35 4267603.008 5231331.871 6166523.954 5523379.487 4794959.754 7337142.955 6931224.952 5913444.514 4744466.631 5427225.345 4245456.693 4766580.461 3399874.984 6296033.135 7601197.463 4669618.647 4164197.836 5729441.097 6753921.809 4955170.667 5386094.624 4477899.191 4895848.182 8175527.309 7398819.893 5198523.238 4550547.069 6096638.534 6668683.271 5351501.279 6491617.184 4152959.056 5534513.42 5032274.734 4940350.47 9943933.825 5995371.514 6107521.143 5871785.247 6228422.93 5310579.341 9956534.57 6907218.338 6333593.433 5606277.139 5389446.325 3024588.073 751023.2469 571925.8566 147698.2617 163617.5992 166784.7551 N-(3-hydroxy-dodecanoyl)-homoserine lactone1 36459.13482 958547.7753 803841.8605 822056.598 1204149.51 1358019.892 812141.0161 1859339.795 774663.6407 819214.6182 1004453.402 1283184.511 1359607.947 1346644.839 1401020.518 1153551.771 1372403.459 1690643.196 745987.8251 903721.0894 1824961.437 949651.4452 1511209.775 1640202.54 1307096.65 733885.6427 982076.8093 907055.2726 1269612.143 1396261.268 1649252.797 1185787.387 826695.0701 976409.2209 829484.6349 1253448.029 751071.7669 744444.9564 1220647.153 1742109.529 1076723.043 1131362.85 477188.2384 1334827.838 706245.5909 1799016.86 1299210.8 765641.0827 837359.6475 869742.0158 1040690.645 596512.0189 887022.8204 987070.3243 906908.2677 1854745.016 1854447.183 2237015.41 938422.6774 803588.0514 1407125.886 1362654.758 1120988.721 1459394.258 1185323.744 1100227.228 629162.6341 3264165.92 893604.4681 878064.9268 1387818.896 839784.9504 908355.9599 982545.1478 1099369.581 720423.1629 970323.6992 1103166.345 1225068.708 1219899.286 575889.3548 2399918.793 1099072.278 714259.5106 715219.743 751660.6745 1270960.635 750716.8917 933227.4581 776937.2729 1021222.063 803759.7556 565892.6921 802802.8459 982576.8139 38139.99021 104551.2074 772759.9541 1013490.719 989883.1028 794352.0846 1717203.438 3290720.814 632398.5081 985919.8177 726609.0252 766920.3512 892615.1821 1283641.183 1555392.889 1618547.071 1793884.115 889093.809 844592.2331 605820.9624 1138274.876 1172867.148 892183.1907 944840.6746 902710.4908 2393136.338 1360007.938 1343364.355 956001.3391 930800.7994 1280756.082 903240.9062 897286.001 1363880.255 1030374.756 1362175.33 1410194.953 857483.6724 1052439.277 1280391.523 714850.3541 950705.7311 591349.9625 1140270.688 1955519.341 1344369.585 1169630.836 824955.9957 1060090.45 1058246.095 906458.0424 835228.1831 1237486.604 1368679.142 814786.9681 733228.1391 1501676.079 1158440.609 885540.6526 911355.9758 1225772.657 1862985.635 2293649.108 1438374.709 1187276.24 769391.4159 2221870.743 681263.9375 1193813.611 877745.8868 1227256.002 1850852.123 1025837.709 898194.6693 1039917.067 1159313.155 33137.8547 55372.72362 45167.61461 40997.236 89794.35913 N-(3-hydroxy-dodecanoyl)-homoserine lactone2 31022.10716 1280353.075 1024642.898 1150560.565 922599.4436 6136221.531 384227.8054 3502314.253 604070.0492 435690.5197 2769811.892 819656.9999 1394643.276 1467798.131 1077045.092 2124764.102 5730960.764 5914030.573 604070.3662 928499.6921 1819973.924 1254126.49 1168983.384 1923750.779 912651.7782 960614.1432 1156473.805 1167655.55 1082366.998 2283787.116 2165043.355 3873755.986 1283107.167 1224501.627 933645.653 3059154.194 1570059.756 791397.2599 715360.8368 1698974.13 1877319.651 828654.7378 1096397.448 804981.3594 736481.1627 1384740.424 1394691.267 485986.9985 1019064.185 1134383.634 1211385.01 769587.5632 232290.1347 1169427.142 477907.2123 4554993.838 2419710.77 540755.9348 609557.5964 1741097.018 2231963.465 859877.9623 1707087.58 515051.0825 1345254.893 1026714.275 679237.8094 2344749.922 809832.9665 4131327.095 955526.6736 1008471.881 1156283.331 936355.0805 442517.8287 790000.7152 769014.3285 999141.6691 1066036.814 1030896.813 662705.4555 958390.1552 1516944.645 672397.4294 764915.1364 521708.5441 586184.4424 842212.8351 776312.9339 633742.3112 531033.8279 1801091.17 427351.1284 954252.015 1045408.668 52812.6935 26986.25167 1014660.231 1065641.777 1635343.117 2377452.286 1302470.4 3579850.628 1157302.808 213253.2172 707058.6053 739616.4888 839324.559 529419.321 773542.237 1102327.167 1418387.947 1710129.22 457367.1553 607466.3383 1265154.66 1329395.858 1506715.88 637364.552 591340.1637 1896872.49 1812758.772 1469090.485 800799.8294 1278755.502 480580.502 771962.4766 871242.2146 1738277.711 2125690.58 3666779.837 706373.1613 1178218.723 1275914.425 1215006.628 1282058.544 1223107.936 464984.177 1452473.81 855488.4458 1910817.43 1032352.634 440028.6299 779152.1351 1577905.605 748281.9644 365272.078 406881.022 510333.1495 1298511.522 1138329.046 1935074.52 696187.2133 1038533.511 768829.4167 2289372.97 2549013.704 2831034.268 3137592.624 885430.3233 3167859.409 1001999.78 970530.7237 1915126.964 1233143.856 714922.5109 1017179.207 660708.5968 1153051.026 1267434.311 1446104.98 27206.92652 65045.47266 56272.15278 39278.55451 37198.026 N-[(1R)-2-hydroxy-1-methoxy-methyl ethyl]-(4E,7S)-7-methoxy-4-eicosenamide 67390.11251 404600.7869 449565.479 448828.4155 274766.3534 78153.83913 566271.4345 4116404.386 503169.1762 481089.1606 450775.3614 223237.4693 111741.8328 1076305.811 467000.2058 578136.0741 759223.8716 1826319.984 402605.4169 684247.2737 415039.6092 2548511.985 552423.2947 179952.0286 337905.5804 550148.8002 469994.5714 199304.5956 610651.5824 451185.84 434998.7323 269510.3171 909654.7694 740215.1097 457798.0637 235975.6301 577557.8035 237576.7123 822732.9551 218637.9368 1214138.405 3673065.217 684245.0632 1033408.617 1057515.376 541128.4612 730458.9565 418873.4846 535130.6792 574146.6353 457743.4975 2462887.673 156224.557 854904.5229 782768.2839 540475.3037 335504.8675 812301.5904 1268713.756 311170.0083 239865.7789 115743.0596 641723.0554 122018.0604 3111088.041 905594.4575 211798.5178 224596.5077 67752.84963 163423.1786 952464.0123 500693.6261 614635.1908 689264.6481 2186444.46 1119780.17 616492.4166 84062.73333 132959.9698 1812552.595 3147241.377 343463.6092 252891.7054 140097.5705 539667.7 411063.4112 2159160.482 248741.1446 1584775.905 750754.6683 875363.7325 2477789.989 649402.5708 397486.2899 477289.9441 48959.76236 46679.8713 431376.2455 383560.367 348373.6279 141232.9215 160270.2083 177647.5705 1496795.469 186251.2569 684767.9078 356591.2996 309306.0622 70413.72015 367852.4674 85056.29839 526561.1306 4215151.644 1222727.634 121479.0626 518573.473 448220.7783 231310.7815 404443.4167 173795.7168 618251.7047 460971.98 816905.8818 2051891.203 107258.2119 158508.2917 269823.532 500326.9177 379662.3696 456501.6418 489711.8826 86778.22124 394918.1411 593813.7637 565932.8384 815829.8859 675466.5789 1663737.018 737379.1118 162229.1215 607956.8208 503423.9607 261442.901 787455.1683 724911.7263 1009143.482 422467.6808 77343.39746 131534.8414 465262.0836 534441.4163 458562.7533 71299.59786 151325.7554 780919.9558 263381.8235 1332659.439 82519.38727 706244.5714 204226.9584 103891.8871 936130.1027 56522.88375 429079.743 921817.7318 486309.6508 109198.6365 332996.4992 573703.1143 648123.3322 528712.3566 44571.0096 53031.98629 49905.47913 50925.66653 48091.26028 N-{3-[(4-Acetamidobutyl)amino]propyl} acetamide 35584.02272 4312701.921 3307720.357 3830825.638 7408920.189 2382708.947 3865040.63 5147911.578 3456201.507 2275053.532 6780430.726 899750.612 6025363.331 7823727.964 10263214.04 4434801.521 17152064.92 5673978.565 4077183.438 6802867.24 3658912.649 4188312.224 5169614.663 7194472.309 5626585.207 3720333.418 4608293.874 6591182.801 6146506.51 9607666.081 4810155.024 13581236.97 3386664.817 7565455.824 8369352.144 6661084.63 7186422.497 5473826.895 6036157.158 5912306.057 9071016.782 6170241.627 6976655.257 7612062.049 6940260.726 6391264.364 6914501.772 3620764.593 4188167.035 4814225.705 4174806.718 13054123.99 5220045.957 7518549.65 5786741.519 7785553.784 8885979.164 7477374.304 7364610.219 7680208.052 11667689.9 9714413.726 10093849.68 6907246.056 6508796.553 9665854.44 7657119.671 9887558.958 2851749.756 4966936.461 10413476.81 3598689.092 5681072.612 5297794.323 4346884.683 7560514.552 4412909.623 5281385.64 4968788.952 12438337.47 4191223.726 4384480.017 7058834.141 3101934.554 2527174.549 4804480.294 3759230.346 6558822.92 4471426.377 5518039.583 4389934.242 10839776.86 4506504.654 3305756.027 4330527.825 36581.36798 38406.09997 3624018.107 4348755.273 3899452.891 4956550.581 3747544.182 3936394.215 4964820.301 1740723.662 4565812.305 7597622.706 5283853.325 3737749.858 5379474.071 5305071.745 2763595.89 5851362.67 4267196.541 3859364.878 4188487.774 4703397.103 4079691.068 4200016.365 5980260.978 7563926.479 4835067.478 5073418.233 4852704.487 3161635.51 4716695.691 1689263.791 3338219.454 6791636.623 8688221.361 6723972.024 3881566.616 4179594.385 4542124.699 2236094.904 4580070.298 4547396.5 9999153.867 3303032.84 3071388.131 1393267.66 4621996.7 5313819.921 2735356.291 3000417.979 6177271.785 4927134.819 6218627.638 8413309.345 4277047.534 4654521.462 8773964.768 1922023.125 4000314.614 5581818.202 4347010.592 5615986.084 4713486.441 5998864.492 6737577.728 9455076.775 5192723.721 2760061.293 2932464.394 6182688.008 5574268.809 5488788.811 4033802.219 4749203.588 5737310.993 5788748.244 35026.44086 35734.1217 36251.68691 34418.96648 39305.11627 N-Arachidonoyl-L-serine 41894.81612 629645.2651 653393.0079 731506.4738 902143.689 990761.77 746174.9215 3535321.324 586564.9511 580509.7618 1108007.707 1747929.777 1540404.56 1874373.612 1845373.87 546233.0873 866802.0806 2717448.5 765343.7664 1683372.395 3013793.593 1093302.534 1503879.317 1379099.216 1871509.96 488670.6363 597154.7917 1249331.933 1161293.357 1376338.129 620671.298 866969.8117 670370.9463 1206748.862 1273018.604 1266378.438 653223.9626 810075.6894 2013942.911 1253152.047 1681736.183 749061.98 1447039.485 1106825.541 691897.9043 2149787.399 1190231.883 561697.2523 511519.2291 707410.7951 726241.8383 518770.9785 356625.4814 1168078.148 1004049.682 1567232.969 1745525.528 1335587.317 870399.916 1731224.706 1673095.091 2182611.94 1555425.478 1246198.519 505089.2929 1472656.834 939608.335 1629283.82 1595603.632 891498.6023 1646309.98 512534.4411 717591.6431 1284129.86 480130.4867 663810.0084 1313609.963 582438.3163 1517951.432 693950.0743 569089.0377 1510039.668 776598.2753 391388.9216 516129.1505 789117.3787 797301.5823 825757.327 772703.8912 592636.4205 1120144.34 997788.3808 458065.3634 439197.5412 744474.7835 31730.8951 32169.89723 443687.351 628059.2675 624572.5438 887691.4506 2776318.443 1282224.122 541697.3843 467642.1057 1499096.808 1025319.77 1300742.543 1645194.404 1527395.133 1014211.362 1801176.949 632605.5518 1228962.118 402819.4837 648045.8908 1021276.851 564248.1004 1008622.106 1267583.305 1218590.639 913887.7167 2909721.209 1604816.934 842104.7083 1444838.025 727787.795 2706003.582 1106157.741 2138403.541 1659359.762 2892536.342 604096.313 821628.9246 2178008.242 691991.2669 726894.1418 486583.6675 1528489.717 1508679.613 1409529.383 2445011.228 2550605.394 860234.2892 470787.1594 437553.5241 256665.8837 1199824.886 1281868.623 639307.7598 689583.282 1314989.414 906112.3697 1126959.647 829055.6536 931342.7491 642356.7396 1952830.777 616144.8276 4818563.527 1188844.404 1617389.751 1907377.613 1239573.709 507807.4492 948503.5455 1228065.668 582845.7676 630139.1648 822680.204 637625.5348 36798.2013 43505.24989 43442.65268 36403.00046 35853.84541 N-Benzylformamide 191283.4396 13727839.42 15480945.53 16524952.49 13244091.12 24696812.3 11908985.42 17121195.95 13399253.64 9300846.76 15782869.29 20459987.37 21208335.97 20915726.51 13001245.45 18433942.15 15975919.46 24789104.36 10057709 16538622.03 21401285.31 21508278.48 15258352.46 24716534.3 11971088.44 15671101.37 17443729.55 12497716.47 10436172.7 17099685.91 33007243.2 14196969.81 14775225.85 15219228.68 21292282.04 24701963.35 15784786.67 18246007.65 14592949.06 20078865.31 12051272.73 11225506.15 11037600.35 15958189.35 13992975.86 21971623.03 20118218.05 16405099.11 15659240.33 17791012.55 13303949.66 22922987.39 13147835.39 10975295.89 11777197.02 14029470.93 13530436.29 9955313.859 12435383.91 29024534.01 20605409.31 22877223.56 18276286.41 18065415 17724020.94 10820473.33 13538248.77 15485826.08 18540870.79 17206289.26 12785523.49 15186476.44 15420263.88 23839667.3 11217102.73 13767187.01 24148902.56 17228132.24 14709339.04 11907317.02 12973305.53 12850327.26 18660169.84 18482122.83 30488666.69 11188553.37 14244926.75 15075256.81 12070149.66 19503193.99 14208894.1 18544740 5707671.174 14072273.87 18241690.12 341074.0301 205219.5863 14890549.5 17890997.76 14856111.72 17996744.78 17137970.07 10990589.2 15033746.14 12147925.08 12937756.54 13075863.45 14153251 12398294.5 15310617.3 21644841.78 14204950.2 11823011.82 11444446.63 10899753.81 15532022.05 17576125.95 13624456.56 11805768.05 12375769.02 13707587.15 19186897.8 13489309.3 14796158.87 23979185.65 11940046.32 9419707.875 14513102.26 13146543.14 13461767.91 17031291.75 10795661.79 16432823.65 17752031.42 11696107.05 17426189.35 14945645.5 10537562.03 12350271.41 15923944.82 18970718.09 15063564.42 10370439.46 14123072.15 22323312.15 13072460.6 11601549.13 15465118.56 12669917.93 16957438.48 18604861.32 15180865.56 21140038.43 14080451.92 16028635.32 8979610.901 13664566.17 21510960.53 18440657.29 21863495.42 13389433.8 13708291.5 15888266.73 17380628.13 18873720.47 11511992.37 11768331.79 18837641.94 16056758.94 17170308.34 16412702.11 946621.5495 451880.8133 377357.756 171811.2539 84675.02811 N-docosahexaenoyl GABA 56963.19577 15722708.74 21775152.51 35394827.31 2998689.013 4894226.801 2136727.788 85726245.52 1436950.838 2432973.417 11954913.62 5522262.702 1822451.8 14971797.62 2841809.008 12518803.06 36431981.81 15451600.56 8441742.947 6968924.561 13199516.53 49289460.02 32474054.55 13323441.62 12381730.76 24690310.04 42065401.31 1827903.635 3664376.619 9200439.073 10610622.36 4606664.49 13255723.47 54862065.09 9744870.878 3002550.337 10525543.04 9717154.282 4765175.911 5644980.323 9711667.284 43006701.1 7078915.371 47400904.17 9968570.827 15318027.06 7605031.632 6247669.126 25286579.81 43752406.6 20418754.7 31449785.69 11871623.29 23137402.07 13628682.87 25035514.16 16377605.23 12029410.61 28493824.21 11172807.1 2856492.018 7403634.749 16009654.28 1277634.83 45404448.51 8456478.989 3865589.327 6961342.839 5193671.075 10950701.98 20817024.57 25492615.4 44168073.98 14807048.03 6503533.209 61852422.41 12653795.44 21071178.39 7571570.272 66675765.06 33337057.67 15199855.85 2673073.002 10390064.49 12557884.76 10993555.61 7414920.315 8675104.385 11510529.13 12961736.73 23967837.78 58479107.34 4747804.344 23603936.68 43622421.71 56991.12967 54291.15255 22996523.9 40926414.73 9122700.11 2181498.026 2175948.274 7460900.025 25617313.85 4924645.431 26200346.91 3079754.33 5125660.038 3194659.096 11508613.65 4447095.028 11112061.04 91699559.55 22535645.34 2489716.64 27830437.05 45877908.39 11863369.48 4298501.261 3436125.209 4933061.649 12716562.81 15121783.94 51961335.4 4207177.215 2691781.808 10695381.54 15831594.22 4866658.22 3704524.942 8340309.483 994719.3405 25430739.23 41764583.25 3590096.213 23874524.73 4305393.312 4400907.673 11818840.3 6284531.502 10830226.1 5096822.994 7851677.522 37557906.04 26473697.21 4101475.152 11665991.08 4601844.513 1064134.701 28094674.57 39075419.08 10827434.23 3552033.501 3586171.044 31923480.42 27121811.31 37837599.28 5286264.261 39801341.54 4411336.73 3421858.892 24540719.72 2859310.726 11973095.57 11514641 3726520.395 9323245.91 20565051.71 27040032.47 43956520.09 20433198.99 53017.24625 53012.74887 54348.37869 57251.22069 57027.09574 N-linoleoyl dopamine 26291.6243 223042.8296 617326.1161 274973.0629 35074.75189 36010.72535 92032.35622 31245.79947 523570.2941 31462.65224 33806.86736 2871598.511 55859.90546 24647.265 1384831.467 411215.1511 502847.5581 108882.5904 33672.17846 1385947.173 513887.4578 317071.4235 31159.18039 4937053.634 31546.49417 561793.2723 299840.0734 31479.27041 464089.5624 70088.33985 265639.7835 129420.1131 91441.65252 30907.88229 1916363.913 27148.38896 45649.00381 29073.39055 1171046.611 53152.19905 218452.0257 31708.17591 28800.88865 1790214.415 26781.23718 98146.91772 108581.6828 29547.53428 609939.4888 305514.4493 312647.372 25594.70471 197067.1208 45565.94669 73198.0743 27960.68732 25554.20602 74524.73163 790686.577 27628.91495 833505.5879 28976.1536 27115.25288 28846.40435 73782.02163 4497840.502 31004.7187 79707.41447 159687.5831 27133.75523 24440.00614 538566.9724 312769.3039 1443911.533 30592.70691 2440580.257 36343.88202 32131.01327 28012.9924 32858.55682 26997.39964 605521.458 24739.24508 27170.33506 30354.09356 90421.39209 27757.50108 865355.9137 28250.74437 24895.27825 27021.76367 26688.13275 28879.82561 541563.7257 296065.0668 26185.80308 22536.47683 551238.4143 292885.48 102270.5373 32273.25087 1096992.323 29749.78807 867352.8559 185305.0956 28151.79888 22795.14549 29617.83449 143515.732 3316262.476 53210.39353 26351.10266 4718986.998 24821.50048 28005.97594 658447.3488 309540.7294 24432.90089 25739.865 28625.96977 27352.57154 1435715.459 28679.2659 24072.29492 4159183.972 706798.7922 58000.1646 33831.39373 57081.06449 29064.83841 271867.4192 28198.03511 600313.2039 284658.4405 31479.54466 27493.4107 661703.6425 27142.78889 2009944.943 3473098.279 1001662.567 30033.39477 365564.3098 167253.2007 3640394.053 92374.1217 1372654.598 26184.33556 785070.2142 616045.9689 237571.6143 26895.22604 4435065.727 31568.94988 1485685.047 28067.5432 3761217.241 248385.8869 1105170.653 31993.96025 243739.171 24055.76351 28858.61308 650989.7203 28588.41285 1799078.125 80716.14365 1465833.903 640558.1846 309235.0048 268136.6268 25859.23021 27296.40397 29615.66016 25687.13204 25538.36271 N-oleoyl threonine 64272.89145 486830.6158 424047.9864 525154.5254 858968.0636 811861.8074 395989.8359 2513551.154 433980.3078 434194.7976 353730.9624 554841.7759 831546.3081 606262.4569 1222487.188 344952.8808 493062.8319 1087889.432 406616.3626 650393.436 1037707.257 433270.721 989453.542 946440.413 1063980.683 426630.312 508658.6617 1148295.789 713265.6614 622760.1789 575699.0591 633559.4862 584334.6074 462776.8755 491863.8368 465638.2347 555057.0011 517829.0338 836006.9644 530889.7177 466896.5879 667496.3086 815648.2017 684152.0972 250347.3878 633803.7834 454900.7446 340393.1369 473632.846 522685.8202 790036.6383 384551.1278 488318.9052 938269.6514 790401.091 1279821.067 809698.3935 679742.7139 578963.979 532423.9204 957562.1219 1177534.31 807716.4239 493874.4591 240751.1157 840003.5247 371305.5871 509610.2648 700211.1078 616473.7257 1115760.549 437475.1504 560987.8235 574727.9057 634161.2465 518400.7586 563626.666 543912.0691 338682.2815 1097312.554 519100.8972 907821.3707 221397.1684 56732.41562 373534.0299 93721.10551 553825.3222 356203.7761 672707.6004 282210.7457 1023081.508 303620.5578 230094.236 427072.4139 642101.4668 48667.65743 39247.04703 318068.771 486054.8969 411735.7114 377016.1361 1081502.241 497760.4359 339088.2511 434948.1716 893703.0486 431706.5884 638751.2358 839452.7178 1404080.8 483474.5884 868478.4929 449802.659 739883.8441 277343.7526 674690.0819 686708.3113 935212.759 784511.664 810604.1031 1071335.701 496611.7153 976928.3729 1368134.845 510974.1268 872801.9024 659530.5055 1089416.963 761131.187 694981.8788 943103.5652 854089.607 405842.7597 554888.5243 1086895.004 521073.7397 495195.5024 310117.2558 1532042.635 618142.753 889355.0528 1139939.89 762916.6586 1166911.034 359976.3952 363136.4176 79072.97711 931661.9989 908886.8287 463900.1787 484053.3731 600687.813 468502.7121 520281.0613 483708.3491 524220.3697 454507.091 1079743.108 487541.7832 1650242.487 997445.8532 1221154.322 885892.1918 889710.3633 300419.9175 692813.5118 1028383.126 426061.7938 548978.9558 616679.9199 572759.5789 49481.44571 57764.61888 47028.91976 42640.22751 41501.57075 N-palmitoyl glutamic acid 63906.64364 1322903.229 772976.3801 1295608.043 2833417.974 1478064.687 1881596.182 2828743.97 697738.6423 1947645.285 635494.6949 2082139.092 1656171.804 1741595.704 4161440.394 726298.824 3113975.236 2235338.461 2803087.335 2311158.157 1220379.301 2054302.739 2718467.204 2043389.275 3515193.261 559089.2507 569759.8359 2794558.059 3327189.675 1794326.252 1833134.896 1803099.943 2219387.105 364733.2797 1960388.454 1056466.947 1684373.174 1629144.13 4320426.28 2308473.705 2025675.515 1811174.593 1310212.694 2523426.886 1838665.578 1849774.643 2605998.562 1485248.98 700894.3556 630476.4214 1341017.648 1310119.292 1602034.459 2031454.295 2345245.62 3169920.477 4285537.699 2919982.219 2285746.535 1393835.09 2765795.432 3483782.371 2684278.378 1170368.827 711722.9564 2907758.552 1431312.715 2272190.615 1832611.537 1882264.715 1456071.582 1195864.248 698583.7454 543453.2963 2412256.545 884442.3041 2321728.37 1073977.866 398988.1948 3571464.213 1628980.939 1778202.095 217586.8532 397265.0522 1265615.858 1310343.555 3823694.686 1598354.257 2355810.042 694662.4706 2964151.385 1774483.947 1243437.354 647289.7005 529539.0601 39030.51425 44377.08812 481943.5096 525482.7641 873878.246 1346306.974 6782823.33 1842729.495 1372721.8 961153.7423 1989374.293 1005881.012 1927776.983 3459907.361 1795941.242 1964901.994 3309679.45 1220612.882 4339166.115 868972.7023 903671.3189 679785.1637 1309169.52 2206036.124 2017416.298 2405629.279 3548099.607 2475349.165 3733785.848 1343306.596 2454053.663 1094558.149 1811584.873 1689754.352 1144997.275 1332506.198 2138827.426 543601.5808 851057.0519 2879387.472 1410298.686 1948017.004 1364293.418 2068463.536 1218174.191 2088587.033 1809306.921 1752707.418 1455904.763 567174.449 926539.5409 1058116.644 2985622.702 645068.8694 589283.8281 612778.2976 1564624.608 2228902.214 2496897.086 4205161.062 788290.3474 709508.248 4067284.201 704771.687 887962.6324 1536850.69 4091540.025 1760926.467 2222335.127 540604.8935 2214758.969 3594893.238 2746085.887 960281.0508 757631.6762 1723364.44 44309.06548 43271.51118 42525.05264 49526.79038 45070.29622 N-palmitoyl serine1 59975.09849 919097.4805 641213.3036 504400.2827 1356353.464 994049.2029 437740.2524 4696962.66 527551.9484 1181104.733 423891.4731 1127683.701 1363930.663 1744656.874 3785047.587 980785.2117 818234.4201 2902917.782 797348.4153 588398.3053 897012.8844 642165.8992 715141.2459 1355980.775 865333.3266 483497.1997 653805.3863 2194508.094 1560968.876 786204.0717 1225010.531 1082432.668 935425.7511 470033.1707 460795.6844 636997.1576 1274918.486 1083526.16 1082055.841 947894.6665 1132020.739 1815804.163 1128303.347 1530831.185 281954.0917 1489261.943 1026169.26 551814.0259 693460.9054 688295.4613 1648339.981 810077.6131 323001.9777 1358502.283 1394373.689 1803614.386 1417454.261 1350194.821 875372.5892 985226.1685 1423734.499 1268931.162 798919.484 526922.8696 410544.4378 1831871.546 432232.1641 560626.8909 784128.6745 811412.7923 2317579.273 571170.3216 698677.3595 816163.2577 913646.3292 1195678.811 1074606.385 1774170.634 517352.6936 1154310.89 336345.3229 1983897.035 461508.5161 137773.2991 481850.2924 667949.2017 971845.1551 694575.0064 890429.1358 427707.7028 1060710.923 1264184.299 516824.9273 632601.8297 668741.1512 38199.40899 38040.10573 583907.9776 622813.0094 1118695.428 665060.0699 1501223.344 1124539.594 941691.5402 856449.4375 1000015.51 881666.2702 1252960.694 891687.004 1613702.518 550780.2391 1939064.953 990888.6638 982216.1707 584905.7122 763370.9467 723900.9966 1150031.58 1051506.479 1269080.192 2075150.872 1798449.831 772733.5079 2567443.576 677207.2171 455766.2543 876209.2272 1190996.258 750795.1709 708345.5472 1831542.66 1356849.634 731737.3097 804659.517 1683303.251 747083.7354 1278944.494 445800.3436 2326298.625 868657.703 1135261.69 1084606.254 633703.4556 1690727.898 481636.1909 353647.8164 118525.9345 759313.3591 398756.6992 747930.5068 667244.2359 1370936.442 662973.2185 1530350.125 664811.8329 1134123.528 1945082.743 4295669.71 1051625.271 616890.5443 2020972.704 1626560.788 1192950.576 1319616.288 431880.0713 1099353.729 2426764.141 804015.2679 715128.0961 707930.6031 1023168.638 42446.02351 35830.91527 50943.16745 37380.27426 37090.51135 N-palmitoyl serine2 41137.7276 9976976.195 10722991.4 10291386.98 19527730.86 18385323.67 9726920.35 48242855.24 8756792.687 22971515.27 7502851.058 20383219.27 28259461.26 15807588.47 41575749.98 8161412.741 9791617.119 27352066.85 11106478.89 19009518.07 22976224.79 14316807.71 23406679.03 21475555.95 30989038.73 8833067.084 10262522.33 55692063.26 17173502.85 15254807.1 11169839.99 12076353.17 13209248.07 19726408.71 16291106.03 21130035.26 20530676.81 12989963.36 25619072.42 27194386.99 20128846.91 15276530.02 30396510.15 17253872.92 6840468.514 16280173.23 15375467.47 8039776.418 8889387.419 10942538.96 15696590.68 5379686.526 10806160.06 24094087.36 17721508.12 22546051.87 23840803.6 18418208.64 15782722.9 10421276.33 27758317.08 35942140.68 26255565.56 15822789.02 7484145.376 19392822.06 8607957.238 11166121.95 31886683.19 11032639.06 28859658.77 9384922.608 10421685.44 25002760.37 9721875.847 9329711.141 26585839.05 6365418.624 10433708.53 16649423.75 9573956.005 13768446.95 7379691.195 4305010.859 8910157.338 15448357.39 17687369.39 15659007.74 21001576.48 8699467.966 17481904.07 12035603.55 5372246.583 8356504.051 10226030.24 42830.80833 30624.74043 8258931.357 9926066.095 9738217.734 15630302.92 36374007.17 15596202.41 12649320.91 6727550.186 17102887.75 9984713.037 14038223.85 25406847.62 23600783.66 13424747.37 18727190.23 14806658.77 22841008.2 4980102.419 11268743.54 12439068.12 21882740.64 14908994.35 28844578.26 19292731.41 29648161.11 22501776.51 28233198.99 9608300.577 19401539.11 20230361.91 47334227.55 18962318.66 8500651.942 29008591.12 25598232.2 10326013.46 11510593.22 24632484.3 9026928.138 11841605.98 9438541.984 43910809.39 16575388.64 30640239.74 21110507.07 24944765.66 17901363.89 8515834.601 7118127.272 6663354.52 24323481.8 24329926.99 11246374.91 9990437.16 13965713.94 14519572.74 11410738.82 19269707.44 11145390.09 13219878.87 23913884.41 8961978.022 58129920.53 32840248.7 18496145.69 16698518.7 50763357.19 6539918.946 15936413.47 37491089.49 11908492.12 10450813.61 11959563.99 10224287.74 36385.00216 39952.32348 40848.53609 38833.86939 54992.63632 N-palmitoyl threonine 59548.51337 1211820.323 828971.0447 813026.5157 583026.6459 518938.7341 249877.92 786330.0758 732579.8254 446716.7433 711622.8747 560771.4627 641541.179 645347.1601 511194.8771 619848.1092 649354.8087 748295.3957 668444.7234 482595.784 326548.0174 564671.0881 312707.3934 536649.5021 670603.5948 648086.6636 662964.4886 403016.1167 703018.1012 758449.5018 820531.0989 483141.1042 904746.8532 236975.9889 608876.3581 706200.2608 712677.8642 178006.673 746051.1283 858481.1234 370816.0899 633585.7239 656066.6656 621050.8209 612590.4594 577383.6243 732198.278 246291.3969 549404.1774 758657.9856 605348.3336 602754.5877 591237.6134 671697.3107 263503.669 591462.5938 673625.3282 187272.1481 664281.7207 709421.0195 372918.2025 264857.768 610215.2072 541851.1969 636445.3281 332901.7172 733241.4826 779257.5587 583885.3026 528929.6987 512731.256 760878.2816 742243.0696 841039.1979 417208.0323 238970.6835 289704.5933 525929.3063 281882.1691 748537.7343 759067.7567 709769.396 602828.3578 663958.8874 601283.0002 874048.3369 921712.7932 625210.3003 596418.4681 743323.756 315646.2641 928637.4475 849094.2926 651392.9812 889990.6053 218881.3455 107248.2734 382460.9745 244745.553 508839.9754 678507.543 745492.0211 623601.9401 141777.4127 384584.4611 173697.7655 389359.0273 449147.5726 532413.2396 515451.1122 215451.2872 109839.6291 427553.4614 691531.5908 605440.3834 646458.0334 476486.6902 275300.2181 548714.1555 607288.8624 609075.1711 662332.2922 299911.5733 403030.0323 550905.2709 548634.7756 418085.2017 431171.0739 588638.9762 653403.8277 714765.2989 612427.7953 362319.8434 681476.3159 770292.6673 305532.8758 157049.5429 467029.2994 200993.8351 510994.6427 696950.8597 249825.2667 556975.6558 473828.6338 654469.3848 447359.5196 396349.2509 618236.8772 295260.0243 423585.9817 529442.4751 451041.6548 243987.9836 630124.8257 498848.2481 575664.2 261685.1383 627930.5346 250636.1554 469646.41 225577.2922 584298.3189 603259.4984 465844.0591 119958.8186 548651.8288 599141.8492 122386.418 531030.8104 614173.8664 512713.6804 124466.1638 118928.2672 116434.4199 116604.1837 110565.2781 N-Phenylacetylglutamine 102062.6867 38364373.27 22811345.01 37052609.57 24406768.81 53566415.5 70571645.5 243646150.2 71536383.58 36753460.89 51153550.77 20603697.07 21340294.19 54564264.09 46590544.5 59485749.64 147051822.6 151654972 95927760.16 73402367.96 30132521.48 42787968.03 53168436.59 25628895.86 94832226.3 20608391.11 39605013.04 10387382.84 174854162.7 45584026.32 33345025.03 54970678.68 61575510.24 28753883 80953458.83 3941567.319 49929687.54 89416686.51 26931849.22 29660860.9 43526834.17 93402352.06 59621843.18 61200428.31 70407919.87 26884742.89 3900005.037 45315790.93 21959296.07 41165396.92 27838158.87 54611770.75 40436083.31 148637528.4 57035537.12 339439159.7 130648765.7 69365480.7 129687261 9992753.721 63877210.59 16074383.77 50024592.49 26140800.49 13698429.95 44876799.18 12148404.17 43387985.37 30849468.89 63941161.17 142625187.2 26764559.9 41810969.29 96876103.4 47823379.5 45151377.84 14048649.09 19208709.31 27330294.83 25617555.46 71644476.73 42112091.81 22484792.4 20984591.55 62581917.06 59527682.99 25169599.56 49892660.9 49874611.62 23235744.85 33661621.97 81760377.92 12635631.46 24591808.02 45209180.33 55777.35697 122233.0742 19845345.65 39124501.32 95453393.4 1984349.294 2648565.472 93926650.27 126221163.3 44204123.78 63741028.72 77474428.21 182688071.5 8550432.114 68447508.8 35549044.91 25948378.81 93871324.49 139058221.5 47321095.11 25986571.16 48021652.17 72760677.34 83610572.81 67486138.13 86764519.42 18445149.4 62458187.37 86523079.65 46287071.01 23786038.11 22050141.89 20804270.93 48540994.34 44234247.04 39032090.57 22632127.07 21881494.36 39560337.13 4814475.705 14587920.22 31998348.49 48019575.37 52742536.36 36669655.64 32097687.45 30686892.35 70060586.91 96632940.02 42849096.68 98320635.88 138087642 19628796.19 36825121.48 28991867.9 43834536.24 7439498.739 22223294.69 81938392.8 157096360.5 37114255.58 58918710.21 39904256.57 17788966.72 37224858.21 77194332.34 30726596.24 23798945.16 25910492.53 16336138.03 46355261.61 28616371.63 119601031.1 23807178.82 41681884.91 42270754.83 89839.93932 79852.98322 67972.04525 55704.92659 56700.30514 N-stearoyl serine 47195.93104 4848062.019 8771364.403 14582872.55 9307041.219 9684055.013 4284514.467 21810831.6 4309149.049 6671065.66 3897448.423 7640003.271 9810511.671 4905437.09 10487852.94 3960810.94 5223041.447 10742549.96 5499079.642 6212080.423 5304809.475 4863339.238 8013897.915 8678370.612 8545039.942 6403460.212 8704648.048 13525669.01 5157686.586 6091262.006 6503190.005 5237349.139 4969738.026 6130518.165 5421998.008 5239104.864 5365154.976 5643730.338 10393834.99 5722843.985 7325504.43 5844503.909 7856216.405 5697892.095 2545866.147 7354464.667 5187244.623 3123888.975 6630216.108 8763710.758 5504686.653 3600907.993 5765063.879 6761445.147 6054988.175 8666219.174 8454532.748 8462644.789 4501253.296 4716305.682 8346206.818 9714369.829 7031975.566 6141965.169 3163551.506 7758668.599 3880914.245 4557444.424 7574305.654 6482037.887 8008316.133 6647626.049 8461786.677 6879171.627 6049257.183 3467470.476 7703355.599 3712295.141 4395678.326 8629441.661 5014820.064 4825612.092 2970175.472 3239313.399 3809221.862 5388645.135 6100536.581 4994926.755 4866116.784 3642953.643 7732096.958 4931656.412 2399791.473 6100800.387 7981999.388 37506.6444 38352.67529 6139888.821 7612893.01 4872877.241 4285422.472 12004689.34 4032869.097 4003746.845 2671668.221 371529.3841 5030936.565 4918482.857 8770138.03 14269597.41 4343090.834 6052268.617 6006115.666 7284068.8 3899170.895 8512833.413 10562780.32 9721076.69 7040721.751 7221645.201 9958985.415 7871209.33 7623405.878 9824595.67 5224986.176 7659226.249 8096660.062 13574724.57 7475446.626 3252433.779 8965133.811 9951504.37 7332835.213 9400680.976 7333755.555 5396864.698 5079419.412 4556265.921 9768425.135 5380543.742 7462372.159 6748979.178 8860280.204 8341442.363 5607747.434 3265303.497 2634227.943 10238663.83 11281279.85 8628391.133 7970247.062 4730982.629 8645823.931 6666666.953 5771748.6 3727160.892 5596605.637 9711652.396 3532886.021 12219821.98 9903208.749 8252358.521 5634072.958 10522704.61 3221190.116 7015244.339 10749914.98 4507103.259 7651850.367 9899486.116 4582899.753 40348.15705 35685.15208 33964.52492 35656.23496 42985.00234 N,N-Bis(2-hydroxyethyl)dodecanamide 2408026.049 3267381.256 2572165.188 2851179.775 2288911.507 2258648.082 2508015.702 2201954.818 2244246.451 2616594.497 2696623.703 2546710.401 2509701.008 2936995.947 2212171.578 2285527.351 2388559.289 2271370.76 2398432.33 2348255.152 2537837.909 2031396.015 2505764.643 2339352.307 2442502.279 2347135.712 2305196.058 2279321.38 2255620.411 2402364.93 2335807.668 2413525.012 2237131.059 2222105.664 2035088.967 2125415.598 3156978.979 2518151.61 2355731.48 2563117.403 2397239.916 2236719.077 2369507.044 2157135.368 2686070.268 2705906.687 2098700.128 2498140.721 2542584.49 2367517.69 2197027.093 2567380.687 2430182.382 2325779.402 1999658.122 2303197.635 2268724.03 2556164.685 2214609.572 2162317.111 1988837.553 1918051.193 2087350.172 2303542.376 2263366.882 2110925.941 2367429.174 2432979.149 2011034.636 2366656.444 2203529.659 2285557.8 2128147.547 2162321.576 2306955.411 2139609.564 2108408.957 2438565.539 2077211.923 2019293.676 2208452.155 1711975.788 2063006.681 2910978.456 1969709.717 2040680.22 2288527.447 2539876.813 2136707.103 2177456.234 2202177.26 2055303.104 2286135.895 2257770.193 2481083.383 2238012.444 2147070.85 2312888.258 2369107.034 2376854.799 2299950.552 3681891.514 2026194.783 2128579.066 559965.8014 2038862.288 2326505.525 1908232.484 2404701.835 2314279.268 2293934.623 2391439.88 2028239.333 2157148.081 2605216.673 2382273.037 2325149.815 2286593.64 2645955.348 2060325.785 2591941.111 2858095.55 2477738.455 2671273.602 2440891.773 20039589.49 2657385.419 2541090.391 2362068.015 2564085.402 2577440.173 2487777.26 2600435.085 2264004.601 2353226.42 2407672.549 2405700.462 2712996.47 2484519.336 2890566.51 3096642.178 2385011.562 11564642.35 2032207.334 2048049.693 2432136.82 2382774.178 3436436.095 2216645.701 2076538.007 2831806.607 1986401.508 2133100.482 2424462.381 2233921.471 3161142.752 2061223.499 2149483.38 2474425.492 2248084.495 2348454.053 2195577.114 2150207.22 2036877.519 2372114.439 2308200.456 2337226.489 2129994.009 2320332.739 2359896.346 3111626.374 2290252.409 2296130.341 2064340.164 1992366.37 2135904.827 N,N-Diisopropylethylamine (DIPEA) 5753386.6 8468029.231 25201781.4 18410067.52 4020149.782 5269994.508 3813077.529 3292076.639 4496402.634 4093951.186 4069956.352 4155096.083 3803068.087 5341744.563 4100559.622 3895133.811 3655891.871 3787750.231 3851911.862 3537397.682 3561668.099 3779132.685 4398134.926 3659588.666 3623561.579 26053678.61 20784382.22 4041698.996 3824725.538 3547893.127 3426642.108 3332580.966 3808502.232 3545864.66 3323939.495 3324895.633 3717243.138 3372501.493 4165039.451 3738483.041 3924294.124 3356019.99 3463189.992 3176175.647 3314216.146 4978034.189 3117147.214 6285821.978 24731877.02 21493139.95 3570968.606 3405010.292 3587972.481 3880746.765 3538379.403 3779941.881 3295373.694 3474919.852 3877675.728 3493543.912 4963198.358 5050565.248 4875700.514 3500854.153 3279426.172 4636298.379 3332641.21 3612446.405 3607703.198 7289488.966 3651365.706 22168173.04 21787432.21 4876894.641 3255157.725 3483811.011 4140209.908 2996509.126 3300624.742 3291634.648 3209788.542 3981352.282 3387787.039 3980516.272 3798738.834 3463437.468 3392750.165 3551748.243 3185745.009 3526484.892 3509201.873 3666812.071 3199302.644 20857351.84 18522119.16 4097057.959 4291599.793 21115582.03 18266085.42 2547809.602 2852362.019 2942368.362 2647519.566 1985055.137 2221543.816 2444937.839 2723974.018 2284777.414 2727389.531 2373363.351 3276875.688 3139303.464 2134785.009 2932552.048 3596055.049 26387449.87 21894767.4 1838854.664 2744539.309 2284545.818 2987491.071 2500660.079 2363082.821 4012608.623 3183169.064 3703210.261 2640900.856 2192352.26 2321857.687 2878136.42 1960836.08 2308845.271 24522843.43 20283457.41 3206758.573 3479889.905 2989912.593 3381789.101 2531695.579 2995537.86 2756873.536 3503276.26 2851372.706 2791041.169 2463924.85 18363708.89 1911591.472 2311451.459 2672558.419 24857476.75 18471926.63 2095578.74 2458605.352 2556312.854 2782943.89 3183229.787 2620695.813 3235978.507 4819762.921 3930257.967 2140421.473 2325573.484 4079407.881 2831944.52 2855318.699 2586227.244 2892445.344 2225938.583 26410897.78 20951503.48 7387369.499 2700987.413 2662178.35 2935451.202 2869735.544 2729407.566 N,N,N-Trimethyllysine 116147.626 8404370.195 5001253.682 5591101.674 8802631.986 7020084.511 5855795.974 12159194.02 5198643.342 11666047.02 18352211.91 6682545.478 7590912.176 13128577.14 6188898.684 20578846.28 13107353.6 10748831.84 6341433.526 7686726.062 13686421.47 8786784.622 6863221.066 12604564.04 7748560.915 5317449.941 5953243.663 6421941.247 7456452.468 17784052.1 9745423.083 10405597.43 8485889.706 9259279.417 12251428.34 7352628.425 9674757.744 8242508.198 6764679.71 10908696.66 6525227.649 7453196.783 6699495.121 11925558 8254169.028 10521186.86 6728918.408 6484371.937 4987770.687 5467193.398 6895774.458 10251617.85 4145807.757 10150961.77 6990391.493 10442213.03 15231261.08 8392895.743 7033431.026 13401054.44 12407599.81 14151026.48 15735016.65 6964332.507 8427942.596 8125181.785 7349789.959 14944793.03 14678499.86 8239594.599 8552659.216 4629986.341 5984038.247 11114338.51 6597629.078 5678857.611 5497252.961 7089277.395 8382273.21 8681469.113 7638547.18 7477052.738 5846565.473 7206873.082 8980906.926 4712937.504 4994981.213 8149227.698 5530765.457 5908662.394 2913165.16 6583434.854 3673173.929 5435624.334 5959452.228 122803.9607 295559.8293 4374451.371 5602890.907 6196231.528 5468158.404 11011006.57 10731181.91 6007553.872 7686317.396 20683323.38 6946171.893 8566075.115 5552329.334 8789033.841 9272085.54 6496643.978 9713447.038 6584672.246 16916755.86 5212824.984 6076691.309 5011795.574 6607478.178 6879102.208 10044116.61 6925464.595 11104597.75 4945746.59 6172896.228 6252210.586 9529391.587 5345860.597 6674671.401 6682599.385 7408862.065 7147884.634 5027960.479 6015222.468 7647354.795 6505738.156 10159696.18 3255868.776 9589439.233 9402626.795 9421950.266 10627465.07 6817462.887 6690827.489 8675507.32 6656893.091 5264037.317 10687702.55 3652249.308 5720736.601 5480287.927 8643538.825 6984561.448 5536926.546 7088333.119 9057074.509 11383389.23 25092709.49 9693391.571 7971791.833 6552084.178 31880425.33 16540960.78 19317805.89 6480278.696 5866817.665 4087390.579 9015843.668 4967090.498 5793827.761 8252956.91 309259.3696 292171.0048 324583.6491 328483.4878 306563.6146 N,N'-Diphenylguanidine 320195.6605 204525.8279 188114.6669 170573.3785 8013416.74 3576593.837 8642675.935 13312901.04 13073125.47 12403806.13 8070370.552 1359996.333 27424163.83 20412107.06 119609323.8 15874185.98 1640686.221 138904.5615 13909083.99 1553381.157 9693440.631 14530937.48 6158871.365 3506636.795 7260277.181 229203.3067 203811.8371 7898932.056 62636138.27 2840193.746 8985454.832 15147896.91 1040807.49 6770351.175 7562184.5 5289889.555 23017954.62 12544112.63 34726376.63 34032351.16 2277789.48 1924297.146 10443901.95 6533528.602 17151811.11 838984.9357 8285080.219 654008.628 307973.3541 249501.788 22050719.51 10631652.41 18414888.29 1703926.256 12929857.03 766061.0346 51039397.64 70919.68425 1513172.549 43732664.28 5837412.88 5462928.711 17456493.85 3907711.356 1378240.501 2123552.622 3630462.803 2761261.775 2730917.279 2671819.627 3919623.357 83516.74742 262543.7465 280701.283 135852.963 2061066.553 7777355.192 154438.2564 4501684.973 31988216.96 9517402.479 656719.0104 1831820.45 27094131.96 311530.5438 9534010.925 29614974.89 17038160.49 708614.0904 9970213.727 21955237.41 39510382.99 1110088.101 86164.26358 81356.31293 70485.7427 177217.1327 147180.3419 124629.6512 4298811.422 3703847.745 9722959.201 8976232.58 1606638.277 15261045.49 2231943.544 46731375.79 15595328.05 31542151.88 43215186.18 1443049.685 6113483.398 7634872.847 2860099.932 301253.2411 74631.82231 81593.87815 22875091.42 25466093.34 34582237.86 3313072.706 71681740.99 7671015.039 5143664.232 910898.8706 22636445.12 6616084.75 55643733.45 7295924.544 1111300.92 6362443.406 2606510.684 224141.844 219130.7563 2482641.908 19903954.47 20722133.6 62105051.61 19782091.49 17423663.71 6230011.668 29378046.93 5319425.252 1109707.156 8248065.381 891915.1452 13647239.23 175387138.8 4750784.625 90269.90763 84541.99427 6826700.083 5245677.143 5152127.668 8133443.037 96289762.92 6142104.393 5865268.978 5387387.05 25213760.53 109421.1576 26199936.31 26850596.45 9414595.724 14483502.65 48092672.26 14910936.82 5567790.821 273801.0892 209317.0367 148195.0112 118602.0841 84742.48581 77281.73367 69073.22535 67095.09203 N1-[1-(2-furylcarbonyl)-4-piperidyl]benzamide1 164005.4287 48939788.4 4814054.519 2560900.14 246512633 58136311.37 63065402.86 66708502.31 127702286.3 47509323.33 59637795.13 56460942.2 41977522.73 150990239.4 115410493.8 84146654.23 48487643.89 50314283.67 75262336.75 94657263.57 103054756.5 139212685.3 94089470.16 56040629.59 117996501.4 3687449.276 1750228.596 78150975.36 189002507.7 84446457.3 65360804.26 85046501.97 100099108.5 90722401.61 99925241.7 102054987 73196944.87 67992273.72 152508334.6 61811277.3 64767658.78 214996415.3 205620975.4 127109237.6 97366255.82 110997269 109466498.3 212906038 3090221.46 1616667.832 89358862.61 117155306.5 78171993.73 81406472.64 95826757.05 141768944.7 96267950.81 45765407.11 123862541.2 48866786.37 74911563.8 100679667.6 39515951.19 45767559.8 69222465.38 93204179.85 97626280.79 63992735.72 106994139 107745617 80277984.99 4044901.186 1562757.77 97957108.43 73150296.08 83961606.27 104058691.3 65119730.06 61599827.64 243827993.7 57586959.36 189228751 60316287.22 76535163.6 116448660.1 98980393.26 126332885.1 45640756.98 148633582.3 123974351.7 166245483.4 122581013.4 92595818.15 3820327.073 2303109.624 288802.9013 301462.9355 4920869.384 2993424.488 139864385.8 107440377.7 242660760.3 103584664.1 103681574.9 103236761.4 265621445.9 130364807.5 120205887.1 158854617.9 109917741 143477020.7 139694950 150457147.5 132880725.1 119725269.8 14709728.64 8805894.528 24513369.66 200158373.3 100732682.4 93173857.14 104897229.7 89210204.2 168278343 117879345.3 169044785.7 78667203.09 101954665.4 179532641 100323747 115117062.4 126715746.3 3967746.699 2181293.7 194912356.2 143524057.1 158668148.6 94956453.19 135018262.1 90209051.56 138360826.2 237519149.8 113970302.1 127461347.5 101892024.2 135548966.3 147844390.8 95419094.69 86910962.5 4071751.143 1652622.785 154788126.2 79095608.73 200004677.2 130704125.4 90951179.46 98238300.74 121100027.2 86434892.2 125801383.9 143427612.8 127496999.1 213596599.4 68252500.54 59101033.89 97332417.33 123818277.7 113827246.8 10358156.22 5393595.664 92270278.63 297108.5735 300835.6043 298127.0708 289843.0031 300131.7929 N1-[1-(2-furylcarbonyl)-4-piperidyl]benzamide2 60614.51123 862058.8398 172069.9993 155816.2632 8182885.729 598505.8129 952358.6943 1149485.161 3304034.856 763426.4236 1276505.841 769301.5359 789563.0806 4483752.102 3309007.023 1997233.537 901694.3206 1107117.637 1461707.681 2080779.729 2299454.23 3345437.406 2230257.774 905513.738 3118239.957 140017.9543 168652.5364 1707472.708 6024347.394 1910739.35 1415628.38 2205686.487 2429637.651 2444722.779 2400988.628 2498475.789 1375770.061 1360701.152 5177011.639 1151895.523 1276049.493 6584813.024 7331286.966 3473612.076 2222437.371 2585755.877 2694353.108 5600390.923 144276.1758 162366.1008 2369150.566 2452628.83 2155100.438 1795346.377 2481558.113 3993966.802 2224856.163 819536.1428 2883014.421 1031130.502 1876174.012 2787202.186 829041.2347 902257.6947 1693172.439 1861148.324 2581824.741 1536429.704 2717789.684 2566005.65 1927281.939 175559.227 162009.0662 2780718.565 2063734.028 2190344.959 2671853.015 1526492.536 1427745.949 10116981.55 1264730.63 5597650.341 1476309.295 1739584.035 3140119.233 2514096.727 3854747.52 848371.2578 4187349.461 3091272.175 5011502.429 3159075.564 2692339.735 138428.8257 193131.1298 49810.79661 50495.2558 149081.2469 173290.5398 3293066.446 1853503.375 5288357.175 1510990.658 2030653.347 1979436.218 8748927.563 2855574.713 2272977.821 3839833.472 2282927.773 3251137.368 3368348.893 4045760.651 3176951.271 2459251.813 190801.3821 193230.531 368406.9561 5218542.549 1858156.008 1646611.173 2291448.828 1990486.503 4261657.968 2720329.398 3870874.286 1576199.298 2250438.277 4888958.316 2013788.664 2711415.178 2739928.751 172920.0688 165390.9394 4993170.459 2571026.549 3642411.898 1756681.765 3378265.01 1703139.726 3106629.008 6410354.018 2515041.013 2910034.394 1903651.218 3181643.671 3417623.659 2216591.979 1990529.55 186602.1974 142407.7751 3616018.164 1568079.021 5874571.474 2850277.841 1898632.738 2267677.543 2569968.486 1843248.961 2725634.491 3784736.107 3046254.507 7838934.015 1541661.779 1208486.655 2542155.346 2726841.453 2439715.675 171722.2826 170554.4118 1996686.123 62391.51252 53080.10672 51058.42325 74579.74338 46004.52387 N1-[1-(2-furylcarbonyl)-4-piperidyl]benzamide3 58123.22047 1562373.433 66384.64962 76931.7673 14092555.05 1317959.164 2070040.105 2249582.025 5973434.535 1508606.676 2186959.838 1814096.943 1642557.215 7498474.161 5980625.382 4131317.338 1706464.319 2345107.525 2806093.754 4009091.769 4343534.684 6541048.238 4497319.398 2027199.435 5953040.969 65543.56391 77012.51514 3573912.043 10171370.34 3263603.953 2624745.268 3981745.496 4671381.866 4557158.904 4926362.429 4829402.989 2996438.381 2718040.841 8785448.557 2484629.011 2390225.4 11889729.31 12573118.9 6249947.903 4226180.425 4533062.443 5284703.903 11545967.47 51806.05031 78243.06856 4268495.449 4431975.215 3513291.178 3504666.244 4687910.353 7171504.883 4491960.296 1741722.637 5758002.422 2001915.626 3258171.669 5180716.248 1608313.738 1680074.047 3493898.154 3803945.54 5201717.662 2633072.739 5363532.208 5525518.698 3822046.19 62050.87283 67084.62312 5030823.047 3712295.583 3900513.682 4780272.897 2805474.011 2962690.192 17121442.12 2466406.765 11290003.36 2718441.419 3662542.68 6335752.102 5254413.549 7060504.86 1760739.753 9314570.175 5741110.662 8240099.477 5792714.462 4736302.786 64123.1478 55567.50372 59348.23675 51410.8565 53981.93592 59768.14852 7070536.919 4571259.138 11355076.03 3911283.212 4788910.738 4893275.38 18332108.59 6181620.953 5292057.329 8032860.786 4659593.594 7120531.44 7320837.311 8152886.717 6677036.289 5730265.461 242693.7246 122121.647 870025.258 12143842.28 4554293.573 3987005.407 4888410.905 4019245.237 8766259.245 6296820.104 8606488.691 3354161.246 4632471.264 11160122.65 5055267.064 5645415.334 5635859.987 75747.66496 79319.07284 11572566.77 6484781.186 8800484.738 4230974.636 7241006.572 3975620.357 7069718.137 13379660.21 5410204.247 6283115.219 4541303.219 6881247.662 8175680.384 4800205.257 4367626.018 71086.04818 69787.26155 8397020.369 3227236.329 11941598.86 6507191.057 4599685.386 4772978.2 5980339.755 3958041.431 6476573.076 8146334.053 7131960.156 14925949.54 3313415.381 2956219.283 5446580.857 5913350.385 5667212.23 98869.21322 67505.1668 4423709.501 59355.2444 62007.63417 56508.71806 52519.21178 60258.31032 N1-acetyl-N7-4″-methyl-3″-pentenoyl cadaverine 33994.14328 43327.42509 47292.7651 103233.0829 100733.8051 1581736.501 1022184.86 239167.5848 105160.1229 2825702.115 205159.2542 1751964.296 86705.69683 129841.9342 97020.5434 335284.944 513652.8674 124108.9997 1477143.602 525180.2026 1414682.834 477817.1982 310218.0214 820734.0487 409674.2399 205235.6523 179576.511 133470.8664 212455.0019 1320075.79 205472.9552 466922.9792 281003.0632 148049.5858 201257.8894 164888.812 2517493.585 1012349.85 129381.7021 2203812.194 279758.6839 1546171.909 372412.9415 764655.264 667882.516 376225.5062 268217.2412 2405690.975 87388.67249 222366.0284 728269.1302 1221173.045 303421.9763 123409.4181 365931.7987 1783398.706 931873.0515 1142769.326 126224.6962 226907.9887 215018.5515 100582.9615 150519.2244 523507.1103 283776.6896 4538562.556 515176.768 191904.7405 123522.7264 3799676.167 214714.6387 2607476.573 169287.0223 73100.94275 199665.5561 123893.4345 280905.1462 114962.1601 378599.2261 221891.9046 1594011.774 2142472.449 893024.2542 1775465.953 1447509.387 210700.7695 232537.0668 1192288.542 779073.2226 1324383.399 121421.748 199663.8251 356335.8895 1263080.334 2539731.463 38690.63247 31366.7659 66306.97164 101094.6634 73818.93005 80947.89382 417982.0896 462985.4595 82459.06791 88676.89275 87118.54978 333604.1555 253914.4687 381216.1841 255323.1176 589355.3853 48143.42341 303551.9197 190589.8726 86228.12297 160054.713 300837.1941 210825.5788 184063.4605 157568.7711 471058.5653 77464.71205 41805.56957 687601.4485 217924.713 911895.8015 250272.0534 444266.5177 275488.1272 323570.4114 91914.35255 560736.8826 240816.5241 113936.4493 55752.02414 391026.8952 100092.9784 284455.786 141431.3223 156212.4237 277302.6379 365861.2178 230147.751 173411.9154 291310.5573 724564.5961 331949.622 171171.7288 168670.4937 345481.2625 258062.2139 214049.7596 108054.4462 365266.5689 440412.4045 135821.0881 271568.9425 372558.8117 189206.935 235938.429 96853.74345 318853.2394 101388.7952 68819.49588 114418.0358 177984.919 462076.6859 150617.3705 145067.0905 88193.32683 109724.2046 38547.29913 31210.29521 34313.53939 28785.49437 31166.12902 Naphthalen-2-amine 31966.59985 5902742.17 5352145.711 5305322.804 6982370.79 4140196.443 3385927.566 6408981.643 5762539.054 3743183.713 7775971.867 5208328.117 7604411.654 9838246.952 5680757.271 6426824.541 5548209.717 8821211.42 2159700.634 6143481.186 5625364.541 5734177.7 6490318 6562339.465 5447355.088 7086341.767 6970751.124 5370658.105 5605433.073 6247752.831 11278441.08 5422400.055 7542426.569 7902100.57 8548456.67 8165762.673 4774448.363 5120522.824 7527642.965 1852538.938 7044790.063 4872115.616 5199728.085 7945438.267 5919561.989 9208363.971 7254590.489 6202770.797 8040813.206 7655239.763 8286918.719 5136476.168 6152507.465 7053714.554 6083567.703 8002485.403 8511369.625 7427227.464 7766370.86 10211415.82 8459640.749 8297960.28 11879446.7 5867677.336 7897569.8 5509145.79 7818557.275 8339560.475 8396264.888 7371890.376 7024994.194 6657730.754 9693499.424 9858313.699 5812427.287 7538196.37 9221404.352 7795888.717 7740865.397 7091412.741 5173124.941 7550688.059 8154789.074 11689997.95 9693681.649 4879214.189 6790564.51 6942055.719 6921120.373 7029954.517 4802489.151 8220950.818 4999085.277 7744416.31 7319067.345 104532.3428 85015.36328 6396968.704 5723010.817 6310447.904 5295688.633 4948581.578 1929659.208 5832061.093 6626765.967 6454099.94 4410257.871 4949507.681 4441221.188 6477911.445 7417489.923 6807473.736 5263768.813 4322725.386 6675717.825 7057266.997 6506613.404 5272728.431 6841278.899 5567479.151 5768463.31 8543288.29 7684696.123 4678079.105 8040469.29 5469844.812 5497431.064 5583004.521 6903234.027 6676633.931 8071910.551 7344091.187 7586846.85 7868122.334 7904670.373 8891661.236 8492185.591 5786009.023 6746696.234 8015175.945 6754185.54 7214299.833 7020020.451 6164844.125 9970598.381 7291201.413 6347375.462 7231005.272 7275854.825 7944494.657 7325108.166 8301678.026 10564810.07 7796965.938 8714080.877 6373289.421 7882394.004 8935516.971 8436226.313 6727452.423 6962246.096 7727930.543 7731841.366 8363912.933 7880534.101 7215910.981 6911323.783 8211659.916 8930557.497 9339124.749 7863504.884 23880.14874 23145.21189 23325.00563 26922.46247 23705.08735 NSC 622050 100178.5373 944423.0271 983491.7823 1020453.902 1364340.052 2263177.55 1177874.624 1423583.816 1022641.723 1172841.277 1045255.072 1762596.323 1368676.368 948266.466 1516423.426 1170087.731 1410750.46 1191062.808 961568.83 1364508.376 926818.719 1837086.219 935610.6391 1400819.202 859343.9741 1029097.959 934840.4246 1050868.533 1084515.643 1239683.133 1008224.193 1417409.459 964006.8594 1235015.881 1667952.973 1177924.654 1339138.799 1230729.191 1439167.444 1371526.375 1127231.343 852002.991 1133520.594 964286.0557 948859.2833 1355347.471 1011406.312 1131707.159 992837.2361 1017772.579 1018658.131 1119120.882 1177342.848 1226207.642 1365891.678 1407091.353 1493023.869 1186090.933 1181538.056 895240.1079 1765697.059 1785246.089 1560287.74 1519096.123 1893365.186 1467009.139 1763792.241 1318732.519 1320184.543 2113606.437 1457014.313 924639.186 887874.3603 1454382.553 1266395.061 730383.3304 1421391.373 1285549.049 1013412.815 1202698.888 1282306.29 1037068.779 1379088.122 856579.0459 1112705.64 1128816.144 1084225.391 1028569.967 984439.0024 1278639.474 1451984.306 894877.3653 1159857.39 876554.1848 1008560.133 73641.40603 88245.7168 969061.5897 730188.5978 989291.2357 1022183.693 985089.5543 835856.3294 1085217.952 1084077.241 1212179.451 1191329.951 1057541.568 1326972.471 1091051.82 1163815.962 842019.8428 1314370.246 1055021.112 1245977.951 1206994.064 1075012.926 941824.8179 1107963.621 1200212.866 1190781.964 1264479.307 1211196.244 1090950.071 1137354.63 1140089.185 1048887.486 1131503.354 1204462.352 993264.7253 1599435.778 1165978.761 977833.7047 963091.7629 1078055.524 1009146.293 996775.6644 1089680.604 1229284.083 1475303.517 913915.0861 817505.6867 1027710.923 1135074.869 1271011.956 1069715.871 951084.5647 1493863.598 1469364.321 1076241.365 906365.5371 959860.0769 1770747.931 1306136.201 1346979.521 1504307.885 1386637.538 1117433.696 1011426.087 2194074.466 1634308.403 1433264.862 1515915.578 1069137.572 957442.0211 1352418.749 1204549.107 1090768.367 1208644.111 705703.2783 769479.0097 58147.68688 91376.03872 54579.6351 96239.75635 98284.4781 Oleamide 7710530.313 19592759.3 14322867.04 20113479.28 14065462.25 36389279.94 28195876.43 20866825.78 12377832.19 42363621.76 15036259.24 60117574.4 14353969.76 13348682.59 16080957.74 16161834.59 22400769.02 10877695.35 26325145.97 28285851.55 23760006.82 21124738.12 17099310.26 16244360.77 17624773.68 17749743.28 17603052.97 11761451.79 15896602.07 28103802.26 21215491.94 18506229.54 18542426.28 17146835.5 17182694.85 13009065.68 31462851.15 13129457.53 10246816.98 57554651.19 15984502.89 25581241.5 21977608.16 22988968.62 19744649.34 26956999.81 25175013.29 14505652.4 17933390.16 20712203.1 24159558.89 19868194.13 14917041.75 13537736.44 26853566.35 31149974.67 20545916.87 23546882.07 10396728.29 20096520.06 17717440.57 9390132.064 10631536.54 13679589.25 17716269.85 16871066.32 22382723.25 16784534.73 12040691.95 21854453.09 14413642.24 45273742.91 23791049.22 9565060.643 11405864.9 20514612.7 13010673.45 10684901.49 17939307.25 15244934.94 29653130.31 87118759.64 20975126.76 20138583.89 26391100.8 16635314.47 19790910.21 39068114.78 33454636.49 24049021.48 16076245.18 21136982.34 22890051.73 47109785.56 49619275.44 12115410.04 16002202 24628556.42 25524850.99 14411844.58 14668066.18 18657893.45 25849367.83 13619721.1 21032365.12 20766699.79 24278427.11 12502770.8 26000901.51 17270698.94 46469696.33 12378186.17 19805558.89 11617061.11 12169211.58 22337719.97 26820641.36 16358835.44 27055876.28 17914508.84 16602566.12 13372676.81 15100653.2 27625695.56 44093637.82 28159174.94 20657066.01 30405370.91 24736926.96 54143703.87 15721604.45 27627130.68 29156935.15 23947584.43 13657027.75 22830451.78 19152649.08 20388762.57 35511965.4 27834272.66 23412868.07 24944519.16 30502827.3 31161407.01 23674887.1 41352651.64 20026632.51 29978626.39 18643339.58 35595165.34 28957741.55 20948220.18 13202299.82 21933045.5 21135373.72 25774279.6 21801381.3 21509457.23 20187913.6 10196326.14 12468156.4 24984118.29 24040889.86 13007436.67 13147148.59 16462920.4 32022509.91 18087678.95 22744692.1 22504533.67 19073338.55 6870026.048 6641752.401 6652632.265 6449980.899 6625043.781 PAF C-18:1 233040.7102 48838740.01 128031383.3 123340799.4 31328588.64 27551676.02 54025162.69 32490493.02 36226638.17 31530658.73 52438294.53 18140467.49 17041328.64 44608480.92 46270155.28 33861949.7 41099929.66 22978123.24 24792077.83 49555079.27 27620554.92 38469426.66 34015297.92 24350026.48 58834999.61 113878955.6 128360099.3 27831861.34 38338197.62 23352026.09 37829330.59 43957527.48 49919831.08 22017178.51 21005531.25 28023014.13 31885982.88 17928693.84 31497730.57 17568798.02 28403144.9 32662850.24 46398625.65 25731800.19 30138678.71 31863648.14 31227235.63 28485690.75 125909928.3 129933608.2 24273683.48 45822614.34 15095232.55 52030890.12 52032977.64 32995542.74 32871744.35 25229573.11 64639935.25 41237703.01 53548479.03 27738688.67 37556111.1 27590614.37 26560610.55 55359882.23 26163333.22 33093299.42 26235944.46 33043187.52 39551476.65 122785968.4 139257686.2 23063748.12 23374082.87 38951041.94 18511754.66 24313403.52 14926311.24 51951354.1 42906481.15 44517578.15 34024488.14 18680168.78 33339342.49 46270208.08 23569596.09 29418220.31 44361367.81 48894891.65 46215572.65 80070878.97 27122638.85 121056102.8 141874497.2 439405.9275 844400.2728 120335475.4 127301848.9 24250811.53 48134412.68 32924164.59 56593150.32 39636525.87 12226737.42 50005929.38 48692326.68 56283638.4 15204942.4 17189789.26 27550212.02 26350952.53 29559660.41 26661389.64 40457889.52 133818217.5 139006557.3 19203716.35 58546996.91 36930386.91 42860446.48 21560142.44 23204919.38 49856837.23 29749807.78 41270148.14 23793310.87 30129149.22 46032583.61 50167888.19 27439536.12 10320838.34 115983689.6 131481343.7 54192350.14 52228117.55 41381379.92 41520639.64 39213115.32 41503490.89 25871205.91 42251709.55 49211583.96 44924360.88 20151569.61 62003718.27 28800774.86 26840336.32 24761635.83 134403716.8 118992940.9 54747630.77 38773390.6 25708985.05 30358960.95 24651825.93 22088384.7 46551716.29 38445183.66 32599982.74 78880649.35 57212205.22 35688875.2 21449889.21 25397190.4 37844244.79 36263611.89 39773471.26 145756666.5 142516405.1 48570747.1 427330.5492 445205.5752 450051.751 426942.8967 402532.8281 Palmitoylcarnitine 68287.1227 21560288.9 48161841.77 46810765.22 51014912.11 56944046.63 29212857.78 70094028.16 26169787.9 32325371.8 24230630.2 37050685.78 45818902.58 29081153.75 44580979.49 27876575.73 28096067.14 46776770.17 36764645.93 34843991.13 23667669.07 26834394.37 30904727.93 39547343.37 31132682.74 40665658.27 43097113.57 45314130.96 21551839.56 25866426.93 38326060.67 30400054 27112206.25 27318854.77 25139209.14 20603740.24 23359092.29 25986915.58 39350139.36 21163858.75 33138284.04 26303787.28 22800009.77 21881738.18 19917914.35 47717751.54 26788458.84 20645088.08 43458186.4 48902413.7 22745939.22 25487545.4 29443457.54 30424364.48 37820875.25 36144677.25 33368069.3 34891428.38 27461933.72 35699083.98 40270781.6 32168824.48 30588324.46 32919046 16246392.75 63249547.33 22844527.48 25343424.35 28080189.93 31157660.75 31152134.93 42292878.37 47514597.66 33374650.54 23487056.51 16665233.14 27670957.91 22257717.25 25349073.19 44765617.84 30198530.85 22100171.96 23409037.94 23050263.13 22987283.46 29369700.51 29228931.47 22160535.68 21524706.01 24256465.8 37199298.28 28209110.84 18621380.02 38481777.92 42723748.46 39900.71303 43143.49887 39470570.13 39615031.51 28289308.43 26611770.56 60838800.86 22149503.84 26613075.14 11963194.03 32080823.89 32879968.56 27040789.09 27575177.4 31532446.21 29719655.19 25787319.1 35581778.63 41743490.21 31228476.75 57852470.66 54206456.93 35051621.41 33858164.52 32893718.95 44465495.02 38881423.04 23465969.94 38441130.92 30629423.28 43462593.2 27278240.79 47016191.43 41508915.99 28020488.8 39215537.62 31688692.8 51466259.27 50515735.68 35813543.73 36573298.35 31025865.16 35834580.08 39684507.29 23074673.95 27356797.47 33175331.42 41647996.78 39297552.78 21234929.64 27343446.88 28563910.74 43343560.2 42036594.67 54301498.42 38917300.71 34095677.92 66183724.85 38978480.52 26296674.16 18858114.55 35711624.53 43642993.71 24702235.33 48196931.9 46652840.73 34680621.46 28101515.8 34033178.08 25293140.74 47010285 34622884.3 34463822.51 54386732.5 49025482.76 25972332.28 52744.70258 41716.1326 43518.79947 47661.30022 44029.69002 Pantetheine 80202.71577 1276321.831 1937489.531 1942870.477 215638.3129 225579.8091 90285.66052 1688841.074 76729.16171 6194722.065 298915.5341 2026237.379 210397.8091 73104.22992 1853577.765 7261137.084 1624325.412 1225678.323 68774.50472 1810997.584 2465823.611 4301053.972 1697543.272 11775466.46 764181.1847 1900510.8 1952900.42 245462.0711 1261193.752 263131.4304 5230696.986 73043.92409 1037585.013 400690.2583 1324017.01 1315458.756 160827.2204 3804926.24 6145840.197 178139.9259 146008.582 164577.7489 1853449.605 321459.7281 233176.7072 206748.0822 80375.96029 4401757.385 1935882.991 2086497.477 5883143.901 7394255.47 76310.91631 216954.0166 214648.3854 186803.133 189705.8708 6023203.116 82722.98382 1921125.985 4985850.822 88968.6209 159632.8826 9593721.251 5188057.851 469725.9055 2652036.64 76940.80603 77765.18221 143627.0165 217026.3889 1940695.295 2652972.03 11395298.83 235212.8084 3322370.53 2434278.605 80071.15021 5839151.921 230288.8778 275992.8073 3640800.123 385170.6795 113236.4138 1732059.005 199671.0206 74756.17071 3634382.989 110668.1232 396373.6916 75049.11624 78222.795 9455795.682 1840681.151 2006552.768 72185.74063 70702.018 1684328.185 1974746.726 2926721.718 199265.5567 265835.3147 179855.9378 273349.0259 7903506.645 760943.2411 74208.98119 74613.25143 173862.1448 6202856.586 4156668.132 1905542.426 2140598.498 164145.2174 82404.65998 1977893.098 1909797.689 743744.6125 104479.3216 1496847.256 384976.7456 180679.0744 426156.2236 245672.6516 77058.17701 187590.7597 6023664.228 3610827.374 2756841.712 2073812.83 95627.48396 916408.2517 2038574.993 2165775.892 79160.76294 319527.939 99913.70994 1816025.818 2379990.422 3787046.05 299336.5506 384841.2894 1483898.329 67125.39318 2237436.261 75811.67597 9689265.92 1768673.985 8243665.46 2258064.507 2128583.446 264790.3668 3243356.058 285044.9491 2554254.471 4154247.284 7383155.856 215360.3006 284753.6453 4206620.643 435696.0728 76864.78054 143758.3228 2646476.2 2305578.51 2604976.417 80472.71103 2377124.469 1993126.31 2019467.961 1670690.428 65388.03958 76450.48757 72534.07703 72781.7328 71283.04245 Pantothenicacid (VitaminB5) 34112.76328 6361308.085 5799304.128 7996391.743 9544891.082 1723751.257 3171677.388 6613913.597 19711222.98 10444908.54 49989498.34 5302576.801 5464652.254 5431572.043 13259590.96 7283092.67 26011068.21 11629456.62 8281136.119 3533307.895 10669631.9 8512207.868 6881323.968 4322033.743 17715745.18 8134877.14 9095579.756 3377558.468 1678394.699 19189036.33 10983031.54 36412407.83 53779194.71 4663394.273 6211368.097 6829410.74 2122996.436 9838907.401 5544642.372 3125946.664 6792171.969 9856610.396 10099977.56 10339786.58 5646436.314 6749595.38 31456395.76 15894739.59 6771862.905 8808783.46 4915263.819 5204607.994 10923694.15 19542203.86 45790192.51 26192048.51 17381837.52 34473986.96 18094923.18 5597003.09 7285873.202 8837218.735 8513630.55 3847684.578 6707467.942 2097232.268 6139113.71 10218620.05 11838136.16 13393372.61 4876433.408 5726692.806 10040407.2 9568905.888 25956186.85 4330632.643 6187022.775 12224724.77 4954549.529 17946986.31 4318517.963 12466013.61 7464684.991 8590517.689 8216546.326 17196438.09 21337978.38 4228727.425 3242808.907 12852372.69 7030335.85 6328257.495 17932302.83 6643147.063 8429365.858 29021.49186 28204.17358 5333903.716 7911601.564 8651362.576 3912392.909 6897280.655 7165493.429 8093833.914 5586909.963 2236126.706 7829285.996 25698060.57 8297486.403 4680329.407 5101976.4 6812365.177 4768138.524 13070720.19 10004316.22 5386307.734 8050051.246 6687827.628 56247856.06 6680186.508 8363305.672 4918961.706 6735746.534 15409223.45 5834350.792 12364627.52 9786046.108 3289233.539 6770851.006 17578501.42 6036128.593 4708249.803 6023425.77 8782852.218 9222530.802 3436050.007 5319245.048 4121926.446 3570031.256 6165124.993 3629303.571 3141545.305 19142849.55 17378247.66 11153034.38 18750517.52 6807832.953 52134552.22 17224044.25 6811017.491 8978316.567 8088978.704 14200459.7 3810922.24 23671763.6 3904414.341 4824472.605 10318256.78 11575230.93 4340482.894 8482935.577 6149051.847 7610017.764 11124464.75 10525338.27 24454370.9 4729764.439 12281304.35 6675297.264 9463401.826 8540197.755 30112.75387 34193.6628 31350.25993 32606.72978 36154.77724 Paraxanthine 568117.1721 63141976.27 54351770.26 90666820.47 7937066.65 187347269.5 14899556 247053031.2 11488065.07 20590725.71 143160849 72855719.16 46975987.19 902393.8248 13908288.15 160035793.2 40563820.92 80007059.59 5183364.077 159755619.6 4490956.596 173941199.9 134927924.8 39644338.89 56212961.25 49078410.78 108526510.9 3373397.841 29769700.69 24023080.15 41196191.71 5749568.864 281679181.9 105168341.4 229388501.4 43914154.63 82354163.49 61567451.19 47321208.59 133191839.7 25090581.23 42594213.77 25465479.5 68394726.19 10009779.66 223060.5173 226282.2761 33135041.22 58336307.58 114428869.3 81643426.06 99963550.33 27582875.42 51005955.21 2792216.231 26646277.8 3895597.71 65003948.92 11868223.48 23184682.14 41549288.51 2196278.035 67092406.1 7317284.785 11805409.18 6960599.723 6942677.651 224772542.9 147111621.4 27599198.85 83992972.57 61798479.19 113679507 17708826.52 5113397.786 167335287.4 61534076.88 92837279.99 55683562.81 34027603.45 187906783.3 9187426.799 62134925.61 91941932.3 63095624.88 35609277.99 16388649.17 162243086.4 141865867.4 23499471.78 74203549.56 55988058.69 2772466.423 55814564.19 112430371.5 830353.3883 373254.3221 53930719.25 110016152.5 124686690.2 2390877.655 442804.1437 51968369.74 17017279.21 47132440.52 1705725.014 138675741.3 29353917.21 19580907.43 138905145.8 72393170.24 175945251.4 20938023.85 21912344.48 22085227.68 70352746.11 127409778.4 216176492.2 38239583.12 10588557.35 18346993.64 48638417.07 124525060.4 34023524.31 148751140.5 93545634.31 52935261 112350447.9 190861902.8 5639803.549 69651830.13 59593607.15 62582772.26 116467704 6374829.723 243430.2727 43383469.36 46953701.05 109598939.9 122274218.9 18078050.17 3888613.874 161144884.2 178482635.1 33011798.75 70307589.75 150965.812 749821186.4 37540290.55 67897915.49 106459486.9 38193586.65 116613204.9 57221301 231931292.7 78914206.17 23588531.48 122992522.3 24926363.41 2213990.569 31365689.38 220148838.9 98257509.17 90521409.44 188667062.8 24829799.5 6060420.506 45932232.24 66264377.9 122121655.3 83350026.27 894384.9151 493661.3217 384174.6122 363330.4204 36194.38444 PE(0:0/18:2(9Z,12Z))1 182554.66 217313878.5 141446887.5 152828286.9 205882423.3 155436408.2 151510503.6 237981891.8 153064061.8 174670018.3 195730121.5 160096427.7 236647135.6 94936136.03 164369223.7 178054262.8 300302088.6 192605382.9 86483904.66 148282240.2 133324797.9 164826901.6 120373734.4 158876731.4 163839024.5 138465746.6 164125876.4 119772537.7 143830051.8 129302808.1 305151160.5 169673851.1 163517685.6 105134941.4 101814314.1 221962543.8 97040806.97 71696321.83 131435048.7 124460569.4 124338820.7 188501926.8 148516916.2 124578779.7 129160158.8 178187950.4 101900116.8 219739902.7 127472038 145159059.9 240841422.3 267331902.6 209456487.9 224607424 108511074.9 171993681.5 134443851.7 179777524.5 233405396.5 238136217.7 299489916.7 128558565.6 173153906.6 141011848.6 97806175.5 217709311.7 150410258.8 102198724.1 149938443 110791200 151641654.5 145954248.2 180764479.5 144078418.8 99851603.34 175657735.7 90043472.55 172597387.2 192718312.3 274527537 161378015.4 76682486.22 139565950.5 149177568.1 252079604.5 207736269.9 76994150.73 210506845.8 248797317.1 213468759.9 93051619.25 233182661.1 86313041.91 118079876 166737050.3 282682.3932 127490.1827 123447758.5 159852229.6 233272779.7 249317563.5 215342238.6 274363212.7 109478530.1 97891616.36 116274830.5 174786203.4 200043732.2 151594017.6 124792618.3 162840241.1 138270707.7 75019912.15 48319014.71 204856795.5 156847068.9 175765710.1 227603701 227037989.8 145479715.8 321423995.1 84978678.06 70573484.79 125115155.5 223878447.3 311699155.8 203410208.2 245646380.1 142097452.4 122919409.5 135928202.9 44100356.4 144297814.1 158532937.2 163110905.8 866385673 134068676.6 133335338 206124818.6 380248977.7 97104631.05 130678468.3 311039009.4 312670543.3 143912589.9 207185083 542588355 115985196 135442394.7 140969759.3 132500183.6 194332463.3 426915478.3 145437283.3 128324695.8 247263634.9 156738070.4 272830614.5 331225896.5 148611068.4 238765932.8 210081050.8 111869153.4 166480014.6 164297574.4 170224613 105139152.4 183764455.8 157267088 153492620.6 226553744.3 305847.3565 48985.86721 54404.16038 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9972258.98 9350441.196 3936273.321 15187207.96 10547973.79 9178003.878 10551972.88 11105040.1 24799750.2 8818505.596 19138165.7 38259163.96 47009614.99 14923275.63 26042687.89 13135345.39 26687674.73 18442316.88 29294389.91 13625195.89 17350342.85 23078121.23 23940034.66 22195705.35 14036989.36 15421329.44 13244217.27 7594662.783 17553676.3 14537125.25 14791514.04 19336130.88 15469392.82 15057455.19 38191531.73 41077066.38 14866053.97 12590820.01 13350112.43 9448269.877 15088818.58 15897673.14 13632562.96 949361.094 12503386.76 17547730.07 10954461.3 16030747.18 17339594.53 7007142.826 15531625.06 15735750.87 18100930.86 12648505.64 32620505.52 10227271.95 387781.1079 35448912.15 74646.3199 67693.45089 1908144.949 38252360.3 20443188.42 25069474.96 19762893.7 22277683.09 9427365.779 7935217.654 24609905.32 3546662.499 19325453.2 8612056.725 11453738.68 13412649.49 13249535.8 6061232.862 5397380.071 28895067.55 42537843.18 42367250.31 12702739.72 17798928.65 12887086.23 26584571.24 7150895.488 7732587.784 21213656.61 23295930.59 30131969.24 11758555.6 17735946.81 24561306.52 15644148.08 14111374.88 5468876.775 42316230.72 40590149.07 22233843.61 53545988.44 30501007.86 14185940.21 18772322.28 21513236.77 13904410.02 24503298.1 21088750.88 23709961.94 10298122.01 17933325.43 16427681.93 13564486.65 8348518.228 46265467.74 33876134.83 16197866.2 18103347.84 10777118 11204710.44 11475280.94 8744739.978 30911387.05 28861638.29 8409023.552 16448513.02 20095867.57 18018662.22 12491036.77 13068651.95 19086051.53 18854281.3 16714129.03 38966332.58 42806841.01 32018094.59 79471.41648 79930.67928 65035.85272 74768.81994 61296.21024 PE(20:2(11Z,14Z)/0:0) 61623.64624 1180109.676 1483513.429 1678013.66 692877.94 677099.459 882324.7599 1390465.02 1308567.294 1340405.809 1517444.515 1072272.432 1255670.932 1181083.165 1017489.21 913206.3993 1863421.428 767580.7781 406831.1537 891429.7303 1162891.282 904182.44 594704.9068 601199.3612 676142.0181 1264958.611 1610931.423 780248.5808 1256312.467 922973.6535 1745756.986 830364.1687 994384.8545 375972.7442 498009.4867 1285761.613 915347.4341 212751.9116 729341.1556 878417.4181 856182.8166 289558.7982 1185121.568 636374.1507 676651.1118 967056.8928 1040681.594 1271647.279 1426734.242 1661742.56 1470779.36 501540.081 535813.3946 1349842.28 655956.7274 1183150.186 775451.3786 2953954.17 1581345.387 2655997.191 2469012.033 757147.0655 904474.1104 1379274.984 636104.3445 1933132.993 867610.0235 1554582.675 977226.0249 891427.1671 894927.6327 1395982.12 1929310.506 669006.586 206641.1699 1589668.85 784616.2631 803427.6838 894415.5049 1892668.343 1644849.954 943094.7137 768599.6789 1868211.801 1591182.426 809789.2438 410323.052 985593.1396 1258624.194 2262884.857 681085.0659 2011150.405 832408.2527 1128944.002 1588640.847 61094.29614 53562.37347 1173397.451 1615296.933 1202257.683 2637313.216 1343189.808 2261337.323 830051.6553 527676.7596 674698.5658 1928668.297 1620903.421 820475.7991 1220440.395 632256.9498 1778351.034 645732.513 341233.6935 2456805.415 1319136.944 1592306.884 343912.443 1349093.887 996377.0107 1397645.929 502683.6421 995669.0328 1237129.98 1505270.089 486455.715 2291837.075 1709103.09 667665.7746 1609173.606 1788605.284 598016.2563 1469803.124 1788073.491 1711889.528 2178429.91 1259169.639 713438.5347 1587123.026 2508824.428 531293.0059 1472100.221 889209.1943 1783247.441 581441.2645 2086037.321 1164652.808 591365.7453 460963.794 1093448.498 1647850.201 1621008.073 1849185.563 1258778.593 473321.4781 1765064.681 1074406.161 1480813.77 1851912.503 1162145.618 4585016.935 1242279.419 1515824.505 816096.2264 685967.8818 748203.4541 2169945.311 1240467.613 1579794.309 1851714.667 277592.2204 68746.61899 53488.52743 63231.07833 44995.39766 47174.24992 PE(20:3(8Z,11Z,14Z)/0:0) 73272.10772 14179153.69 9394308.256 11770421.91 17371032.54 15129808.62 6685904.336 26413976.09 9044667.712 8235911.542 18346712.88 14554202.67 26141195.73 6952602.64 6185665.22 10661193.66 18051446.21 21366121.88 3764561.445 11445474.23 8884072.223 13330348.58 8779311.071 12607057.83 7599121.433 9274710.036 13050363.48 5463775.958 7141431.375 11898965.08 19216272.81 9087086.613 7787579.585 10297000.79 12291070.68 14448251.52 4671526.017 3853953.539 6652841.015 10045871.91 8424346.256 6944343.454 7613988.586 8766241.939 6357944.077 13488161.62 7769294.794 17029409.88 8799521.141 13974052.7 10226002.63 13445987.13 10807372.89 16449011.22 4268868.748 20797655.85 15036827.64 12206964.77 13873566.49 25831543.94 28098964.95 10806434.41 8066701.05 14019595.96 10011036.36 10305505.49 11811624.41 14045780.88 12418294.43 9729733.788 5215144.563 8849919.214 14217144.15 10948483.53 5743632.221 18056393.83 10979462.55 17435573.63 14239827.42 18659726.54 9829895.416 5086893.594 10293978.89 26556050.11 16784788.62 5869043.974 2946915.298 17486881.85 8157484.165 15685850.5 4298814.377 21704721.39 4669078.397 8857529.808 12761361.62 50268.93162 59809.46229 8131126.074 11952954.8 21718864.6 19802100.79 11275265.06 16760887.33 8517601.715 6688642.613 4989282.769 11605260.58 28198143.26 14734478.57 11603013.06 10258115.68 11048209.19 3857422.322 2337156.863 15793420.74 11709990.19 14568877.92 8063276.355 11724483.13 9429084.535 26869999.91 8412459.182 9238886.015 6039104.749 22829332.09 16571424.84 15602722.38 14675336.85 13204264.09 5779312.965 10192303.4 4233779.047 9774636.311 13667787.05 13735458.66 39741181.95 10806184.58 6400038.642 11985509.67 13889035.58 8280886.395 7537781.658 13933058.09 21261310.08 20268373.77 11159749.81 19550925.9 9035900.551 7881894.209 10460694.68 10602977.05 7265466.38 27161578.06 11371097.08 16885160.93 19171655.68 12993745.75 12088063.87 16607715.06 10862553.12 12073801.53 6415294.468 11418624.95 10071842.07 14004560.05 9605284.095 9498424.825 10412235.64 10730594.01 12822572.7 15190764.38 47885.23374 61319.00256 59443.1281 46806.17358 54216.08636 PE(21:0/0:0) 12280508.08 4493087046 10956144092 10459868141 3051060959 2617431026 3374185276 2127180650 2679695452 2593565474 3314323669 2342887291 2781669615 3203435621 2939017514 2568578388 3091805495 2305361286 1753591390 2476409592 2846426885 2636359414 2500296803 2348279429 2977935743 9275748042 10433356542 2383050555 2192308909 2417137521 3491409480 2993295315 2642186641 2150255597 2057139346 2830443802 2230155497 1259033399 2295763419 1798642686 2917287002 2175494160 2121084403 2062570389 2344781695 3855761044 2422386478 2662189197 10158691174 10840830914 2674568907 2648912859 1742399205 2983456053 2353482601 2438012384 2200982800 2314021789 4076650148 3612448721 4279232481 2517317985 2520585905 3364601863 1932772206 3708205203 2417397947 2364627532 2634676594 2475198645 1882446120 10440983517 11765940665 2587680854 1352645717 2743479531 1640464782 2443039038 1905691370 3627546412 2913535447 2659305757 3137622039 2245652500 2678063868 2509059575 1473752590 4147304921 2604617603 3122978724 1505176304 5175231099 1668448892 10029364904 11666045534 19301298.33 4513384.221 9678308525 10052028388 3069534857 4956952911 3311221957 3989366320 2509000389 1201949167 3335515885 3152850721 3374891843 1450979182 2524880351 2465153968 2529596456 2383716948 1556050534 3708385664 10377449867 10916357132 2078318486 3528534139 2237776745 4047700435 1909786551 1232114819 2978381176 3243562802 3185659727 1619309440 2489770670 3682471268 2960636448 3162283330 1340796972 9457000200 10686691759 3896705654 4918367106 3587461369 2597307697 3038116144 2970684944 2570037743 3377385604 3528850857 3738896711 2179516731 3627872271 3227487579 2363003021 2073838994 10826934854 9734860256 3063649081 4569319075 2376496554 2130585913 2263367778 2380923221 2868457867 3864612192 3428961503 2792974742 3728219097 3202207411 2121506176 2319302511 2852584809 2805535866 2629216412 11574490355 11877656128 4429057849 6826688.615 2889300.534 1175778.523 605458.9226 510328.3821 PE(22:1(11Z)/0:0) 125206.145 8950901.654 19834564.71 21561745.36 9335850.898 5655080.7 9396705.871 6708148.202 7686431.445 7820011.309 6937403.189 3491124.743 5231917.009 9400153.929 10261813.79 6015247.657 7445210.996 6548616.001 4126930.169 8918388.178 5608712.127 5207265.167 9795197.472 6057830.998 15513616.2 19690505.97 21500857.62 6820826.853 6588177.526 4683302.917 7549345.341 8727143.298 9107834.343 3426931.296 3106129.282 4880594.572 6161234.095 4425368.95 4235615.617 3379452.634 5657743.521 4951765.975 7164085.155 4330729.491 4107268.224 7638859.804 4652087.331 6111451.237 20728349.35 21633822.25 6074223.757 8048074.92 3981618.966 11551414.77 11096357.8 8780476.523 5033361.326 6086788.963 11048068.9 7978604.886 9865317.79 5449284.807 7913107.482 4837674.042 3677560.54 8905913.942 5123393.167 5431770.999 6572828.093 5667977.715 8284687.062 18479519.1 24088837.84 5982476.907 5670304.46 6417464.289 4340890.429 4542131.389 3780578.648 11173264.45 5972093.655 6922446.909 6758852.469 3460478.947 5987192.02 10546091.77 5194858.444 5796976.215 7088309.731 7576075.196 8499179.601 11708900.69 3933060.583 18565412.19 18982688.49 147683.4993 144258.7876 19658603.2 21763267.34 6008255.15 8731835.55 5734515.018 9404305.622 5395303.655 2945876.747 9363457.566 7252799.97 9423367.7 3140248.529 4388726.325 4937413.329 6771612.873 3989383.27 5017647.878 12448231.47 22493537.95 25197268.47 5217755.664 10502082.03 6028374.895 10767404.72 3250367.814 3507687.289 10720158.54 7747452.165 9103759.718 4435997.989 7329134.556 9113674.542 7620732.359 5492597.031 2465039.91 20230050.7 21105105.75 10258929.64 15919279.54 9776862.094 8326876.534 9432622.589 8457774.526 2084708.727 8288808.565 7350914.481 9981578.239 3779821.141 9589681.893 4995178.42 5308228.211 4368307.244 22817976.79 19973064.03 7721433.083 6481266.406 4434580.246 4468308.544 4281508.807 4122708.218 13595580.08 13570333.63 6181946.852 10162795.58 10730922.06 7847533.175 5518816.213 4279611.344 8185725.783 9444444.254 6989058.812 23113128.63 25057799 10007714.04 156554.4768 166984.2629 176507.4123 136600.5539 151584.3353 PE(22:5(7Z,10Z,13Z,16Z,19Z)/0:0) 54467.80891 11421010.19 7668916.274 9563635.051 10052734.63 10980859.18 10803724.71 15120244.07 15291898.54 14186105.49 8852844.163 13693946.28 29226158.94 10531704.41 15244349.76 5110559.565 12092231.39 8404930.988 7415593.441 12730963.02 7835666.704 9535977.697 5501361.826 9585152.372 6544805.727 7336990.779 10192772.71 11345539.71 13829282.02 8672504.401 11787850.62 6279960.756 7212205.884 7451745.452 5828111.763 8859323.181 5923537.302 4691567.866 9450000.747 8382411.048 8728700.266 13739106.45 12171448.34 7632168.402 9099849.903 17950350.13 8703370.231 13071163.69 8801932.801 11181994.48 11361186.13 10332583.74 9505039.929 12762137.44 16548128.11 9578597.657 5443661.459 26205494.94 12716097.22 24071568.34 21547366.4 10073551 7443926.506 11983827.29 5584434.235 22655975.38 9286326.999 10491722.54 12350339.34 7526543.307 17657679.23 7664621.896 11030336.83 13632700.55 8232314.47 9817935.632 10301124.48 7033595.269 13840943.27 16185721.12 6664850.322 7182158.154 6982377.886 34946136.97 11295497.96 19169315.53 9276728.396 14410433.61 10308008.62 17354875.44 17492914.93 15494423.08 3896360.649 7852577.734 12331514.62 48559.54208 45374.71124 7473928.085 9695524.335 20924308.52 19983985.08 13311721.33 15715915.36 6698638.588 3932261.311 6340240.577 10551758.43 9757078.122 6531380.574 10299177.66 9531497.447 4230073.687 5185430.2 4804914.6 10239167.22 9037444.754 12925966.74 6339958.501 8188842.275 8592211.922 15140897.28 6240300.848 4391039.08 13442952.58 17267794.9 14209390.54 6923247.481 25898253.29 6182943.891 6745250.961 8692203.972 5631548.735 7906512.968 12785285.54 11299124.02 30797272.31 13278342.92 12804612.25 9789615.862 9162918.36 13591865.91 6097018.325 12903162.44 18266765.79 6746407.609 8892297.919 16310370.24 7365238.443 7750709.462 10417411.03 8836555.656 5650233.93 25745908.88 10041259.87 5883310.331 6040123.836 10491703.39 9285384.243 15064029.3 10933491.33 12948669.14 5248027.381 10361939.37 7039807.354 10294417.56 11043367.49 10101046.67 11826164.26 8419071.183 10625049.99 12087923.42 56064.6108 47697.4416 45880.76987 67016.87646 43242.5685 PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) 49513.60963 69504701.01 56900084.45 67834375.8 84806677.52 61209695.26 150173268.1 122401344.2 89537654 117298775.9 138247114.9 75232816.42 102723139 92993655 115332119 50521010.92 74139317.25 76525926.68 74969388.49 114992158.4 131889155.7 72955564.93 80932705.4 82105660.82 113362780.5 54630372.57 73144543.56 73981682.82 97910540.09 81595925.81 74960171.65 83665349.3 57043066.85 96661814.87 49586776.41 74133079.76 72557166.23 52434665.37 107339995.9 63207579.21 100036713.4 56851386.14 89575007.18 41068717.67 85163762.46 151118056.7 65155485.32 103775117.8 49264763.47 68332232.59 63955730.33 84971599.05 51469736.91 87190467.09 87782260.28 82318458.97 79526873.07 203953596.2 98164568.6 260424173.3 110038356.9 81339408.18 92836798.53 170426579.9 51064101.25 183319386.8 70239049.31 188568202.8 70492373.45 60877975.66 86887670.36 57885027.26 81040014.23 91660007.06 62991031.69 93393021.18 60924423.89 58977823.43 115028342.9 78095409.85 93934520.67 99602202.97 110658642.1 323557961.4 63946099.43 123691056.2 69599828.19 83649851.85 68553735.23 96868376.46 112455666.6 60852737 44548834.63 49049726.33 71805347.53 44768.31559 58880.21354 48530241.02 70547881.46 69404713.34 105082955.3 112602517.9 68907499.56 59273374.68 55695508.34 58244319.31 88600374.15 86310618.51 125112941.4 81338231.89 77473077.55 90893667.91 72622645.88 64493350.51 105714848.3 65850534.07 80205734.14 40865042.06 123264075.4 77182951.42 92591439.97 55013907.08 133388863.6 94817613.13 75375055.5 99568794.04 99379016.64 199411362.8 69002810.77 122131052.3 80598373.04 83367586.16 56719359.36 69653636.18 89886898.49 142089421 64331854.28 93507716.71 80854604.81 104611999.2 70933093.63 104951924.5 173932138.1 89896658.76 68817301.24 64361140.3 77835245.9 70972233.99 93176706.17 57079302.03 59025199.41 96833971 122161421.5 77249214.6 74013547.14 108630341.9 102699901.5 93726977.44 46685714.62 202576383.1 155586524.5 92169914.77 76369462.34 61092758.77 72537662.81 108836149.1 86915021.25 98874866.39 60584710.81 72863009.06 66136928.22 46912.21682 38152.75681 46104.46121 55183.58032 49619.44561 PE(O-16:0/15:0) 22574.24804 2229404.955 492034.1034 243424.1542 1412343.874 1215761.924 2560236.414 1428160.75 1808824.656 1245196.561 1516829.209 1445079.226 1313607.002 1406414.905 1503453.066 1794081.61 1340166.927 1430989.024 1397923.8 998409.9223 1938250.241 1895934.45 1227127.24 1234725.288 1397579.791 492557.2626 396726.1701 1755068.655 1963161.242 987633.8809 1597803.503 1407706.698 1846635.344 1943072.535 1268206.966 1790142.468 1565316.216 1351752.788 1766837.397 1261047.427 1876950.714 1721831.623 1571259.622 1606749.758 1689704.38 1006595.776 1844210.409 1301472.254 510274.6871 423181.6305 1668855.986 1634232.17 866200.2816 1859982.47 2227910.576 1233643.161 1204438.16 789187.5557 1968149.602 1921291.912 1663307.571 1644248.159 1565041.451 1969394.426 1475658.001 2017835.707 1831282.109 1552706.067 1710318.994 1741749.32 2017748.816 460917.7383 468888.7381 1884117.323 2206444.002 1584561.859 1005856.593 1530130.652 1247163.099 2236613.281 2487536.275 1887282.429 1831971.401 1333499.172 1917008.525 1822513.214 1939912.797 2019336.399 1843532.311 1737004.005 1403658.253 2407914.542 1961996.065 433894.7326 453544.6202 77427.83782 50737.91628 444695.0692 344975.0549 1268589.253 1577952.622 1349698.076 1476387.319 2417902.705 1262254.664 1598365.268 2102201.324 1653348.974 1521286.558 1345965.157 1180837.626 1290404.166 1894422.184 1654130.45 1594966.88 817406.3819 477414.5839 582542.6813 1899007.523 1322919.556 1680611.14 1500064.927 1593944.369 1510345.767 1226740.952 1864709.87 1766214.873 1350248.116 1714858.758 2233026.791 1299141.69 1578247.992 619649.5487 217006.6907 2318538.46 1790966.941 1810828.413 1245662.234 1967194.362 1511365.58 1837647.079 1649098.567 1745314.885 1317752.472 1422402.654 1461175.029 1601215.143 1791208.621 1553415.399 617049.6309 505027.1695 1295762.682 899400.9421 1563762.976 1425071.693 1431227.116 1621340.502 1159011.651 1778913.92 1652236.36 1560554.983 1878402.765 1915312.55 2085706.592 1320486.201 1720208.311 1462908.64 1282115.562 574971.6019 519716.4047 2039668.246 117085.2877 127361.098 101567.3095 115408.6888 119355.8191 PE(O-18:1(9Z)/0:0) 133004.2154 14003837.85 87616188.94 92309196.25 10472018.33 7877431.152 9922783.246 6189578.577 6686688.026 10780731.72 9194504.74 5257881.791 7084245.473 11192209.57 8924699.635 7612633.829 6444789.682 7400923.077 2868140.461 4579091.594 9619169.032 10038016.73 7798767.855 4569674.172 9150674.652 74560291.95 89268046.72 7475037.905 7208435.099 4963784.703 6777561.611 8720467.362 6520124.863 9323746.44 6060119.473 6867345.601 9694504.587 3187252.459 5178279.365 6881461.06 10030927.12 4979616.666 5904976.846 4529682.754 6315566.279 9633223.615 5701150.482 7857543.425 83416299.04 92977575.29 7143764.713 7436426.754 5382223.396 11224304.08 6113998.659 9323628.911 5012898.201 10456656.26 11509106.72 14840579.55 12439230.79 5400730.162 6744687.512 5985490.713 8038755.282 9649782.452 4525885.581 6131020.026 8317151.345 4895535.62 4719516.213 86608650.97 102555773.7 9901192.333 3152078.155 6365402.98 3737745.396 5207546.436 2888064.374 11272682.57 7615872.034 9677078.651 8504249.396 15674717.1 6858625.289 7203111.13 4978760.316 8801057.953 7451486.569 8340755.541 5367000.879 18009684.77 2028238.892 85940651.94 108607178.4 195122.3419 252307.3592 77458331.97 86792509.54 7155537.228 13689591.66 5189966.083 15460346.73 10177632.55 1919919.568 11617275.05 10415590.4 6118346.053 2974857.663 3635739.258 7611507.347 5463158.57 8285721.808 8030276.628 9023210.943 80178966.84 89815315.72 5562640.289 8533763.233 4607413.31 7210779.917 6965135.385 5900876.042 9083132.481 7534467.417 9013501.271 3692024.532 6399500.194 11183364.24 8929137.067 8228757.559 1476482.072 75437629.46 91774636.47 11685347.97 13053096.01 10913600.53 7439233.08 7481210.425 5926533.876 7354702.925 7984750.494 9096080.006 8342531.694 5791173.573 12613613.78 7729489.173 4968036.438 6281751.581 87421887.11 83024771.72 11675441.82 11034564.38 7862646.666 6412182.147 4990517.856 10328680.13 9223669.325 8049025.064 7634445.26 71051564.75 11268828.09 8294830.502 6210094.222 4681975.331 7485640.937 9702344.691 8731746.501 94312775.13 101045971.2 13031849.25 191669.372 202581.047 209962.2901 206173.8098 200168.5012 Phthalic anhydride 11143849.17 4814511.948 98507115.68 130890227.3 54055325.74 19449286.76 10263133.56 8417714.03 6620233.153 24782718.18 5224574.977 6647960.105 4724555.042 3815560.655 3136619.575 4166873.342 3777800.31 4035405.655 4112885.762 3837473.031 3759784.949 3987215.345 3704411.692 3638857.837 3811993.185 80089016.7 116950162.5 119010690.5 17979612.87 9001945.651 8147353.443 6038572.417 5444837.989 4782301.776 4414622.275 4646048.508 28717131.46 30844754.31 3990906.931 66563760.83 4407911.006 4033913.912 3780207.568 3935181.62 3460540.266 3558720.759 3418906.471 23791882.68 81655087.15 137916706.1 61199436.35 33376441.47 13919030.8 9399460.49 5571980.37 4738828.952 4500937.537 208302880.6 7101260.536 5128227.099 5046210.451 4334422.247 3693311.257 4138865.97 4254293.579 21542609.17 4020805.803 4017614.577 3863584.405 21067804.46 4067605.488 75911488.09 125721828.4 155780113.6 22594616.67 14175401.74 7813178.66 5029324.149 6453743.564 5109548.217 5250463.372 5106664.094 4574214.44 23088699.55 15760421.21 4441440.212 4448508.291 82170174.92 4937057.534 4282176.982 4067477.608 3759038.34 3362645.301 78366680.82 116139953.9 55670175.61 16325457.39 86741048.58 125522273.1 136216445.7 25211493.25 13937452.29 11040490.27 8140816.996 6742765.282 6687685.909 4702443.032 5423767.813 5345503.72 5402031.707 4906344.718 6438992.342 4393459.258 5205955.342 4267948.596 92276032.23 130304924.9 143439220.9 20945741.66 11077532.22 8868588.679 7482197.563 7098270.798 6490100.283 5658872.861 5432163.302 5761951.507 5178376.126 5101651.167 5100343.868 4695906.278 4521385.852 78487156.27 131327805.9 267038500.3 24511656.74 16944965.32 11579708.02 8756667.369 8222004.5 6268416.108 6572109.173 6673275.155 5970223.566 5697673.583 5529803.916 5687201.441 5646205.083 5225873.979 90659235.46 119254409.4 103553302.3 17819997.84 13580092.07 9096787.739 7852298.076 7178759.648 6974403.609 5982360.155 5689996.349 5581450.041 5301666.743 5583177.723 5107018.908 4481916.747 4893481.866 5725354.065 4556650.669 90579122.74 123438844.1 79653186.93 18319930.76 12170326.66 7289935.404 6175333.597 5666828.055 Piperine 57199.14398 125764335.8 121077714.4 125702655.5 20393417.45 29800835.79 165036878.2 84239560.97 87661946.35 454695073 119835502.2 191652550.1 156925918.6 491806074.4 47702412.34 474536562.1 126800424.1 589340684.5 207977663.6 8416700.845 481734622.3 755732674.8 86557268.51 69846147.96 43464026.9 135430392.2 148747256.8 139483546.9 26957056.73 300318277.5 804553773.8 256491674.5 218988843.2 42101882.33 27041830.51 206684681.6 98253564.98 4941535.539 24908154.81 402025538.5 660363912.3 18569314.74 97024080.9 22027107.41 17825969.22 151655613.4 161658383.7 139784555.4 143600680.8 169132010 278823664.6 375813399.9 159812885.5 326637130.5 42572586.81 94010523.99 76346530.32 105288374.5 25031937.7 460403391.8 336446864.7 331468181.3 160109646.8 25877741.11 629074655.4 306375972.8 69796894.44 298236698.7 84881037.7 21936745.05 24062574.5 150498302.9 177467907.2 35935553.83 180720287.9 374497638.8 17020213.98 61536627.77 125401024.7 16717334.06 7205216.711 435356427.8 213417011.7 34877170.61 249849607.5 59369255.52 79289589.39 414630933 75227432.58 33759788.72 28084013.09 162658574.3 9158035.265 130942487.9 154329320.3 211573.9675 107697.795 138816108.9 150171279.5 10823333.67 129670229.8 73407141.16 260624931.8 36328351.53 175045628.4 179147244.7 145759541.7 122909313.8 12663804.08 121566770.9 203895362.4 375351066.6 203388677 6067738.327 234737779.5 167063887.6 171125609.5 110479982.5 68166086.94 17159034.89 42855384.78 132797922.3 234603437.2 35372647.23 262907748.3 622068088.2 145058142.7 143916448.4 141416507.4 133116645.9 271682223.6 145201075.5 143183195.6 165845598.2 193717785.9 268413719.7 549438112.1 58600965.41 176645965 636183700.8 355465304.8 306925195.6 94445369.83 152211759.1 401067060.9 33153053.84 38296285.8 33642111 121850726.6 159737169.1 153302020.1 174161798.2 123153257.7 56255347.7 110709354.2 66547319.25 477286503 171768293.3 501098981.8 110071651.2 156672922.6 299771326.6 223830311.2 149234407.8 573384828.6 68167922.41 14644207.74 164148401.3 165636647.2 174588543.5 171282630.3 59502.5298 53500.50847 45271.32768 46869.02794 55360.39182 Proline 23901367.29 236803226.4 300050137.1 324805024.3 181439222.8 359130723.2 247187540.1 266708433 172582087.2 259980315.7 248312239 195795190.7 355412205.4 294905694.6 194447267.4 288042633.1 408145127 267857222.1 233360670.9 360437335 831377706 184104438.9 169854462.8 223001269.2 174782932.1 319881775.2 321785676.7 428266184.9 264476948.6 224627843.4 597198532.3 229432612.5 236485657.3 273373276.2 347568228.1 272219479.9 244331698.7 269367042.9 239057075.5 232351238.5 178806463.8 178857532.1 215544756.7 150370628.9 189518836.1 378086716.1 204793567.2 407781338.6 288582295.3 314102874.4 214771006.4 474030506.3 289885333.4 184745034.3 186882964.1 232484174 203325818.8 384992652.9 237553658.3 346510866 176195357.4 296396784.7 283690883.8 186956726 186199452.4 270343190.4 196955963.4 335445640.7 194273922.9 215416728 260517739.4 289349418.9 302452216.5 311265016.4 164409395 331024129.7 262837131 201979787.5 175278614.6 193525696.1 166111998.1 197861382.4 281268992.4 257006787.7 573394061.9 237778172.8 204104068.9 425613817.5 236613593.2 393355338.4 444035177.5 205056842.5 163260679.5 266970960.8 298409688.5 45828871.36 6179778.731 248618330.1 278574374.3 288091788.7 312024615.8 345161560.3 228341345.1 216405370.6 185637585.7 203423277.8 187385869.7 155550777.9 136656772.4 196654174 235295076.9 191479914.2 209933588.6 248356139.4 192460014.9 260714087.8 286408475.8 266846008 129138966.7 241537289.2 330051189.8 202110506.1 121910766.1 144236977.8 431722536.6 207990639 147753415.7 213246662.9 206317632.4 173274949.9 216378535.3 166167815.7 268603247.4 285898362.1 303582857 427038217.1 335318271.2 221844718.6 249122195.6 219392507.5 244542681.1 256892989.3 379804384.8 314157120.8 255781962.4 266163222.9 388351701.2 184720070 198461579.4 299944030.2 281220867.1 181694672.2 295785874.9 184158117.1 188203006.5 137759897.1 231619521.9 359274317.4 401077254.1 311185805.2 278891043.4 174865212.4 144050720.2 359342359.6 243927715.8 144710477.9 347144669.7 236138637 278984796.6 276665614 278346684.6 6714955.483 45653256.6 4547534.003 429857.3425 31817670.18 Propionylcarnitine 30563.29087 45594793.5 43289843.91 57871124.25 52123434.75 42104773.44 34029113.63 73545955.51 51585700.74 32759649.27 86361128.59 80926163.82 73126842.66 116498113.5 32912876.97 66159497.88 79235629.81 88096764.62 44379164.66 35720392.38 69625383.27 64036392.4 74612895.25 63084623.38 40490157.87 46096522.51 57476950.35 39134861.25 50951475.84 90391397.39 79156023.22 80448343.08 58931887.58 61393365.8 62941354.36 40623546.12 36093093.37 50500061.29 42907738.77 48108552.54 70504421.66 33909461.24 40291679.87 80366734.63 76872349.91 106318946.9 47504061.88 25412809.28 36976570.18 63260025.44 48376081.32 32529172.89 38958874.67 86226302.12 33678185.98 74118528.33 90724247.96 85327820.58 67580006.94 66146268.33 84356007.19 46228977.28 96128851.34 62726341.57 42847609.17 51373149.28 29151926.93 93280225.72 88990866.39 65706784.68 55509440 44889261.98 60748747.8 61531662.04 36530624.88 31319766.19 47209738.86 58755313.56 93176175.36 43231191.28 68598561.8 40705272.5 40189794.56 47642703.84 46415597.74 49349751.94 34958452.63 50356858.89 32986694.35 43737332.05 11332496.61 59712433.72 19073321.01 35394782 61458865.3 103964.2523 30786.08425 41189015.92 55622603.07 42605989.3 31377587.55 51658996.17 74195114.15 60354056.89 38292787.26 38722058 42176852.07 64874447.32 24856718.52 43913996.67 77522959.46 33462401.01 41695327.12 30458544.94 39281641.27 46543036.65 63319869.07 52886628.97 42511344.73 46426798.11 64749103.8 69281615.47 37879519.35 36550826.86 66885824.45 43151758.43 28211000.86 30133025.37 65828885.69 27615567.27 97738913.23 28778119.26 48973699.9 62778262.87 47430003.47 48182869.63 71214319.21 25411603.29 49143302.99 36145636.37 52581959.37 71514837.61 43424300.96 50473783.25 68786798.61 50759264.49 61051835 64645618.28 57668329.93 53334182.04 64646718.5 57641756.32 50645229.71 51045341.35 65577176.66 44700540.5 61810906.35 52030249.96 75765542.03 50298032.17 78856040.47 41455632.93 46793047.15 68748371.81 58768794.26 41588911.9 45132512.62 63264840.8 46552672.77 55056849.17 68914154.58 42748.29636 41123.75479 49513.92776 47661.51948 38169.55991 PS(O-18:0/0:0) 74113.86435 16711495.29 11833214.38 12430267.63 18321966.65 30540339.35 30750434.47 15872895.88 18981039.63 21920123.77 26867133.71 18827797.75 15291105.88 30866499.18 25204407.47 20596461.44 30609664.94 34020420.48 21746686.2 24012173.39 29151169.26 20330025.54 20048692.44 15087625.9 26036519.38 10672909.27 13551439.93 12723308.68 14632465.4 25681728.14 21049787.99 31737156.04 29449022.49 12678366.16 26305.82715 25349234.41 20331644.14 13943687.77 16963853.87 16122110.12 16637948.33 23350826.59 23009152.12 17880026.42 21333252.96 37794359.67 14000234.05 18339033.19 11999629.93 14933878.52 17622703.06 14217032.47 11651560.85 29878436.46 36088860.2 36395854.26 29835031.03 17915060.89 31424160.89 9748884.99 21906112.34 15274174.84 28316091.43 28149596.47 17541073.05 39468286.18 13830401.15 20929645.29 22547671.31 31811600.74 19138774.69 11621310.24 14806250.68 19383113.3 21752081.1 15659354.18 17368134.37 20969438.87 15806448.06 28368909.57 33516723.49 35246194.03 37422578.32 8858938.511 16622794.29 29234691.85 11319498.48 20705667.11 15512764.24 31500876.7 18616956.56 96718.48443 10514342.93 11230569.81 14212611.16 49953.82317 51290.61393 10906482.9 13777723.88 22726438.38 26825326.33 24259787.68 23149254.82 19105076.61 11918039.5 24604459.51 17463387.38 19802615.67 13247229.13 18762234.81 23125719.39 13691599.07 17695043.86 13601283.57 25880092.92 13694342.62 16953582.08 14650024.27 23363460.16 18478741.33 24930126.81 14202129.44 13170889.45 21692663.15 25325203.37 14084653.77 16462782.25 15423132.31 22898304 24393005.87 32836405.85 8525509.68 12351632.19 14353160.57 33465160.97 17509690.14 12914529.04 15487196.63 16176990.49 26297133.13 17709526.69 13872003.9 14164555.12 30497319.86 12084453.62 29302441.13 11968596.29 14622678.08 22258246.53 13071178.23 13536229.39 10391687.57 16698457.59 13852747.99 13766159.66 28010645.1 19258307.62 12613980.31 26765323.29 47830248.3 36115349.1 34673691.63 33104705.38 15512080.83 15334394.46 31054153.62 21425362.2 17960913.76 12814290.82 15551955.06 18154837.96 54510.68462 56390.07768 62952.71032 46192.44729 45834.37453 PS(O-20:0/0:0) 57637.48689 3054438.261 2822299.091 3038122.115 3078451.153 3876350.624 6271512.472 2028990.398 3707022.893 3651398.959 3982524.943 2315259.405 2190651.204 4927163.314 4400045.835 2639986.28 3871547.3 4598276.858 2499502.671 3174061.261 4542237.663 3610353.774 3638331.618 2222515.212 5724439.959 2572518.975 3047571.077 2226564.74 2775856.71 3778350.572 2985821.434 5109823.831 4791851.829 2603873.179 1835293.841 4592191.686 3077038.32 1725899.387 2684479.085 2718069.148 2819972.289 3608677.014 3780449.033 2716632.78 3970718.843 5896648.984 2229631.841 3000270.565 2771909.469 3213527.941 3231000.673 1996895.528 2029108.596 5225064.619 4497868.776 4956811.888 3109489.055 2324195.725 6213039.488 1914412.789 4675871.079 1877986.988 3572867.823 8017947.188 2877003.296 5424925.522 2798912.035 2544998.889 4220364.511 3626171.048 2406545.387 3030058.262 3432546.518 2831845.207 2838486.955 3651995.001 2605284.864 2746234.301 2024771.84 5429091.34 7227407.5 6640658.051 6364210.174 1535567.995 2385580.242 5692522.295 1595361.62 4376968.809 3587695.498 4946866.15 1840554.034 5844562.258 1299012.002 2645723.829 3334424.106 50102.03859 46837.76272 2622515.964 2646902.672 3891212.516 6523243.213 4398166.441 4588613.048 2814267.815 1322549.088 5363224.965 4382211.48 4223918.225 1779248.954 4309061.9 3768069.038 2838161.373 2904763.289 1783814.853 4611073.19 3302628.639 3644699.184 1981389.937 6094342.496 2846970.41 5768700.871 1963166.137 1882454.792 4377307.2 4123898.758 2410946.981 1942937.467 2397540.337 6173266.285 4997268.467 5978067.481 1590746.901 2801672.074 3362053.817 8533856.256 2860480.974 2303640.864 2227474.22 3635464.2 5520011.227 5256139.374 2702887.835 2875775.831 5514913.893 1430931.081 6406129.376 1711273.035 1878390.48 2742849.093 3204217.87 3177121.139 1978177.179 2901545.676 2484595.879 1761341.547 3864576.089 2291681.992 1890797.189 5371689.765 7619743.024 6039721.393 6280403.776 7579409.956 2514336.359 2136459.023 4432947.989 4586156.363 2903762.233 2997704.117 3544762.002 3153800.127 50939.81164 59467.11466 43541.30048 40167.66411 52494.93874 Quinoline 103521.9781 4139075.807 4248980.603 4003664.426 6358156.66 6126042.201 3289190.353 3870788.936 4503755.684 4163591.481 5255425.439 4957550.238 6142153.863 8341660.339 4755399 5620641.042 2420600.509 4863107.97 3093181.125 5768025.055 6142562.577 5627945.181 6849796.28 5870097.556 5341914.111 4257123.625 4453606.37 4554754.729 3656538.635 5287700.887 7744827.3 5367223.276 6210978.667 6206116.073 7052703.031 8588906.954 5621031.916 5478452.871 5861777.713 7070746.918 6876476.962 5716297.629 6790785.27 7484280.45 7477648.254 9874961.01 6731575.425 8039975.418 4423078.725 4897497.899 6359699.823 5097747.627 6967840.814 6360917.656 6040004.239 7498491.318 8086811.119 4965445.851 8538497.937 13443251.06 7799711.331 7559054.261 6272181.172 6592406.619 6622945.344 6117884.979 7373456.073 6829894.101 7881148.318 8247414.311 6128858.98 5472434.32 5317280.586 9149249.523 5183671.688 7488904.48 9646914.926 5174733.917 8512446.529 7532571.75 4930511.707 7892338.505 6425324.698 7199069.488 8163438.141 5607421.515 5900207 6240646.702 6864933.465 7808794.373 5297593.156 8974643.493 5138824.208 4977170.789 4857235.747 901527.3097 40804.37259 4471143.249 4918513.785 6994688.884 6670008.283 8193219.36 6592177.428 6835141.633 7204714.453 5046728.983 7177383.654 7844255.322 5327664.732 4060916.301 7993997.757 6875289.409 5926521.575 3407713.615 5563019.622 4888430.976 5456826.69 5177445.887 6025707.09 5614337.071 6106501.578 7246478.237 6287899.274 6346148.145 8425200.317 5988940.376 5636240.142 5634579.852 6488929.662 7896691.06 7304994.326 6660137.056 5018448.012 4768140.086 8152937.143 10095814.51 7362126.548 5418429.181 6011378.652 7253902.958 6057215.261 7747709.217 5781630.902 5889155.362 6809721.538 6089688.901 5685623.631 7066628.788 5708964.295 4805037.043 4522642.738 6974018.16 8184500.219 6447748.456 6913354.429 7145279.095 6043565.569 7704290.02 7283587.725 7947948.783 5880772.796 6489627.268 4848731.093 6488784.797 6372494.51 4897871.154 6024702.18 7784729.943 4996605.111 4592958.054 4981417.044 43529.1013 262494.8118 38823.5396 328588.6512 297089.5436 Serinolamides D 71407.08835 6293720.965 10324629.52 9750369.323 11170633.56 9756306.354 6838713.444 30834434.93 7249366.709 7215720.495 4564748.824 9659474.58 6835323.211 6420607.702 13907435.59 6237015.247 7372083.936 15023263.26 9407384.481 16487997.27 5955015.176 5965934.934 11998463.39 15589157.17 10900083.82 8219631.52 8732591.437 14118277.91 10020899.46 9140672.498 5394480.91 8298205.88 6211550.81 5481843.162 10706048.63 5289407.233 6512556.096 11481044.73 18166533.08 5945761.289 8846949.293 8187671.242 10205074.19 8238091.439 3939921.309 6377196.651 8304590.939 4894032.412 8000621.337 9442440.922 6615718.113 8542533.462 6408443.23 10873475.68 11787003.63 11717471.6 11746873.02 7512750.935 6427529.683 5202492.209 8373862.177 18374794.46 14317987.97 7097144.349 3929115.566 14863586.36 7317432.651 6682988.377 9519418.606 8278606.876 15139676.57 8338388.13 9400313.323 7721801.185 10905828.85 4014172.209 8501894.27 5899260.789 4258236.173 8714757.584 6028847.437 5462731.508 4006159.139 2853799.607 4726192.746 8249490.949 9608189.771 5867320.144 7714591.008 4854930.519 17005122.5 5565998.313 5356533.828 7559256.648 9144838.06 47780.33812 46674.37376 7311771.636 8456262.47 4958708.85 6094970.187 15514110 4306846.742 4002261.185 2520550.492 14674627.91 7826261.494 8117827.309 9490945.273 9472900.502 5177881.284 5435516.76 6624713.695 11548954.07 4508761.784 10919142.89 11193277.68 6224884.103 9449138.701 11472712.86 9122403.112 7278200.235 11590436.79 13716951.12 4761874.945 12086575.96 8847623.769 16688945.6 8337551.391 8947490.197 9266632.476 9828382.52 9731341.651 10600627.8 6770009.169 5158533.332 5303350.607 8148508.063 8763463.124 5090896.317 7745136.699 7340240.602 11038762.95 8071686.171 5235987.977 4232185.039 4411078.637 15192501.25 12734453.28 10527249.12 8618481.852 8003730.743 10998787.96 10917643.44 9383535.134 3060170.282 4519401.855 6230465.264 2651097.962 17807546.01 13260273.83 8739951.904 10469992.12 8095659.544 4813376.564 10609810.03 10221142.8 7666761.474 9880455.052 10154819.84 6083807.984 50909.81716 43809.07207 63746.47768 51797.292 46818.56476 Serratamic acid 51114.96177 1574581.412 1433197.357 1770581.44 2890927.028 1897608.113 4484216.618 2605805.439 3667778.289 4429693.412 1539978.417 2956919.339 1788418.962 2732731.88 2175845.654 2028729.651 4588465.652 4011474.405 5312436.477 5938930.02 1395779.842 1323557.919 3522410.977 3969233.093 3289251.732 1391908.301 899612.0925 4590822.035 6312766.602 10471272.01 2233344.081 4408884.166 3782759.499 3164175.83 874141.9351 641490.6735 3183920.12 5248996.996 20530808.88 2583612.297 5736777.271 7447878.442 3800380.28 4195652.686 1797711.531 2867559.059 5263637.88 1301616.85 1639657.83 1903826.872 2156690.115 3875639.424 5712282.611 2159898.189 5169565.143 1455416.352 4802229.095 14537505.68 1741717.124 1047730.012 73485.85977 5062105.018 6559937.661 6214306.903 1811393.338 2682439.123 2564151.44 8166338.74 2348473.678 3274689.476 12865919.08 818693.4736 1136470.664 2080539.521 7445500.874 754727.6685 1918125.264 2959353.097 1966030.185 3492438.258 1691417.996 1401368.259 1444558.014 2073798.526 968931.5256 5596628.87 7562804.309 1230073.861 3765508.64 1396862.058 5578252.109 1445182.296 2602581.513 702248.4966 1130939.454 44105.34714 46305.38618 1370788.453 1779528.953 1904337.729 1990869.133 11480271.64 1976587.306 492020.2934 1495612.667 2962491.454 3077349.765 840480.6512 3842431.317 3706663.366 2422528.9 3288290.28 2186142.21 6198714.749 1060422.971 800816.5852 1945992.541 2759769.777 4951188.396 4296139.397 6167438.121 4338551.488 2504492.997 2381729.177 1617733.405 5022867.621 550657.6869 2244418.911 3853191.747 2984372.973 1208527.352 3750890.399 937335.1317 1891759.952 1875501.527 974024.5527 1646308.576 4846798.982 3054016.186 2519931.588 1929358.786 784541.7167 5515637.6 3259372.086 1326719.171 2124403.218 1375548.722 2139372.787 12746979.05 1064424.98 1770752.687 2504000.752 4912105.268 5486017.265 3034059.158 675769.6369 1213618.344 3296116.749 346788.3687 4298558.154 2531067.633 4611054.581 755161.5958 985452.0191 1315972.833 7048296.56 1490709.719 2345098.799 1705477.193 1945195.888 1882316.675 42230.60586 43083.84102 43707.85796 41498.18743 47389.31027 Solasodine 27803.07971 537316.1065 1222190.765 693488.2985 28400.1818 472843.8539 989413.4862 579831.1856 869917.314 259103.1066 396819.2145 1232135.027 2229503.309 1812772.268 235742.7801 3885815.604 95474.21476 934241.2006 27349.70159 715618.2844 120524.0087 4028927.632 972756.5301 83235.73749 73236.91838 1103627.645 729934.7634 911316.6994 161314.8454 194748.3333 8604390.946 988861.4756 1916284.741 35974.66385 432752.8416 635259.5776 2462398.816 26153.91883 134126.9009 3251165.187 3094965.275 720233.5663 283012.3924 7767427.693 30262.1821 2985770.565 2179329.57 464764.322 1121998.531 722768.6772 1496143.412 1972130.858 3374753.622 615072.165 599420.2694 1074095.658 759726.0268 3992399.731 410657.7869 747774.563 687352.8293 2553683.831 140876.9174 866340.8224 4545433.337 698251.7857 503980.9544 1293120.961 34632.45439 30831.71071 401472.5304 950045.1332 723260.3046 253604.7419 54594.04427 217526.4277 460797.2783 678954.1064 282456.5978 152387.9199 433832.2289 106019.2549 726019.3854 321189.3128 29427.78051 27229.21103 82660.21732 124642.384 66805.01549 673226.1595 270911.1997 1607167.359 170906.7934 954345.4815 555301.6978 28048.78465 21269.23001 1161999.053 730366.7001 10701722.68 821278.0463 303189.9291 166729.6557 92906.24971 808138.0842 941754.3449 3851697.069 612021.804 5807154.956 369463.8444 859961.4469 364353.495 168564.5586 406548.3115 112380.5945 1260220.734 736753.664 2998884.181 25513.4089 163932.0977 775803.2953 236821.9481 30486.01786 568435.631 527822.8728 109623.6554 1286452.463 2484996.382 1378786.832 566994.7543 28469.15566 87687.28075 1115653.128 742115.0488 39747.44721 913894.1813 57396.59742 29670.92427 199131.4014 580923.5044 559091.7309 171347.3328 3276184.516 33766.77314 204693.6758 518926.702 116960.4045 535782.8423 71362.78648 1198626.561 637974.8398 2483899.408 533271.2628 687415.0583 214597.7131 127305.1799 401607.2221 2826524.825 460695.6493 27900.32706 39396.08285 370607.6072 605830.8283 98269.17945 1403645.791 29550.05509 3226159.492 136157.3671 1251020.887 840997.3973 560078.1926 31218.24737 27569.8762 24981.89281 22718.39731 27347.76122 Spirotoamide C 32778.2384 200403.8453 176701.1175 238586.2179 261726.1995 186366.0415 207048.9616 328528.6039 185734.1699 212829.0968 300637.3535 235436.181 269907.5094 384235.9917 165516.8781 152896.0754 194759.5262 181086.5609 289391.3813 395359.6575 135834.811 320078.4767 240825.367 267980.3729 268715.4388 175536.8243 235975.7547 283460.3375 352915.3703 303799.8709 168072.3549 261943.1956 298640.5294 138563.2285 145994.7761 79375.86276 184675.8558 226540.3162 461516.0661 222767.4786 407770.7332 276501.6859 205222.814 279298.3304 186024.9027 394527.5806 380130.1427 229742.8062 176464.1458 210576.2723 237992.714 277108.696 106007.4841 300069.3543 496701.4499 367117.4222 279096.7479 459997.4873 361302.9837 307027.6549 458894.4386 277232.3216 278081.2776 230424.1935 161255.3065 564181.9666 200465.8358 244538.1375 227776.5076 197059.5942 803608.0507 157338.5271 274389.6794 288742.8533 232356.0795 208786.1237 331570.1224 126608.8974 212718.2247 294506.8772 154540.5486 214038.6634 163113.8392 59688.9503 115197.1273 384491.5236 430898.3756 216179.9992 205814.9487 245765.9145 357644.629 373022.6185 168731.7653 172818.8908 247845.4018 33510.48309 34760.44938 154746.8637 211285.2633 211557.12 292210.0294 632916.7735 425256.7966 269759.6074 98159.12859 232141.1776 250186.9685 210661.8855 157860.7389 364257.1269 223474.6267 328796.9328 331563.3261 399821.2032 99938.67201 210868.7805 273329.6875 127766.7752 253605.3569 292850.2336 315390.2202 188849.2245 199315.2427 286827.4912 205410.6687 303392.7399 193475.985 239062.3869 211205.8275 153099.9842 411384.836 177110.2021 212606.7811 240804.6005 612629.423 152644.2078 335684.2393 202139.7462 264330.5119 135272.6595 221928.243 290474.6109 169468.4826 298125.9225 106306.5164 271842.7255 134769.3139 257526.7956 326397.6063 206874.6557 227324.2462 246654.4558 391783.1838 317453.2417 253467.7143 119848.5711 178178.1664 368321.8354 114868.2442 513194.2958 552436.9497 325169.515 268723.0215 61370.03177 87079.75566 339884.4632 416224.4949 286568.264 186063.2842 276686.4512 177036.166 36049.24557 34855.17477 30345.76023 34102.1959 38405.14707 Spylidone 85606.13761 4616905.801 7984344.168 8570491.9 2537296.357 2936999.734 907337.8488 24554452.32 1117329.485 2133077.558 3321586.433 3650645.005 2835082.891 3636680.399 905333.6949 1792806.416 9086996.913 7222361.593 2018988.512 2244818.214 3404277.194 10394654.65 5872969.857 3232845.497 1438838.19 7762259.902 9981558.194 2141094.202 3385050.613 753600.0422 3583123.663 679052.3336 4415821.239 58819052.87 2186698.445 3779110.01 3227931.78 2258919.514 1306552.847 1187409.794 2854367.439 15254496.62 2928204.869 5256712.252 3045988.19 5583578.648 4875361.916 1210644.703 7892306.842 10597918.5 5193819.095 12620968.11 2268848.771 5074808.185 4637001.785 3875761.276 3397472.557 1181343.362 6932696.617 4117649.586 1014767.764 2603360.728 4022001.763 3388391.429 14172574.81 1986279.739 903459.2812 7052821.025 995701.4997 2899070.864 2686959.068 7844046.349 10117694.32 2773075.716 1432294.129 35161178.87 2920788.586 3420872.146 8714175.188 47319697.12 9838369.613 3515723.033 999468.8527 5346050.42 10448501.68 2661243.437 1620234.554 6320535.508 2755015.52 5402427.045 7095520.261 12295660.2 1132870.312 7197445.086 9939329.781 85561.5513 54821.61265 6954715.601 9398394.388 1933631.443 826214.0419 585848.0335 1890115.534 3706762.79 1181614.877 13668956.78 625490.978 1190065.723 1294672.972 1593456.282 2788455.219 3976398.707 11944194.91 5727505.497 465830.1142 8376349.697 10283738.33 8403305.295 1309728.63 1282338.412 788772.0903 2077519.057 2415102.013 17835246.76 1083562.245 363277.8992 3093906.037 4475743.466 1379330.38 1572530.406 1786824.894 584019.4596 7897306.986 10245691.48 1089747.061 9353330.889 2101611.597 1388752.015 7353687.53 8216308.401 3269627.076 3493516.113 1136127.463 10413409.52 3466877.437 1703450.245 3647803.016 6082145.177 495139.4694 9000381.8 9051961.533 5476784.536 2015198.667 942760.1496 7291776.92 20873854.01 7846775.689 1261196.941 8633151.744 4856376.162 1163268.759 3043946.507 892695.8076 4541103.7 4182598.312 1415215.323 1037341.191 5292477.254 8420052.085 10350736.59 4800396.324 67616.80278 71448.51326 66817.06808 61364.6685 68030.17388 Sundiversifolide 89434.93139 6326331.803 4938724.361 4508201.562 7762628.478 6586470.819 6395230.921 17571546.43 3622823.608 4352758.483 5531005.73 8562502.086 8387576.498 6334776.273 7318167.921 5095825.212 5195071.902 6925135.995 2221743.302 5080403.019 17496409.85 7406679.246 10039742.9 9392145.034 7202228.595 4802415.808 4883138.65 5772912.371 5256876.006 4010561.296 5835670.367 6497474.745 3639116.307 5154785.269 3445328.867 9783602.23 4074596.369 3650569.802 4182088.192 5950996.392 9758684.168 6892070.348 5522153.952 7668113.234 2812876.581 11125877.93 6589565.689 3870279.914 5077169.009 5353301.346 8704179.325 3872856.455 7354520.674 4679379.211 3458794.559 7370569.164 3932847.317 5900301.229 6535975.989 13128763.45 6635645.685 9089507.472 8698201.946 9565514.252 5398144.31 5509661.128 7269976.382 10947617.27 5704448.979 5863537.763 4450904.551 5087908.784 5381042.554 9695293.257 4428471.21 3764086.789 3768421.11 6471296.208 6477267.695 7161654.528 6567849.065 12194945.76 7342198.88 2765654.052 5369500.251 6038676.393 3219321.658 6680225.76 10061593.6 2395862.371 6091684.761 12964498.27 2155612.006 4875723.687 5623915.164 101044.6428 47512.78376 4712060.079 5165871.455 7787597.7 7408018.129 10940020.28 8442431.367 3404078.213 7350132.994 11295649.67 6895635.821 5485424.88 12462478.41 6954339.574 10494670.15 8304802.861 3917674.838 5041961.186 9909427.262 6051907.517 6060942.339 6315865.471 10508748.83 3870972.019 13754040.58 6077376.044 13551714.84 9164333.115 4446136.916 10133544.15 4855742.549 9467370.538 9562573.593 14746396.32 9740670.973 8957997.271 5729183.359 5307057.289 7079239.049 6080627.614 5375455.367 3354559.236 10103047.35 15452587.71 11388690.36 10539616.1 13642618.32 7846348.751 2489097.44 4987353.104 3345173.595 3602577.662 6103573.158 5475172.877 4899905.616 8633044.424 8283580.985 9512735.097 2625737.878 5835261.871 5392858.016 17116095.51 17590706.34 20695946.16 6680036.059 22869471.94 8915293.258 11062208.62 4875174.089 5612127.954 11122400.36 5509662.506 5804791.414 5471761.489 7979747.871 107856.8741 164411.6498 95493.50537 233303.9293 64364.50948 Symmetricdimethyl arginine 112209.0777 11690987.15 3191705.558 4746198.296 12423070.53 11952413.75 12889840.81 11881155.07 13447924.43 12333090.33 12794874.35 10647728.68 10485296.03 13811229.9 15233224.14 10216868.63 11872810.77 13719306.61 12603180.46 15977743.13 10329299.34 13354062.79 12602477.22 16557429.77 14538020.71 3438124.302 3583430.916 10937455.07 13824329.54 10879874.97 9408667.497 15308417.6 12502543.47 14619286.2 10864846.47 10210145.98 13645017.12 17170939.96 13646035.78 12576426.34 11743721.59 15866220.83 13015633.41 14066333.04 11599140.16 8978503.069 13788830.57 13893051.52 2850360.372 4210915.5 10568349.86 12248162.39 9046108.628 15456541.52 15335090.41 15943051.87 15266424.13 10277748.43 11908902.32 11688422.24 11384989.92 12118102.32 16120528.65 10485728.59 11322232.25 10844355.34 12051077.56 14041797.98 8906172.126 12900777.44 16818081.17 3420299.493 3180304.351 9518779.086 12697833.86 9047387.134 8881602.151 12660535.7 10573025 12154131.63 12784419.93 11548531.51 13496618.96 14193350.83 11537521.29 9101371.257 10801630 8850500.565 11866812.62 10901504.16 10339573.79 13403872.55 10959432.43 3924087.211 3557087.265 96724.01816 233525.0609 3154592.985 4502658.038 9724992.742 10522883.19 11416295.07 10535993.34 11381583.48 9507534.2 11419133.89 12205560.03 12554063.78 11257871.16 10307086.69 9154504.704 12824570.09 11628522.1 12926839.62 10627612.87 4403145.971 4857446.297 8567215.237 13412263.47 10907184.35 12500157.72 11087214.66 12383198.05 10868779.4 9749408.403 10924497.03 11613053.76 9571791.407 11451306.65 11403283.81 10592202.18 12400846.78 4474229.978 4486538.063 11232074.03 13046082.44 10952034.49 12319031.69 10082356.35 11999379.69 10110416.33 9260361.444 11045090.54 9155696.07 9184966.968 10152339.83 12687469.07 11422799.65 10569167.42 4294923.702 3850517.511 10512376.32 8702026.487 12137722.91 10710392.47 9302686.889 11541603.25 9632998.369 11428729.91 8835125.067 10687474.1 10534403.14 11837552.43 9709355.296 9794466.968 11419977.34 4217168.324 7563705.879 3341155.09 4120388.676 9825899.651 251810.0287 251045.4535 255651.6467 275361.7862 259338.3772 Taurine 40769.16352 3575997.656 6436793.03 6409455.223 6295399.62 4180088.354 5327075.473 8571090.171 6429745.345 5940122.698 6529049.585 4127043.48 4633630.735 3597635.383 5620899.337 7100092.095 3888364.356 6720564.408 6213544.103 6115598.958 5183437.247 7665590.499 9168405.374 4122316.766 5923468.951 6004180.772 6020531.647 7994105.825 5389755.572 6090302.808 4634106.58 5879493.578 7294708.811 10419128.91 5996914.783 6069363.575 5591554.543 4775703.579 4253993.152 7314301.915 5186400.65 5556829.67 6948316.95 5887468.016 5845838.821 2815794.032 6545821.169 5582408.838 5351300.136 2879086.715 3072247.682 4141198.181 3140994.622 7902075.17 4013194.403 9981765.238 6867509.849 4252374.458 4434349.424 4458148.541 3748281.704 6114391.598 4656691.032 3291668.636 5329872.532 6545056.103 4798978.069 3781089.887 5870401.087 7629688.483 5663783.67 5499925.853 5080922.995 3442631.501 6050598.499 4696560.96 5203000.123 5570516.95 5042237.868 7182974.418 5361912.211 4730341.428 2561542.209 20507226.35 4346711.491 4048432.786 5149704.401 4521048.657 5456892.628 5027403.055 8358940.678 3924614.896 5841068.814 5172431.116 6560541.197 415386.358 50763.3238 6030020.28 5539829.632 5563540.255 11709339.7 4480920.098 5710391.927 7035989.791 4712636.054 10692831.31 7494568.008 4978126.582 5693668.619 6032183.989 6657381.51 4357759.409 9271176.7 9122456.091 8027837.118 5663229.861 5756827.997 6623658.696 4204832.681 6586114.403 4940659.82 9783675.825 4487124.575 6391533.757 4468563.607 5833775.877 3714828.047 5736860.21 9101846.097 5997807.659 5368029.321 5627029.371 5603430.817 5953981.869 5096623.806 4686973.179 3695654.113 5337662.282 6930273.238 4375082.378 6982421.801 4295694.375 6563093.153 5378445.551 5440953.281 7723870.19 4033261.669 4856560.507 5420187.464 5416373.284 6148037.155 4510548.687 3907281.266 5369766.896 7980842.496 3806217.203 9287382.382 5461647.835 5023309.324 4029614.378 31558560.69 7818337.259 2927322.688 4985496.615 4715561.248 5531977.742 6494631.708 5034532.93 5316326.393 5365673.579 3153700.738 259534.7981 117919.2334 459575.4882 78194.76448 257488.2742 Tetradecenoyl-L-carnitine1 65415.7387 2015582.316 1435345.844 1234997.229 4686742.539 3790398.917 2937557.405 8416844.614 2284467.756 3689106.475 1726784.367 3677088.389 3264809.017 2779362.014 7898212.282 1740057.85 2672392.143 3665471.49 3367000.582 3567307.865 2627337.315 3156171.526 4761622.452 3867635.955 6745206.183 1057647.462 1434329.715 4899627.255 4234773.892 2827334.115 2080707.625 3058647.531 3673346.673 1783938.835 2162985.268 1770696.214 2739273.489 3002652.936 6767169.742 3673473.146 2839704.009 4141188.542 3967541.191 3789099.42 1695856.311 3033296.556 3720217.082 2572430.643 1289436.996 1420138.729 2778269.258 2069904.748 2443911.41 3758604.167 5722458.911 4522955.92 5300447.456 4071097.893 3997580.642 1883335.216 4795243.995 5724512.101 4191036.46 2233241.859 1547573.025 4983420.588 2426160.713 2877922.322 3976786.374 2448821.37 6900436.6 1313288.432 1601223.449 3557318.802 3599564.655 2384330.526 3609130.413 2268631.383 1823042.202 5075434.644 1710021.81 2839236.49 1635815.873 530695.4075 2104280.601 4422202.094 5295114.039 2886141.299 4747665.406 1537875.522 5345440.676 1886278.275 1980679.167 1165189.101 1427835.406 73614.5476 90109.72979 1030669.855 1332713.184 2003261.693 2417177.333 11602570.26 4024144.115 2658500.076 988344.7156 3719617.539 2093261.783 2842036.003 5482094.307 3801443.208 3509819.293 4470006.923 2047210.212 5200839.35 1449285.341 1591051.254 1881098.438 3912743.193 4093788.815 5445358.582 4083748.678 4052381.465 3329724.623 3221084.74 1907561.956 4685124.052 2637953.021 3633013.21 3234556.642 2216983.607 3485722.55 3374603.894 1218690.56 1492086.447 6170865.703 1647278.375 2765698.386 1994822.168 4123406.838 3149999.106 3446324.24 3538857.163 3393057.323 4395573.753 1632024.271 2616437.281 1333155.824 5326988.364 5413248.82 1386856.245 1298926.249 4239484.381 5365901.009 2782713.193 3245215.375 1667440.876 1483226.139 5977126.468 1632851.669 7550947.503 4853619.351 5718363.664 2264164.32 3369001.874 1529257.99 3552848.915 5258199.49 3343744.296 1367166.141 1572398.367 2721540.507 62134.28178 59001.42823 52642.40195 67900.10465 63722.80449 Tetradecenoyl-L-carnitine2 50260.38188 12736790.57 13704284.12 12616010.42 19983376.62 23784318.6 15894349.81 55945886.6 13172273.37 19426417.06 8065168.179 28891044.71 19884365.69 17002645.04 49145786.96 10357483.29 16204812.32 29772928.67 20297136.61 36768329.18 19379241.62 18182493.36 32162146.99 32787551.93 39326255.13 11349516.92 13329163.84 55542207.19 35907901.87 26073513.66 10738981.08 16785055.6 17778165.93 14897451.75 26981851.1 26460117.32 23668387.6 22137266.98 54508185.7 25457639.13 24412822.3 21448066.89 49524986.12 27300997.89 9205116.864 15355588.36 21023002.93 12391972.52 11862720.2 13344261.55 19689464.86 9134314.168 15118924.27 34470599.08 33529368.78 31577575.99 33814051.27 25700200.16 21337631.57 9932446.797 29291979.62 61237201.57 34398841.02 20886929.04 10112531.72 33479522.79 18310739.72 15146629.04 31913497.24 19059432.76 48358954.19 11700785.42 12926610.7 23862400.14 20559399.62 12410228.26 29500075.12 9873275.969 9893672.536 19370826.25 13861648.1 15453646.13 9965158.787 3844460.339 9413465.361 19118186.67 24066127.73 19320575.3 31152136.6 10250679.1 38959104.18 12317282.54 9751240.042 10638306.01 13548657.85 50293.63537 41504.54635 11067228.07 13336775.86 9198334.474 19297093.11 49102448.21 19555193.1 12048071.82 6473666.533 29303767.28 15220361.57 25762910.08 35072189.88 30552620.97 19666010.38 19194518.04 18446401.92 33517750.19 6472704.313 15742080.76 17946644.58 20372216.61 23798570.18 41315405.3 28871969.33 27554436.78 37809547.74 38010588.05 12098053.28 30693403.56 31062135.29 62873977.64 23899995.64 13857235.44 30085067.15 35595875.17 14628707.31 14798967.82 27084455.84 8253042.625 11363305.07 17152730.19 42866114.8 16734646.98 27912993.08 28288755.38 24430422.21 21368593.5 9813933.004 10695679.67 7484253.233 41612508.66 42186891.78 16210988.76 12483584.96 21068362.56 26452931.38 23951942.51 24171845.32 10212964.88 10469712.3 21720104.02 7161032.917 62398420.97 37411566.24 23478425.82 30761169.99 36979499.62 9307312.076 24952817.68 36563687.79 18039165.31 15357366.79 16161263.81 14707230.32 50553.92253 80390.5201 62503.81676 49136.55887 48171.41249 Tetrahydrocortisone1 29938.36455 176241.3244 190240.8452 162841.8698 342558.4559 383408.9023 285676.6323 264496.8773 434579.4469 225504.032 323466.9139 211667.4523 169690.6413 30367.46965 408419.7785 87378.2816 235564.6725 474431.6009 198274.8135 442661.5974 227036.2043 372977.0539 225144.2708 345757.5341 279660.8348 190329.8416 171511.0084 273546.0532 211135.0867 221208.312 303290.7874 216697.501 267765.7805 212879.3281 324676.2486 257135.2484 208018.5077 517564.799 223463.9476 73811.47179 287480.937 197076.8514 229892.8338 296558.937 199346.3373 363953.6174 368498.2355 385820.7694 163462.8346 196773.5435 148380.5903 366858.6562 477452.0087 263561.1331 191714.4342 339417.1231 365564.4273 28595.97772 279212.928 1341655.959 366936.5306 309152.0031 356034.7221 200210.3102 217455.8662 319195.7863 108654.8843 424591.213 281250.7556 350638.5813 419806.8642 183711.9136 198831.8543 251075.1164 250992.8468 143150.385 372906.3755 122729.2572 316417.3079 382949.9812 143731.761 286770.563 239491.3434 314819.2439 435114.2184 371943.514 399489.7606 155973.7265 351774.1577 369418.5784 451077.1342 569624.7856 423160.2747 185099.5694 193880.4447 27380.20656 27321.41233 158823.8485 185476.5222 235405.9254 175803.5474 235115.1712 145987.7589 216136.5859 512196.3813 575421.5943 389603.8589 283350.0292 258627.6056 505690.2535 899218.7851 476571.57 333953.0082 368234.2058 133607.4824 234412.1699 249725.1065 296966.7943 242202.9504 235581.1953 194760.7702 204900.8651 1287171.747 424178.4414 232044.5722 116527.0324 767794.1688 369903.3966 129872.9858 260900.2272 278582.7177 358679.9134 227930.1985 227352.9225 116650.3127 513017.4239 266312.4503 256483.5775 178662.4956 328223.6425 200953.7284 215446.5193 264786.621 158148.5043 463668.7729 655259.2788 322647.558 432002.3687 121851.5516 220648.9811 172372.347 206764.5593 180698.509 316948.5165 381122.0908 531757.6099 277062.5242 407927.4215 202736.8743 317924.015 261301.477 328710.8475 424491.5941 229598.2627 225640.0101 178203.932 228259.7495 242454.4304 209176.7701 201512.5434 222356.2532 29262.2667 26680.0985 28853.30125 26338.51751 26133.251 Tetrahydrocortisone2 34793.18625 748982.7113 424036.6281 437824.9738 813686.7825 643653.2028 660280.9176 888572.4779 748438.4328 776529.9567 745895.3564 500915.6521 510018.4895 120560.0501 959180.9338 740757.5598 1006215.879 869594.6408 816236.3923 875036.7746 422510.4164 771792.9684 1111495.288 927117.57 1183724.251 372858.1628 435646.5519 571424.4802 753415.7455 1340954.958 848451.3047 1090669.071 920795.5626 586385.0443 980021.5123 647448.8586 747412.3886 913243.6729 1110928.202 707106.3704 914911.2975 732137.3087 622132.3041 1043287.75 944460.9189 898317.4008 797173.243 798801.873 459750.0821 479464.8881 620684.7539 1816930.717 1232949.91 842582.8748 892966.5033 1091978.187 1182461.3 145839.0974 1084930.261 1245533.879 1224348.869 784665.6882 888951.4537 527995.1128 749309.7761 578191.1755 456302.4066 630035.884 652397.8206 788357.0601 1030928.73 444153.3786 478329.4764 1019362.828 1003961.266 267055.9328 639124.8726 694980.9818 925048.2689 1018964.751 650318.1359 585306.2795 772413.3249 581845.6075 827522.2282 698159.9808 912477.4303 249122.2196 781180.4235 562019.7283 849175.4402 828539.6477 579754.1026 433041.2555 474823.2181 36397.23734 33813.54332 438893.2254 428145.2532 1336509.595 557974.2255 1155773.656 664070.2054 588373.1152 1058877.892 739989.0585 911342.8487 986575.909 1039426.881 754553.1913 1192514.715 886323.5226 926401.3504 376127.7535 931081.6061 486165.2231 503740.9331 902045.8425 742293.2236 735687.241 765224.6358 904938.5289 1296795.004 562281.259 602087.8284 792141.1067 814996.8556 603510.5415 851247.6806 671383.2785 978128.9909 1075178.216 458754.3549 495921.329 787695.5787 1664418.769 885821.6535 768476.2779 691827.4161 907930.3761 631157.4163 652904.8271 788561.3451 727833.0066 490080.0159 1032544.895 348584.444 911148.3706 904464.3056 459525.4718 379855.7766 765900.7961 588028.6294 874254.452 470133.3019 779693.1277 640165.8276 853793.0855 785329.2373 470226.9163 853671.5236 838287.135 817123.7676 636277.1047 916599.0707 929638.1959 603938.2203 824048.4756 458081.7256 612466.0185 763024.3187 31623.66732 39806.9281 30763.95808 32886.26739 32208.45298 Theobromine 1535229.509 31731494.09 26610643.61 39549024.86 15222579.98 54426198.62 11269691.72 120971680 27376162.69 47190073.07 26902740.68 35602452.23 108391681.2 1260225.239 52855849.43 61921011.4 64327214.01 104743698.1 33312199.36 84191902.07 1683024.381 78408405.7 51952296.81 11080987.05 55900203.05 27686960.55 44692919.78 2732072.858 17174822.94 14506581.57 10764811.37 24066866.07 59680840.13 62684494.57 38117743.58 108474688.6 31206049.34 78477474.71 206317492.2 57699183.6 8664790.095 45562834.93 82758618.72 16292532.52 40084305.45 343474.2815 1203052.317 91800314.34 32742376.1 47438520.43 40317842.72 18779456.68 13327467.29 73785161.95 8760098.588 30077438.45 3836816.374 77746628.64 48498420.02 16608531.35 70002515.84 7983702.275 81717314.31 3172066.994 42313200.06 24715196.47 24953774.31 36689984.14 35734170.75 61775665.61 80060289.14 29230313.76 56539772.01 22363365.17 20668082.44 31476321.44 14481416.08 41149718.92 18638006.06 90522140.35 86935962.4 2408790.889 168883504.6 72306943 62767188.48 8895063.794 62634297.79 31514493.32 200653597.8 93479376.69 73284819.72 187746807.7 880563.5358 30533338.92 48039922.45 11158602.4 291769.787 27678667.26 45215100.4 47738590.15 1030021.714 442804.1437 41220204.76 70425929.44 14824038.5 3819008.192 163039941.5 67505997 5128386.966 115273839.7 14911853.3 50629727.86 8119799.429 7573129.299 39710807.34 36050121.52 50336153.65 43936022.65 25188368.86 43414563.99 38069059.66 102742360.4 155042602.9 19579336.21 110725801.2 31088143.74 52519281.65 16241167.4 50090633.4 10389028.83 80769003.87 11049957.49 31067031.81 47940383.14 23999024.87 243449.8393 28900327.07 53684215.06 114860607.2 29794897.69 28060490.52 18727647.5 34035379.97 22175418.68 5752446.222 13025201.35 201375.9778 169362101.7 44052818.38 33271137.4 44315406.31 11553089.2 148453320 43255941.78 157295627.1 70765988.21 103070651.1 35928524.66 94646083.62 655478.2138 125342003.5 80001727.31 34382070.93 45508790.4 41031923.47 37131032.17 10736310.81 14556168.69 36922534.32 54393728.09 39927782.98 412811.9696 1290018.461 192570.398 227928.0266 41431.1704 Tiglylcarnitine 29995.92187 2188436.366 2334916.009 2253873.613 4555789.016 1033188.645 1322151.319 6740035.235 1437703.413 2027444.055 2944317.131 2465127.288 3036564.091 3083182.022 1555340.514 3183018.428 3448183.907 8054490.739 1971461.145 1178825.409 3448628.016 3322476.802 5952657.579 2955148.835 4457963.594 2024628.873 2294857.566 1102313.744 1709558.933 5383722.146 7226098.258 4354183.659 3191380.128 1979776.586 3951553.691 1201599.78 710459.8929 3859545.468 3029897.809 2940227.311 3675413.934 1064026.404 1075150.541 8359658.736 2133382.855 7883172.035 2094775.649 1642641.972 2424018.819 2810200.204 1897590.298 2815824.563 2106138.384 2873378.612 1612289.262 5770997.287 11429336.02 8703097.627 2447877.17 3470345.674 5117855.821 3241209.92 2872099.552 1373140.244 3129408.939 1454272.838 2118507.079 3382441.841 4027513.219 3472312.007 2365232.79 2025597.831 2475911.188 5329645.84 3050874.92 792816.1351 2962109.319 2424100.978 2914518.796 1167983.028 1209123.911 1419602.467 2533568.164 886504.9882 5781579.467 1083795.833 3062946.446 1447087.393 1332563.582 832619.6224 863937.2648 1800487.508 740805.1841 2066045.183 2445343.354 32001.29066 34273.12631 1681675.157 2494375.32 2017267.886 1660718.625 3324671.939 2866981.365 2552138.04 1313359.578 1823563.863 1219942.426 2216873.721 1810202.318 2929106.149 6782844.64 3124528.798 843643.1784 1509180.712 3050304.696 1285598.694 2767762.525 3335636.733 2337568.981 928533.1012 4840635.924 2287024.406 2506821.692 1458220.413 771581.7222 5108609.335 1470161.143 2311622.852 2690436.871 2905714.733 2381714.965 1899148.586 2169136.393 2327108.296 3106722.68 4355455.328 1232552.479 696238.1511 1651210.782 2178824.871 1822716.223 3536753.931 5302352.965 1757848.242 4007514.086 1721695.674 11186412.27 8035442.555 5429233.775 2348081.786 2420217.572 2884893.306 3825407.808 1970388.609 3384045.649 1762321.972 1484056.826 13354183.19 4902848.651 2298025.259 1396111.449 4700563.536 2046245.662 3608587.058 943958.8677 2436077.056 2485207.583 1731911.275 2151182.141 2586625.306 2552908.398 28629.28632 33319.8879 32609.35023 31914.30438 29730.20957 trans-3-Indoleacrylic acid 56872.36602 17841887.75 15193074.24 14587794.68 4424772.027 20730264.32 11730076.45 19695860.69 6233966.391 7951408.885 29511183.06 2037424.847 3093634.61 4388966.191 49831762.87 12810801.9 7239063.487 17144401.5 20340108.36 6610425.805 2874071.915 75969899.76 23727352.54 8719782.821 52445717.35 15772806.67 18620971.89 1708741.062 3902249.71 30835021.62 26641066.67 22012729.95 25483579.44 5466976.214 5761977.626 39559640.81 10584536.76 4311419.332 21741799.67 5114370.943 23319209.8 39931195.24 45945817.29 32556971.03 6461294.895 8602831.472 38204679.43 15630311.29 17154507.08 19016241.47 8194558.09 17955151.92 5880405.497 40059413.37 10711553.61 15493934.19 10037361.06 7075135.879 112775982.5 16366727.51 20205432.42 36151379.88 13851511.47 6609736.607 3393566.743 2599972.028 6175812.62 22152228.22 9290809.359 40806958.71 4269394.245 15349555.13 19187675.24 26379494.68 26595885.03 26981155.93 8249212.471 47710260.25 4857630.342 9890604.169 42300900.02 8812759.596 17129665.14 11632165.89 18320816.6 12870621.57 23259444.29 8421334.661 36889565 9636273.998 18316109.73 21663654.21 4150374.66 14163209.4 16506418.96 53614.59487 57505.60643 14998251.24 16377559.63 21873068.16 4764344.77 12237424.11 4179861.202 6553923.378 34699622.52 8426351.068 43827166.59 77658247.52 36011308.46 13017416.18 13249717.68 21169994.92 5882141.468 6709931.601 15397408.84 16392542.48 17407692.96 6077477.06 85281250.15 9854193.613 24220007.5 10227917.96 13154129.44 8681217.568 8190190.39 21551569.69 4356963.474 3961404.796 120154871.8 28496110.64 7668930.95 6855909.895 16223127.2 17205532.41 100387647.8 4204380.357 9317650.016 76912031.1 8757251.005 14407901.06 5553266.048 8958014.499 82730423.03 12751049.5 22915043.53 24521205.9 24308448.22 10829552.26 12416681.93 17230793.12 15199060.08 3750494.421 6753705.875 9240371.93 42624524.3 29019990.16 4394912.529 14139184.88 30837504.7 11557197.49 4446564.412 23483901.26 7370864.708 19715304.59 57303574.64 18031086.75 5102368.907 6603438.791 18663326.43 19183268.68 18687131.05 48490.3987 49495.95423 58232.442 51845.16993 53707.99261 Trans-Non-2-en-(4.6.8)-triyn-1-ol 30767.90223 6806750.577 6531228.576 5693125.769 8175165.191 6057320.031 3614002.963 7090550.76 6978914.739 3206838.739 9434011.828 4190606.016 9209415.582 12385061.17 6907038.882 7336616.734 6610836.73 10600459.39 3498929.646 7671935.15 6415216.838 6688789.328 7739625.431 7542854.311 6545674.063 8777735.398 8626061.473 6901674.766 6866051.544 7258519.001 14229313.06 6905487.404 8853941.74 9219555.867 10820012.77 10167922.24 5790870.374 6135231.704 9874442.342 6147354.198 9270891.368 5788943.682 6774821.423 9527862.557 7652223.967 11952669.31 8922091.362 7169091.518 11124480.05 10158746.86 10520211.08 6468439.652 8002833.418 9784222.435 7675247.369 10126376.65 9977312.681 8708248.452 9618170.256 12398332.3 10888337.07 11048383.41 14657544.47 6996891.088 9853604.637 6761737.745 9076143.288 12077636.89 10670059.26 8809410.798 8870851.938 8437672.123 13039169.33 12765566.96 7722397.36 9030210.548 11565713.35 10213219.52 9701215.58 8933625.143 6032837.663 9817484.294 10110958.2 13909605.08 11647724.43 6521809.224 9268521.724 8578968.379 9101306.708 9437089.656 6697280.69 11664092.59 6550185.924 10387382.27 9717356.542 24148.08921 25913.0339 8470797.445 7293970.868 7500193.691 6749664.931 3627673.623 6061394.479 7241722.299 8426209.956 8492898.505 5047645.222 6020490.599 5385940.275 8544073.06 9191262.043 9033302.234 6796822.101 5283367.501 8254685.689 9151563.047 7868954.444 6236350.459 8801076.184 7169756.866 6992752.635 10771071.04 10019874.59 5619339.883 10766077.1 6735541.401 6851563.76 6841375.941 8466096.912 7951185.892 9988775.478 8717707.509 8531729.966 9554253.743 9913180.546 10681159.3 11084859.18 7435763.342 8380302.251 10237903.27 8326127.76 8962118.887 9295173.381 7616521.063 12399511.25 8961164.397 7553057.449 9465056.925 9161266.146 10084416.72 9421554.55 10725227.37 13046679.34 9701803.351 11274100.55 7899672.877 10064088.2 11537355.41 11413409.34 8419393.696 8703770.325 9947288.469 9276985.36 11028180.16 10367374.02 9674387.074 8546481.61 10294135.93 11661083.5 11971541.6 9984606.149 22984.68042 22277.30255 22450.35431 25912.91213 22816.18356 Tributyl citrate acetate 630621.1688 530806.208 404598.6555 409223.6176 555033.2142 530461.0494 550857.438 512301.0005 440743.021 1948275.847 453384.8497 597118.4735 1386348.435 448884.9324 387220.2143 499147.7852 407279.0647 486145.6351 355095.0319 367137.4541 352917.8139 506482.0682 381629.0671 390302.0058 327210.9825 138077.1531 218785.3569 431759.2759 355015.4479 430132.6518 397424.9529 386061.3032 534770.8047 476500.4054 390543.913 220594.4944 1961638.124 20429662.85 402826.8504 4848144.339 358174.4467 399180.3662 405857.7148 408950.2423 326665.4683 401711.4646 372688.4323 1586784.735 211215.1124 190354.7039 375772.0493 329576.9587 382828.3488 322022.9666 341564.0297 252246.8217 295205.6386 18007034.66 286201.3645 337108.371 228701.7542 410368.3871 306946.0584 327467.6593 219423.4657 1264293.476 249855.7786 270029.5806 344184.7208 1304625.639 953157.4622 1297979.545 295879.102 706545.9949 823367.9179 714893.193 767116.034 731534.5886 747057.7006 782209.3395 715299.1303 800073.0262 777495.7698 11677544.38 1458883.401 928399.3317 957767.9259 5061047.347 832630.6038 769006.8713 788894.6396 781978.5593 848092.836 542267.4761 1011929.67 47156.01968 48797.67708 643542.3049 450813.8296 790686.2202 753916.0661 17175099.92 868394.4421 856788.807 768921.8667 814727.0939 699240.4582 855093.5722 1060220.677 936990.1821 899616.1173 938450.1174 1007339.218 1062354.832 905773.4007 741283.4249 588092.466 2977826.323 950117.785 1073377.659 997521.2913 57862771.64 972836.0632 963596.0983 900738.4906 1015929.56 1029420.875 1006626.824 848153.309 1017922.847 945050.6733 1096071.27 903898.6726 816012.0014 956540.7172 1010429.745 1129940.766 1076711.65 1198899.913 1095287.105 1126656.753 909640.7819 1282503.63 1091436.674 1241109.149 1041841.354 1064103.905 1035757.444 2322262.312 721040.5398 773714.8411 1007247.905 961065.8564 1024883.364 1011704.299 1185918.697 1215638.252 15095504.29 917640.9697 818347.0104 884811.107 814757.6212 980990.8366 1005287.464 871525.2867 1922341.712 1106787.965 1063616.877 576265.6711 603712.626 858503.6302 209090.1419 500435.8982 513139.2363 274381.9757 53037.52378 Triethylene glycol 681532.9743 254678.7211 210573.8374 274309.1495 2450783.15 2103465.758 3501515.856 2751391.717 1828112.777 2715411.562 1923887.602 2479458.094 2940602.798 3573307.064 3243510.787 3127903.193 2539121.551 161474.9362 2116067.308 3262262.253 2566412.723 961028.7662 4409583.541 2313695.329 2860107.359 302130.4726 198911.0881 2216126.629 1881976.253 1846379.431 1669016.698 4764602.651 3002189.379 2475441.96 1801815.081 2117099.767 2648105.591 2688166.29 4076081.693 3802881.066 3036931.636 2878678.334 2198362.032 3134857.095 2106810.972 1942821.971 2487519.415 2328881.102 730889.2714 199172.5079 3195938.392 1471466.53 1970278.094 667941.9911 3001378.647 3203954.473 2799532.53 2034150.831 1862154.758 1829523.301 2516058.08 1551829.907 1933106.08 2739875.338 1669079.752 1871762.729 2064587.077 1554035.298 1391805.373 2546777.381 1517754.253 484421.6777 404717.9183 2467594.205 77181.14015 1573242.954 2242994.171 500742.0032 1657876.689 2301710.629 2228906.432 1830797.806 2634509.244 1391250.323 2004790.949 1844414.502 1695775.262 2503912.092 1767053.184 1558951.266 3914241.17 2334090.784 1440693.377 338626.5776 395735.2084 990976.2782 686470.9943 372749.2747 179645.4258 2193058.448 656525.5637 217374.3566 2259781.387 1807515.923 1968709.897 1973140.955 2405345.759 1860620.413 335510.9616 2439995.406 2071445.372 511735.7098 3307330.876 335712.2525 535311.9328 307711.3198 192558.3365 2222110.875 96906.01218 2822922.84 133969.4561 3232144.085 268935.8226 1916005.752 1600944.525 191719.5048 468094.5472 3526188.013 3307621.33 115833.0663 2116053.5 2031901.02 704462.8053 198179.5368 546168.2931 1520247.193 223598.6883 3553696.78 3558570.955 250083.3212 251905.0016 1209022.617 221378.6162 1959671.422 2134803.527 2254278.747 1478751.505 2035410.365 5718762.617 590209.7754 274243.8703 3438477.918 1370131.897 1937400.664 1765484.202 250225.6478 1165153.336 193944.6336 297297.0217 3444999.327 1924388.549 3026605.847 2526328.667 1962464.43 2021995.988 2675996.072 380982.878 1234931.892 511461.7064 426142.4203 211632.4232 408718.6759 465674.2863 441666.2471 439116.6464 470015.4766 Triphenylphosphine oxide 155547.0792 617344.1789 736042.3013 561146.7628 260288.1374 419688.4259 147536.85 172617.4331 816807.1577 194309.1758 139896.3679 1431099.015 7130127.44 270191.1102 185077.8211 454469.9483 1352701.79 801702.7245 488261.3198 1497434.744 1885515.902 594407.0048 296219.0277 2322342.166 216471.1531 1027592.274 741863.0259 221859.1903 1088361.512 455755.9359 700963.8549 349590.7564 3580383.382 282014.8612 1682257.821 362162.2007 228232.9293 404283.0594 1553100.285 378306.5815 2436611.285 3900092.237 5033877.709 3092461.971 499376.8968 340445.1212 685561.9047 231535.4896 905907.3989 801962.2757 336424.1865 658344.4376 191821.3545 14162378.04 760976.6157 380628.1504 652750.1602 787363.8283 2270482.741 521654.496 930954.1841 95845.41873 386005.636 234458.3525 675404.7956 1190001.104 459954.4707 639013.3105 749765.8734 712063.4228 680127.7373 1159276.32 942313.6786 2355899.523 5469188.691 260684.4197 657857.5004 646513.7611 1143732.759 422759.3316 484856.904 1179519.463 591025.6831 615970.5763 813105.4246 262672.1012 624935.2787 680842.0735 217942.052 166254.41 196097.5125 775988.7407 318861.9461 951811.5173 906201.1226 71605.84537 84772.25108 1173684.23 696457.8537 595978.454 288936.5554 293407.7001 1259303.772 27642710.62 187021.5382 282246.9717 654300.9781 2795925.189 3327361.806 346110.9601 418945.9966 199885.5279 300299.9924 85115356.46 89825.35131 1070075.043 740561.4311 475816.3564 155891.196 267223.8873 292483.0162 1737262.332 1847846.741 195310.07 895242.3561 230918.7879 350827.6675 64437.64075 90941.81271 319620.6685 500417.7827 433770.8756 1018818.917 869108.3014 426545.8665 152128.9314 1330357.726 318656.4003 794993.174 423353.1716 2383539.752 173179.8896 628026.9759 2668745.872 1095896.083 151819.9631 590325.4029 2184416.957 616129.2852 1153036.148 880314.2082 218708.3699 367717.933 646648.7338 22195170.93 148398.2347 240730.0005 529002.8615 645061.4413 2609151.466 1664740.448 1374355.709 305953.506 618993.1851 708581.1871 315125.8518 108175.3084 205275.1548 1200920.983 901057.5686 979712.1371 91529.96525 102944.4546 178330.4877 138575.7566 170132.7219 Tris(2-butoxyethyl) phosphate 7404452.894 7617144.505 7821581.419 7813815.889 7408637.482 8478605.621 60477147.35 7308866.495 7281180.823 7541100.731 7484489.835 7507193.143 7719064.002 7690052.583 7328443.875 7261296.885 6303323.678 7283360.536 7400259.831 7093302.793 7672378.812 7235580.122 7509537.778 7696563.469 7032490.167 8029249.001 7833179.544 6893679.651 7078616.926 6974796.31 6727578.102 7219679.488 8441518.305 6658107.401 6631006.934 7161492.304 6952684.139 6851112.045 6682968.583 7211402.18 6748383.895 7099553.437 6789690.963 7033479.386 6983915.099 7626304.504 6861727.297 6710595.749 8133027.625 7192327.322 7665021.78 6821827.182 6552780.05 6668534.117 6319705.209 5696060.25 6344139.393 6762050.971 6608641.23 6575766.3 6790734.651 6737626.571 6522794.42 6643680.963 6427677.186 6591040.955 6509229.248 6511835.198 5676751.704 9473268.475 6091528.018 6181922.875 6885272.286 14159009.22 6275942.856 6416946.896 6251465.163 6501634.956 6417990.905 6297779.415 6631260.083 6946911.134 9362213.545 6302894.048 7542982.986 6670513.487 6408567.534 8082846.566 6282052.078 6800219.23 6535651.414 6956768.684 6453960.584 7141998.711 7346975.585 55869.94736 45888.28913 8723725.18 8234002.937 7223146.872 7732822.96 7526375.72 7753978.188 8744807.217 7102445.179 7274815.911 8311221.581 7837273.653 7922136.49 7477978.618 7551480.647 8128032.053 7949702.355 7922420.732 8354197.766 8612319.487 8487293.352 7714726.879 7882401.698 8105227.996 7600728.172 7360240.35 8115356.785 8160790.301 8551953.792 8755512.449 7782622.764 7879762.7 7804747.716 9436129.898 8589387.599 8546201.357 9192590.259 9540468.9 8507009.522 8444655.922 8736894.723 8490675.893 8726913.628 8790717.967 8895428.782 9085221.706 9356752.58 98569719.28 9032459.073 9284841.601 8583724.868 8740881.558 8633096.369 9071277.205 9603998.1 8134499.893 8197969.364 8556116.853 8939012.739 8956558.339 8893051.349 8876883.831 8567501.957 8438272.224 7960116.741 8481205.716 8816119.833 8898561.933 8002810.012 8450904.79 10119594.74 7237628.47 8535660.406 8489525.575 8598809.451 63491.71056 57412.37585 59217.40453 129563.206 67934.68076 UNII:W45XXM0XWE 1462389.546 1174631.756 1571713.322 2145031.703 1988562.114 1458638.325 3345177.592 1033435.668 1488163.7 1842575.155 1948599.306 1513264.509 1174986.242 1470269.649 913994.2769 847221.3092 1063652.398 1165105.951 1283981.15 1062534.801 1296413.842 1314596.621 1126147.425 1179633.31 959636.8732 1711394.636 1324431.205 868833.5253 748993.2049 928052.9029 1153442.584 1213462.558 1312244.32 714045.7789 832574.2042 672709.5895 1186228.628 780716.0284 1147350.647 1008522.718 1210906.321 1147206.135 640413.6969 966287.6141 1347254.657 713182.9232 843369.6123 1264333.737 1697613.537 1361276.149 721640.961 1726619.682 903943.1094 606035.6128 749156.9033 958620.39 3627556.642 890915.4419 1759316.392 1063712.156 859784.1506 1019628.133 833822.8207 1020135.957 1708993.162 2292429.669 813097.0204 1886580.278 763337.2916 1191831.75 741770.0951 1843399.625 1467143.216 11261552.3 715822.4275 876875.2574 8125134.889 1190404.117 664543.7975 969689.9181 1350283.389 1596563.714 2171760.441 4807068.598 673559.8316 767426.7292 831132.1717 1304003.903 843262.1392 636608.7002 1275396.794 1283685.464 596468.5927 1364175.718 1658214.264 998536.7355 906905.9912 1556838.477 1644377.835 567127.2838 604419.1224 818746.8526 630207.6338 864679.7465 618040.2951 613868.4574 961349.3158 681645.6031 685815.9518 696114.8815 665957.0451 579441.6428 666168.7817 1102582.047 853714.8364 1666020.42 1427837.453 886036.6287 6158577.596 2176311.925 746596.5438 771894.6841 481097.37 1328730.922 2332977.76 1106680.911 704002.1958 1036625.726 632845.3046 729233.0398 3362414.239 1302264.812 1933439.369 1719465.071 708949.4343 1276975.124 723757.4873 995055.1582 1065738.56 726676.0369 772825.5324 1116635.303 751105.7621 4697195.137 799593.9514 1187397.312 109323813.2 3391452.064 948613.6995 1771185.752 1534738.733 721655.9812 820788.9888 945640.8385 905896.2847 579089.6358 880935.0089 905527.9394 1398543.427 670808.295 5538006.496 1113706.872 987406.7392 877373.8954 625780.4926 1232929.232 832966.5769 623046.9623 1808860.641 1536313.516 1099321.526 885734.0199 1085412.248 971690.5077 1073535.882 1092218.131 Uric acid 45566.8202 101471686.2 87805585.97 86080309.15 95009096.73 113725933.9 128463888.6 92827441.32 79396339.14 118330337.9 117829251.6 146429262.3 104451874.4 134726285.2 97813663.08 137652383.4 149521119.3 163205921.3 169117206.3 131414042.8 67699897.94 120268829.6 81507515.32 177088540.5 74580274.5 81635961.87 82613959.81 87583365.99 100057943.9 174872888.9 129640655.5 129079287.1 115665105.1 131500560.5 131844159.3 169253419.2 114187236.1 163652232.2 123621099.8 124740049.8 107350513.7 140585753 136745555.2 134451251.5 120618022.1 142536208.9 108654259.3 114695783.8 77200860.68 87213846.51 100801995.7 162189377.6 102834246 89444641.86 102349318.4 146974920 154718491.3 101445359.2 53965582.61 130224157 107056955.4 145523805.1 98540961.31 116873399.1 99216482.13 116530315.6 112424376.9 134554848.7 90405532.01 115308490.7 110094186.5 81358651.55 79550980.96 77955616.15 85163126.05 120929610.4 146016461.3 99613563.59 127431993.5 93377649.18 75136720.75 63841659.16 131410407.5 117755381.4 48767689.25 81994412.67 100557963.5 138748259 73087291.14 143923604.9 238037919.8 101645825.4 77755136.3 75819735.96 85377922.55 464268.4287 56737.07892 76908317.25 83202912.7 98148979.86 77083250.63 134782930.8 115256940.9 81424270.12 104799453.9 158103869.6 90883553.62 88660179.56 105014198.9 144767964.5 98379152.28 96089634.08 105830846.9 94925093.66 83984765.63 72409696.88 84332095.33 66104672.08 80960862.13 85214461.21 106975645 132281546.7 108212724 120337458.4 111020382.7 89671190.89 78803419.21 106209338.7 110179010.2 115698794 119526649.5 112345584.9 78914559.16 83671848.27 109293966.3 94586493.58 99398047.45 125744099.4 98411476.71 85810786.28 64947671.86 110712559.2 95814245.48 111700019.8 119054530.5 100349708.4 180267445.9 134453273.6 184289676.2 85121248.87 87768306.12 126549176.1 132414002.1 70803324.32 105665294 93717345.99 127817048.7 139393027.1 126110692.2 94934895.15 102880695.6 128972021.3 105979408.7 113677707.7 126113149 116911619.1 64819018.82 123142278.7 78960894.97 81471469.5 96414816.22 262709.0019 131795.7996 513657.6725 87396.6122 251254.0414 Waol B 48595.06337 789490.4321 118121.5805 185265.1587 1431109.162 786071.6239 859102.098 1190603.191 301425.4551 800288.5426 648188.9057 962884.9416 906994.2443 890097.8024 560445.876 846062.0597 667489.0567 1153569.645 405503.5342 757250.1942 1533862.591 569233.7585 832720.613 1113054.645 573242.5603 74533.00497 147800.3673 510050.6127 613342.0166 857303.5488 1229288.647 846104.6742 406098.5136 507630.8834 524851.1405 1134895.277 262081.8096 633512.0637 534164.1019 525527.3789 741392.3497 997846.1968 411534.2063 695720.8676 656247.9629 1238283.829 475832.6258 480782.8882 84662.65403 179823.9006 588617.209 345870.2094 764594.4293 538740.8128 226979.9853 1620380.753 942787.1392 1380490.36 848928.3539 1839693.754 581132.0309 810707.3568 1375543.119 714150.3951 488765.4954 595568.6351 637885.0753 1170329.466 782919.7484 458758.879 659933.0689 67578.60911 128727.7605 1999806.713 431764.1932 355970.5869 557473.2225 831442.4534 1141937.555 1001139.206 384794.1347 521298.4531 1049780.76 499134.1257 732100.518 580598.5564 459012.1499 649533.8593 824110.7437 412323.2616 902840.9075 893527.6964 237279.5878 91656.26085 174043.1823 43867.87976 49568.29847 68079.57089 75302.05824 1403602.731 831642.4039 1002102.065 1364043.076 283196.8517 914355.5095 865646.1381 968622.1408 814878.3958 866607.7994 529603.4374 1242768.884 634865.047 269601.4473 318094.7807 613436.2135 77384.8227 148426.6887 787775.8272 820004.4963 431433.9848 1792950.205 498378.6474 935026.849 481858.6418 700702.1319 933236.9866 408921.922 943743.756 707929.0055 1012901.572 1232765.874 569169.8138 77371.17882 113736.2355 591747.1063 885212.4792 782821.31 346484.9726 899357.6881 1172170.522 523594.5187 725215.3963 623978.4399 577912.9578 597741.7375 528505.0619 717329.202 615635.0151 891882.97 133036.1705 123282.2196 691059.646 1016352.844 980145.6088 501261.0127 812576.4555 593450.2345 1251946.738 2348552.946 765290.2456 916734.9654 1086776.212 697295.4643 1317519.987 723088.3312 660882.1286 562664.2776 401551.6056 83273.61118 102567.2987 749200.0485 48739.46306 40208.95246 34502.17042 41386.11241 39693.44071 Wortmanamide A1 36593.74 6566756 8240353 9638636 9285961 11744916 9156300 23678486 6719232 9982291 6384997 18709129 13673344 11507883 30799243 6484665 6230958 13033634 9497490 19812480 18879326 9840812 13019530 16153784 18847998 6963253 7700557 33623665 19930893 16848869 5914974 9141655 8968370 10175675 15243546 20215435 10766587 9335418 31547389 17796030 14258580 13008807 24878701 18419372 6527511 10848048 13089011 5206871 9121358 8335699 12984718 4440950 6093823 15063499 13027459 14248841 14309088 9768565 12525296 7506470 18867950 35229168 23764073 13748059 6365414 17257677 10456761 9679501 16312537 8268794 29128192 7449834 8218663 19617688 8360208 8123058 19983052 3688347 7069040 11287796 10567471 12712247 6062203 2175697 5580257 8808621 12297775 2458854 17905443 6753811 17592509 7415354 6017790 6534599 7793216 33059.74 33944.43 7030580 7625407 4526730 3564926 32123883 16009403 7571609 4162215 18467432 9021935 10133813 20602603 16647791 10688418 12744686 10290718 14746967 3772346 9114405 9664608 7717529 12292080 19865103 13280707 15155866 16479995 18568561 5422679 9426076 16466623 41414363 9055489 11217826 21594557 26236802 10125520 8864447 16516976 4704342 6268555 7283479 24669324 14149085 17275165 15262972 19848275 11674206 4933461 4902395 4647475 17033244 18665173 9041054 7921705 10315976 11171574 15550519 11616764 8122506 6267097 13809493 4403820 44501079 21034114 14188752 19411395 24782723 5057276 12572041 17481436 8338573 8891665 9556685 7166294 32547.77 35662.26 34990.25 28957.2 28749.78 Wortmanamide A2 45676.82976 1999820.653 1568553.916 1259838.268 3090015.113 3156732.28 1864145.061 5647592.742 1807203.617 2426621.027 1793228.42 4271135.543 3236345.516 2614757.62 7059615.151 1975193.425 4043972.165 6387980.589 2573190.852 3492794.703 3064891.778 2541662.635 3310981.604 4083481.022 4611812.058 1087549.074 1518584.84 4267967.608 4302473.267 3242799.069 1996026.145 2543307.613 3190113.108 1596295.637 2591636.761 2217168.27 2556301.363 2682625.867 6627981.369 4583674.036 3038454.243 4101470.992 2986400.327 5240597.229 1570333.448 2749719.519 3915542.667 1963388.892 1263590.125 1571337.209 2905521.277 1722845.327 1521517.073 2834370.31 4126384.262 4080154.813 4268701.158 2635037.64 3273746.358 1719539.604 4604102.981 6905500.7 3811646.244 2189191.75 1540030.784 3974011.036 2440837.146 2397442.994 3310880.03 2237452.807 7148966.29 1248814.2 1376576.447 4019211.366 2692847.755 1531968.39 3481320.905 1371965.736 1996187.956 3510155.033 1272614.705 2534118.117 1371390.046 415336.2033 1636735.28 2574850.308 4122936.763 2467836.293 3478871.949 1644245.469 4008313.015 1982210.538 1965404.053 1203903.977 1556688.483 34107.76576 38847.25116 1164321.265 1303413.156 1551203.013 3218991.099 13186651.3 5608385.769 2729993.278 997300.7617 3194822.011 1864029.952 2422553.334 5538636.827 3384027.592 2963313.358 4984059.105 1878991.859 4330921.463 1565044.924 1554241.565 1725730.053 2401820.981 3735425.966 4938538.655 3718282.427 4331956.728 2917686.692 2616583.027 1752130.385 2611820.531 2574158.062 4589100.867 2285744.562 1908546.767 4489365.829 4072848.725 1520678.405 1668044.34 5330272.986 1466615.759 1203812.854 1736891.918 3382822.012 3971147.264 3517972.122 3083324.407 2661482.251 3328954.554 1350210.422 1682379.472 1379618.332 4573475.746 3722005.383 1724989.11 1097080.964 2909302.358 3634452.457 2981354.137 2650273.545 2119350.021 1427379.811 5735572.244 1822678.377 5894908.972 4130260.022 5456220.794 3258645.214 2965917.427 1370800.453 3484732.098 5345217.955 2682072.784 1493997.156 1508087.319 2059935.837 46352.54656 38212.15967 41337.78221 47487.14861 48706.26084 α-Pyrrolidinopropiophenone 1366373.528 1159284.334 2116444.39 2182039.749 1863651.158 2217240.247 1729455.444 2990387.454 2096085.641 2467014.654 2041019.567 2384920.192 2383476.988 2269948.932 3902525.465 2998384.342 2347930.36 1435753.8 2110044.413 3602016.386 1853142.945 2581711.307 5377917.167 2207138.241 1668796.131 2269577.941 2294910.413 2971638.305 2331804.415 1842653.501 3439798.549 1378461.748 2053801.199 1800737.67 3812587.055 2035501.905 1990978.71 2628683.429 1614568.077 2103483.582 1873054.544 2129249.889 2372424.755 2175329.283 1739964.161 2069665.699 2877773.2 1747468.532 2129660.156 2340338.59 2039957.37 1294126.168 2040138.856 2102159.154 2002378.724 2101104.493 1552219.84 2159974.611 1878857.957 2123839.365 2126785.311 1883604.386 2675835.593 2219843.467 2599926.207 2330822.735 1775669.61 2439719.343 2107607.655 2883415.332 1799209.608 2096092.502 1824790.409 2274128.187 1371711.438 1656547.924 3838981.229 7324865.394 1633970.926 5383124.719 2076060.975 3023870.096 1770565.103 1637992.853 1624686.834 1312290.058 1690398.816 2255377.38 1716782.409 2907436.344 2334691.29 2461248.805 1606248.962 1740851.241 1905186.311 43294.10118 39549.64371 2038572.275 2079473.531 1167116.782 1302344.286 13117252.96 2092183.96 1505712.573 1360332.067 1978414.682 1941142.881 2457565.624 8984001.729 2440983.61 2995155.803 13639245.45 2083098.823 1996844.568 1422665.767 2041830.795 2359176.017 3172173.475 9234532.968 1556923.778 19096658.53 6990357.894 1517346.547 2805544.201 1688859.671 14269847.56 8594649.659 2289449.565 2294501.367 5708266.556 2492461.787 1976329.468 1955909.375 2256533.402 15586317.74 9090622.174 12080487.16 4248635.563 1696363.22 7834787.279 3262314.752 13148566.6 11816672.6 1656370.182 3400631.127 2047694.155 2177137.686 2094688.855 1881316.975 1933348.541 1480784.616 1602741.927 2068303.794 1972041.966 2478548.193 8194053.594 2355214.546 14791244.69 12956364.72 1994742.038 1102657.628 1487416.766 2733864.962 2471499.159 1861919.612 2127193.6 7941131.89 2120866.721 1809563.452 1948129.893 907233.4989 54287.12291 50272.93178 28255.00264 38297.62688 28882.88059 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name RefMet InChiKey_14 Formula Mass Neutral mass mz RT_sec Adduct MSI_level MS1_AM_std MS1_AM_db MS1_RT_std MS2_std MS2_db_exp MS2_db_theo (−)-phenylethyl-8-O-α-L-rhamnopyranoside - - C14 H20 O5 268.13078 269.13804 267.24 [M+H]+1 2b 0 1 0 0 0 1 (1S,2R,8aS)-1,2-Dihydroxyindolizidine - SQECYPINZNWUTE C8 H15 N O2 157.11011 158.11738 41.88 [M+H]+1 2b 0 1 0 0 0 1 (25S)-5beta-Spirostan-3beta-ol - GMBQZIIUCVWOCD C27 H44 O3 416.32843 417.33571 235.62 [M+H]+1 4 0 1 0 0 0 1 (2S)-2-Amino-8-hydroxyoctanoic acid - BXWIRZWJUWLKSW C8 H17 N O3 175.12067 176.12792 21.12 [M+H]+1 2b 0 1 0 0 0 1 (3Z)-Phytochromobilin - LXWZWRRIEITWMN C33 H36 N4 O6 584.26283 585.27011 271.62 [M+H]+1 2b 0 1 0 0 0 1 (4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate1 CAR 8:1(2) YMIVWYONPRZBEJ C15 H27 N O4 285.1936 286.20088 197.58 [M+H]+1 2b 0 1 0 0 0 1 (4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate2 CAR 8:1(2) YMIVWYONPRZBEJ C15 H27 N O4 285.19363 286.2009 204.96 [M+H]+1 2b 0 1 0 0 0 1 (R)-Norcoclaurine - WZRCQWQRFZITDX C16 H17 N O3 271.12051 272.12779 255.78 [M+H]+1 2b 0 1 0 0 0 1 (S)-Abscisicacid Abscisic acid JLIDBLDQVAYHNE C15 H20 O4 264.1359 265.14317 238.5 [M+H]+1 4 0 1 0 0 0 1 (S)-Carnitine Carnitine PHIQHXFUZVPYII C7 H15 N O3 161.10496 162.11224 17.88 [M+H]+1 1 1 0 1 1 0 0 (Z)-hexadec-9-enenitrile - OWIIMTXNVHAYFW C16 H29 N 235.22973 236.23701 249.42 [M+H]+1 2b 0 1 0 0 0 1 (Z)-octadec-11-enenitrile - SJCDLORCWMRVDC C18 H33 N 263.26104 264.26832 270.6 [M+H]+1 2b 0 1 0 0 0 1 [Similar to: Taurochenodeoxycholic acid; ΔMass: -52.9942 Da] Dimethyl terephthalate WOZVHXUHUFLZGK C21 H43 N4 O4 P 446.3026 447.30988 270.3 [M+H]+1 2b 0 1 0 0 0 1 1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine - LSOWKZULVQWMLY C30 H50 N O7 P 567.33164 568.33892 288.6 [M+H]+1 2b 0 1 0 0 0 1 1-(tert-Butylamino)-3-((5,6,7,8-tetrahydro-cis-6,7-dihydroxy-1-naphthyl)oxy)-2-propanol - VWPOSFSPZNDTMJ C17 H27 N O4 309.19355 310.20083 205.8 [M+H]+1 2b 0 1 0 0 0 1 1-[(11Z,14Z)]-icosadienoyl-sn-glycero-3-phosphocholine - YYQVCMMXPIJVHY C28 H54 N O7 P 547.36321 548.37048 316.14 [M+H]+1 2b 0 1 0 0 0 1 1-[(8Z,11Z,14Z)-icosatrienoyl]-sn-glycero-3-phosphocholine - BBNHCUBQEQJHIG C28 H52 N O7 P 545.34738 546.35464 299.1 [M+H]+1 2b 0 1 0 0 0 1 1-arachidonoyl-sn-glycero-3-phosphocholine LPC 20:4/0:0 LAXQYRRMGGEGOH C28 H50 N O7 P 543.33161 544.33888 289.68 [M+H]+1 2b 0 1 0 0 0 1 1-Hexadecyllysophosphatidylcholine - VLBPIWYTPAXCFJ C24 H52 N O6 P 481.35257 482.35984 310.62 [M+H]+1 2b 0 1 0 0 0 1 1-Linoleoylglycerophosphocholine1 - SPJFYYJXNPEZDW C26 H50 N O7 P 519.33162 520.33888 289.74 [M+H]+1 2b 0 1 0 0 0 1 1-Linoleoylglycerophosphocholine2 - SPJFYYJXNPEZDW C26 H50 N O7 P 519.33177 520.33904 286.14 [M+H]+1 2b 0 1 0 0 0 1 1-Oleoylglycerophosphocholine - YAMUFBLWGFFICM C26 H52 N O7 P 521.34727 522.35453 308.04 [M+H]+1 2b 0 1 0 0 0 1 1-palmitoylglycerol;MAG(16:0) - QHZLMUACJMDIAE C19 H38 O4 330.27662 331.28386 366.18 [M+H]+1 2b 0 1 0 0 0 1 10-oxo-nonadecanoic acid1 - PEBIXVCZWGYSTN C19 H36 O3 312.26593 313.27321 297.3 [M+H]+1 2b 0 1 0 0 0 1 10-oxo-nonadecanoic acid2 - PEBIXVCZWGYSTN C19 H36 O3 312.26593 313.27321 292.5 [M+H]+1 2b 0 1 0 0 0 1 1alpha,23-dihydroxy-24,25,26,27-tetranorvitamin D3 / 1alpha,23-dihydroxy-24,25,26,27-tetranorcholecalciferol - - C23 H36 O3 360.26585 361.27313 287.64 [M+H]+1 2b 0 1 0 0 0 1 2-(1H-indol-3-yl)acetic acid Indoleacetic acid SEOVTRFCIGRIMH C10 H9 N O2 175.06318 176.07046 207.84 [M+H]+1 2a 0 1 0 0 1 0 2-(5-((3Z,13Z)-eicosa-3,13-dien-1-yl)furan-2-yl)-ethanoic acid - WRGYPEJIHKRYHB C26 H42 O3 402.31283 403.32012 229.08 [M+H]+1 2b 0 1 0 0 0 1 2-Aminooctadec-4-yne-1,3-diol - YJXGFSAKPYAXAY C18 H35 N O2 297.26637 298.27364 244.5 [M+H]+1 2a 0 1 0 0 1 0 2-dehydro-3-deoxy-D-arabinonic acid1 - UQIGQRSJIKIPKZ C5 H8 O5 148.0374 297.0821 342.42 [2M+H]+1 2b 0 1 0 0 0 1 2-dehydro-3-deoxy-D-arabinonic acid2 - UQIGQRSJIKIPKZ C5 H8 O5 148.0374 297.0821 318.06 [2M+H]+1 2b 0 1 0 0 0 1 2-methylacetate-3,5,6-trimethylpyrazine - ANFZDGQJMXVAEI C10 H14 N2 O2 194.10529 195.11256 34.92 [M+H]+1 2b 0 1 0 0 0 1 2-Oxindole Indolin-2-one JYGFTBXVXVMTGB C8 H7 N O 133.05266 134.05994 118.74 [M+H]+1 2b 0 1 0 0 0 1 2,4,6-Trideoxy-2,4-bis[(Z)-(1-hydroxyethylidene)amino]-beta-L-gulopyranose - NRXWTRNYICXMBF C10 H18 N2 O5 246.12125 247.12853 26.58 [M+H]+1 2b 0 1 0 0 0 1 2,5-Diaminopentanoic acid - AHLPHDHHMVZTML C5 H12 N2 O2 132.08975 133.09702 16.26 [M+H]+1 2b 0 1 0 0 0 1 235BBF3K97 - FWNRILWHNGFAIN C20 H28 268.2188 269.22608 361.5 [M+H]+1 2b 0 1 0 0 0 1 2R-aminoheptanoic acid1 2R-Aminoheptanoic acid RDFMDVXONNIGBC C7 H15 N O2 145.11013 146.11741 34.32 [M+H]+1 2b 0 1 0 0 0 1 2R-aminoheptanoic acid2 2R-Aminoheptanoic acid RDFMDVXONNIGBC C7 H15 N O2 145.11014 146.11742 20.4 [M+H]+1 2b 0 1 0 0 0 1 3-(2,4-Cyclopentadien-1-ylidene)-5alpha-androstan-17beta-ol - OYOVFIJVSKWVLT C24 H34 O 338.26049 339.26776 256.56 [M+H]+1 2b 0 1 0 0 0 1 3-(3,4,5-trimethoxyphenyl)propanoic acid - ZCYXGVJUZBKJAI C12 H16 O5 240.0995 241.10673 241.74 [M+H]+1 2a 0 1 0 0 1 0 3-hydroxy-2-N-iso-butyryl-anthranilamide - QLFWPFJWFDNGQP C11 H14 N2 O3 222.10017 223.10745 34.98 [M+H]+1 2b 0 1 0 0 0 1 3-hydroxy-N-(1-hydroxy-3-methylpentan-2-yl)-5-oxohexanamide1 - FCGLCOKPOTZYII C12 H23 N O4 245.16244 246.16971 48.84 [M+H]+1 3 0 1 1 0 0 1 3-hydroxy-N-(1-hydroxy-3-methylpentan-2-yl)-5-oxohexanamide2 - FCGLCOKPOTZYII C12 H23 N O4 245.16244 246.16972 44.76 [M+H]+1 3 0 1 1 0 0 1 3-hydroxyoctanoylcarnitine1 CAR 8:0;OH LUBMSOHGUAAXAM C15 H29 N O5 303.20407 304.21135 154.38 [M+H]+1 2b 0 1 0 0 0 1 3-hydroxyoctanoylcarnitine2 CAR 8:0;OH LUBMSOHGUAAXAM C15 H29 N O5 303.20408 304.21136 173.64 [M+H]+1 2b 0 1 0 0 0 1 3-Methylsulfolene - FAYFWMOSHFCQPG C5 H8 O2 S 132.02435 133.0316 22.32 [M+H]+1 2b 0 1 0 0 0 1 3-Ureidoisobutyrate Ureidoisobutyric acid PHENTZNALBMCQD C5 H10 N2 O3 146.06898 147.07626 20.28 [M+H]+1 2b 0 1 0 0 0 1 3-Vinylaniline - IFSSSYDVRQSDSG C8 H9 N 119.07334 120.08061 28.08 [M+H]+1 2b 0 1 0 0 0 1 35-aminobacteriohopane-32,33,34-triol - DYJIJIUSBPCLMI C35 H63 N O3 545.4803 546.48757 318.72 [M+H]+1 2b 0 1 0 0 0 1 4-Acetoxy-2-azetidinone - OEYMQQDJCUHKQS C5 H7 N O3 129.04251 130.04979 74.16 [M+H]+1 2b 0 1 0 0 0 1 4-Amino-3-hydroxybenzoic acid - NFPYJDZQOKCYIE C7 H7 N O3 153.04238 154.04966 25.44 [M+H]+1 2a 0 1 0 0 1 0 4-Hydroxybenzaldehyde 4-Hydroxybenzaldehyde RGHHSNMVTDWUBI C7 H6 O2 122.03663 123.04391 22.56 [M+H]+1 2a 0 1 0 0 1 0 4-Indolecarbaldehyde - JFDDFGLNZWNJTK C9 H7 N O 145.05261 146.05989 38.46 [M+H]+1 2a 0 1 0 0 1 0 4,4'-dimethoxy[1,1'-biphenyl]-2-carbonitrile - YTFJXLBVBXNSDD C15 H13 N O2 239.09428 240.10156 28.26 [M+H]+1 2a 0 1 0 0 1 0 5-Hydroxyconiferyl alcohol - NPNAJGCZQBQWQZ C10 H12 O4 196.07332 197.0806 221.88 [M+H]+1 4 0 1 0 0 0 1 5-Hydroxyindole-3-acetic acid 5-Hydroxyindoleacetic acid DUUGKQCEGZLZNO C10 H9 N O3 191.05799 192.06522 29.34 [M+H]+1 2a 0 1 0 0 1 0 5-Nitro-o-toluidine - DSBIJCMXAIKKKI C7 H8 N2 O2 152.05838 153.06566 25.56 [M+H]+1 2a 0 1 0 0 1 0 6-Methylquinoline 6-Methylquinoline LUYISICIYVKBTA C10 H9 N 143.07337 144.08065 38.46 [M+H]+1 2a 0 1 0 0 1 0 9-Decenoylcarnitine1 CAR 10:1(9) GOOOCIIXFLVRAG C17 H31 N O4 313.22478 314.23206 216 [M+H]+1 2b 0 1 0 0 0 1 9-Decenoylcarnitine2 CAR 10:1(9) GOOOCIIXFLVRAG C17 H31 N O4 313.22478 314.23206 221.34 [M+H]+1 2b 0 1 0 0 0 1 9-Decenoylcarnitine3 CAR 10:1(9) GOOOCIIXFLVRAG C17 H31 N O4 313.2248 314.23208 224.1 [M+H]+1 2b 0 1 0 0 0 1 Abietinol - GQRUHVMVWNKUFW C20 H32 O 288.2449 289.25216 239.7 [M+H]+1 2b 0 1 0 0 0 1 Acetyl-L-carnitine CAR 2:0 RDHQFKQIGNGIED C9 H17 N O4 203.11555 204.12282 21.12 [M+H]+1 1 1 0 1 1 0 0 Acetyl-β-methylcholine - - C8 H17 N O2 159.12578 160.13306 20.64 [M+H]+1 2a 0 1 0 0 1 0 Acetylcadaverine N-Acetylcadaverine RMOIHHAKNOFHOE C7 H16 N2 O 144.12611 145.1334 32.4 [M+H]+1 2b 0 1 0 0 0 1 Asperophiobolin D - VQIAIGUFXCMWQU C26 H39 N O3 413.29237 414.29965 256.56 [M+H]+1 2b 0 1 0 0 0 1 Asperorydine L - LWMYYCFEWUUXAH C20 H21 N3 O3 351.15776 352.16503 180.3 [M+H]+1 2b 0 1 0 0 0 1 Azanthromicin A - C17 H17 N O3 283.12051 284.12778 282.84 [M+H]+1 2b 0 1 0 0 0 1 Bacillamidin A - DGUKAPCPLGCHBI C17 H31 N O5 329.21973 330.22694 214.2 [M+H]+1 2b 0 1 0 0 0 1 Bilirubin1 Bilirubin BPYKTIZUTYGOLE C33 H36 N4 O6 584.26264 585.26991 283.14 [M+H]+1 2a 0 1 0 0 1 0 Bilirubin2 Bilirubin BPYKTIZUTYGOLE C33 H36 N4 O6 584.26279 585.27007 225.96 [M+H]+1 2a 0 1 0 0 1 0 Bilirubin3 Bilirubin BPYKTIZUTYGOLE C33 H36 N4 O6 584.26289 585.27017 198.78 [M+H]+1 2a 0 1 0 0 1 0 Butyryl-L-carnitine CAR 4:0 QWYFHHGCZUCMBN C11 H21 N O4 231.14681 232.15409 30.18 [M+H]+1 2b 0 1 1 0 1 0 C16 Sphingosine-1-phosphate C16 Sphingosine 1-phosphate IQHNJQKWEMCXAD C16 H34 N O5 P 351.21692 352.2242 249.42 [M+H]+1 2b 0 1 0 0 0 1 Caffeine Caffeine RYYVLZVUVIJVGH C8 H10 N4 O2 194.08017 195.08745 55.44 [M+H]+1 1 1 0 1 1 0 0 Caryophyllose - COAMNWKAJPDNHU C12 H24 O8 296.14661 297.15395 40.38 [M+H]+1 2b 0 1 0 0 0 1 Chenodeoxyglycocholate Glycochenodeoxycholic acid GHCZAUBVMUEKKP C26 H43 N O5 449.31349 450.32074 237.06 [M+H]+1 2b 0 1 0 0 0 1 Cholinephosphate Choline phosphate YHHSONZFOIEMCP C5 H14 N O4 P 183.06573 184.07301 296.04 [M+H]+1 2b 0 1 0 0 0 1 CJ-16,169_1 - BJRAMQBZNGBNLY C19 H21 N O3 311.15169 312.15897 287.7 [M+H]+1 2b 0 1 0 0 0 1 CJ-16,169_2 - BJRAMQBZNGBNLY C19 H21 N O3 311.15179 312.15907 291.84 [M+H]+1 2b 0 1 0 0 0 1 Cladosin L - OTEIGXWPIHHYHP C13 H22 N2 O4 270.15762 271.16491 199.86 [M+H]+1 2b 0 1 0 0 0 1 Commendamide - MZUHHHSFDVDBCZ C18 H35 N O4 329.25609 330.26337 232.14 [M+H]+1 2b 0 1 0 0 0 1 Cortexolone 11-Deoxycortisol WHBHBVVOGNECLV C21 H30 O4 346.21388 347.22116 240.48 [M+H]+1 3 0 1 1 0 0 1 Cortisol Cortisol JYGXADMDTFJGBT C21 H30 O5 362.20875 363.21603 221.34 [M+H]+1 1 1 0 1 1 0 0 Cortisone Cortisone MFYSYFVPBJMHGN C21 H28 O5 360.19308 361.20035 223.38 [M+H]+1 1 1 0 1 1 0 0 Creatine Creatine CVSVTCORWBXHQV C4 H9 N3 O2 131.06937 132.07664 20.22 [M+H]+1 1 1 0 1 1 0 0 Creatinine Creatinine DDRJAANPRJIHGJ C4 H7 N3 O 113.05885 114.06613 20.16 [M+H]+1 1 1 0 1 1 0 0 Cyclo-(L-Phe-L-Val) OQQPOHUVAQPSHJ C14 H18 N2 O2 246.1365 247.14378 53.04 [M+H]+1 2b 0 1 0 0 0 1 Cytosine Cytosine OPTASPLRGRRNAP C4 H5 N3 O 111.0434 286.1029 26.76 [2M+ACN+Na]+1 1 1 0 1 1 0 0 D-Erythro-sphingosine 1-phosphate Sphingosine 1-phosphate DUYSYHSSBDVJSM C18 H38 N O5 P 379.24821 380.25548 270.66 [M+H]+1 2a 0 1 0 0 1 0 D-Sphingosine Sphingosine WWUZIQQURGPMPG C18 H37 N O2 299.28204 300.2893 253.98 [M+H]+1 2a 0 1 0 0 1 0 dacisteine - HSPYGHDTVQJUDE C7 H11 N O4 S 205.04064 206.04796 183.36 [M+H]+1 2b 0 1 0 0 0 1 Dambonitol - MMCIFJWGSIWJLP C8 H16 O6 208.09441 231.08366 29.22 [M+Na]+1 2b 0 1 0 0 0 1 Decanoylcarnitine CAR 10:0 LZOSYCMHQXPBFU C17 H33 N O4 315.24045 316.24772 228 [M+H]+1 1 1 0 1 1 0 0 Decorticasine - DONSVQBFPXNWRA C10 H16 N2 O2 196.12093 197.1282 51.72 [M+H]+1 2b 0 1 0 0 0 1 DEET N,N-Diethyl-m-toluamide MMOXZBCLCQITDF C12 H17 N O 191.13074 192.13802 248.94 [M+H]+1 2a 0 1 0 0 1 0 Dioctyl phthalate Dioctyl phthalate MQIUGAXCHLFZKX C24 H38 O4 390.27627 391.28352 429.9 [M+H]+1 2a 0 1 0 0 1 0 Diosgenin Diosgenin WQLVFSAGQJTQCK C27 H42 O3 414.31277 415.32004 274.2 [M+H]+1 2b 0 1 0 0 0 1 Diphenyl Sulfoxide - JJHHIJFTHRNPIK C12 H10 O S 202.04506 203.05233 20.22 [M+H]+1 2b 0 1 0 0 0 1 DL-Carnitine Carnitine PHIQHXFUZVPYII C7 H15 N O3 161.10499 162.11223 20.28 [M+H]+1 1 1 0 1 1 0 0 DL-Tryptophan Tryptophan QIVBCDIJIAJPQS C11 H12 N2 O2 204.08952 205.09681 38.46 [M+H]+1 1 1 0 1 1 0 0 DL-α-Aminocaprylic acid - - C8 H17 N O2 159.12574 160.13301 69.42 [M+H]+1 2a 0 1 0 0 1 0 Docosahexaenoic acid ethyl ester - TYLNXKAVUJJPMU C24 H36 O2 356.27094 357.27821 232.2 [M+H]+1 2a 0 1 0 0 1 0 Dodecenoylcarnitine1 CAR 12:1 VFYGOZNDDVMNNT C19 H35 N O4 341.25612 342.26339 238.14 [M+H]+1 1 1 0 1 1 0 0 Dodecenoylcarnitine2 CAR 12:1 VFYGOZNDDVMNNT C19 H35 N O4 341.25612 342.2634 235.14 [M+H]+1 1 1 0 1 1 0 0 ethylbenzoate Ethyl benzoate MTZQAGJQAFMTAQ C9 H10 O2 150.06795 151.07522 238.5 [M+H]+1 2b 0 1 0 0 0 1 F1839-B - XWOBYGVFHSMINH C24 H33 N O6 431.23024 432.23751 262.2 [M+H]+1 2b 0 1 0 0 0 1 gamma-Glutamylleucine gamma-Glutamylleucine MYFMARDICOWMQP C11 H20 N2 O5 260.1369 261.14418 40.02 [M+H]+1 2b 0 1 0 0 0 1 Geumsanol C - ZMOXNUGOJSHBRR C19 H28 O6 352.18809 353.19525 221.52 [M+H]+1 4 0 1 0 0 0 1 glutaramic acid - GTFMAONWNTUZEW C5 H9 N O3 131.05831 132.06563 26.16 [M+H]+1 2b 0 1 0 0 0 1 Glycochenodeoxycholic acid1 Glycochenodeoxycholic acid GHCZAUBVMUEKKP C26 H43 N O5 449.31353 450.32076 256.56 [M+H]+1 2b 0 1 0 0 0 1 Glycochenodeoxycholic acid2 Glycochenodeoxycholic acid GHCZAUBVMUEKKP C26 H43 N O5 449.31355 450.32079 260.7 [M+H]+1 2b 0 1 0 0 0 1 Glycocholic Acid Glycocholic acid RFDAIACWWDREDC C26 H43 N O6 465.30851 466.31581 235.02 [M+H]+1 1 1 0 1 1 0 0 Hexadecanamide Palmitamide HSEMFIZWXHQJAE C16 H33 N O 255.25589 256.26316 411.36 [M+H]+1 2a 0 1 0 0 1 0 Hexanoylcarnitine CAR 6:0 VVPRQWTYSNDTEA C13 H25 N O4 259.17811 260.18539 137.52 [M+H]+1 1 1 0 1 1 0 0 Hippuric acid Hippuric acid QIAFMBKCNZACKA C9 H9 N O3 179.058 180.06528 79.08 [M+H]+1 1 1 0 1 1 0 0 Hypoxanthine Hypoxanthine FDGQSTZJBFJUBT C5 H4 N4 O 136.03839 137.04568 22.38 [M+H]+1 1 1 0 1 1 0 0 I-Urobilin - KDCCOOGTVSRCHX C33 H42 N4 O6 590.30996 591.31724 205.32 [M+H]+1 2b 0 1 0 0 0 1 Indole Indole SIKJAQJRHWYJAI C8 H7 N 117.05768 118.06499 38.46 [M+H]+1 2b 0 1 0 0 0 1 Indole-3-lactic acid Indole-3-lactic acid XGILAAMKEQUXLS C11 H11 N O3 205.07368 206.08096 187.56 [M+H]+1 1 1 0 1 1 0 0 Ipronidazole - NTAFJUSDNOSFFY C7 H11 N3 O2 169.0849 170.09218 16.8 [M+H]+1 2b 0 1 0 0 0 1 Isoquinoline Isoquinoline AWJUIBRHMBBTKR C9 H7 N 129.05777 130.06505 225.48 [M+H]+1 2a 0 1 0 0 1 0 L-(+)-Arginine Arginine ODKSFYDXXFIFQN C6 H14 N4 O2 174.11146 175.11874 17.58 [M+H]+1 1 1 0 1 1 0 0 L-Histidine Histidine HNDVDQJCIGZPNO C6 H9 N3 O2 155.0693 156.07659 16.38 [M+H]+1 1 1 0 1 1 0 0 L-Isoleucine Isoleucine AGPKZVBTJJNPAG C6 H13 N O2 131.09441 132.10169 24.24 [M+H]+1 1 1 0 1 1 0 0 L-Lysine Lysine KDXKERNSBIXSRK C6 H14 N2 O2 146.10539 147.11266 16.14 [M+H]+1 2a 0 1 0 0 1 0 L-Octanoylcarnitine CAR 8:0 CXTATJFJDMJMIY C15 H29 N O4 287.20923 288.21651 210.6 [M+H]+1 2b 0 1 0 0 0 1 L-Phenylalanine Phenylalanine COLNVLDHVKWLRT C9 H11 N O2 165.07869 166.08597 28.14 [M+H]+1 1 1 0 1 1 0 0 L-Pyroglutamic acid Pyroglutamic acid ODHCTXKNWHHXJC C5 H7 N O3 129.04254 130.04983 23.16 [M+H]+1 1 1 0 1 1 0 0 L(+)-Citrulline Citrulline RHGKLRLOHDJJDR C6 H13 N3 O3 175.09546 176.10274 20.46 [M+H]+1 1 1 0 1 1 0 0 Leptazoline B - DQWZJXAZNNVHLN C16 H21 Cl N2 O7 388.104 389.11125 318 [M+H]+1 2b 0 1 0 0 0 1 Leucylproline Leu-Pro VTJUNIYRYIAIHF C11 H20 N2 O3 228.14714 229.15442 22.44 [M+H]+1 2a 0 1 0 0 1 0 Linoleyl carnitine CAR 18:2 MJLXQSQYKZWZCB C25 H45 N O4 423.33418 424.34146 267.96 [M+H]+1 2b 0 1 0 0 0 1 LMFA08020332_1 - JOZKALVPSJDERT C16 H31 N O4 301.22488 302.23215 219.96 [M+H]+1 2b 0 1 0 0 0 1 LMFA08020332_2 - JOZKALVPSJDERT C16 H31 N O4 301.22488 302.23216 214.86 [M+H]+1 2b 0 1 0 0 0 1 LMFA08020333 - - C20 H37 N O4 355.27171 356.279 241.98 [M+H]+1 2b 0 1 0 0 0 1 LMFA08020334 - - C18 H33 N O4 327.24043 328.24772 227.28 [M+H]+1 2b 0 1 0 0 0 1 LMST04010233_1 3-Oxochol-4-en-24-oic acid WCFIGQHNBJXROP C24 H36 O3 372.26583 373.27317 232.14 [M+H]+1 2b 0 1 0 0 0 1 LMST04010233_2 3-Oxochol-4-en-24-oic acid WCFIGQHNBJXROP C24 H36 O3 372.26585 373.27312 254.16 [M+H]+1 2b 0 1 0 0 0 1 LysoPC(18:3(9Z,12Z,15Z)) LPC 18:3(9Z,12Z,15Z)* WKQNRCYKYCKESD C26 H48 N O7 P 517.31619 518.32347 276.9 [M+H]+1 2b 0 1 0 0 0 1 LysoPC(20:5(5Z,8Z,11Z,14Z,17Z)) LPC 20:5(5Z,8Z,11Z,14Z,17Z)* PDIGSOAOQOXRDU C28 H48 N O7 P 541.31614 542.32342 277.14 [M+H]+1 2b 0 1 0 0 0 1 LysoPC(22:4(7Z,10Z,13Z,16Z)) LPC 22:4(7Z,10Z,13Z,16Z) ZOJBSSVHFSBHMP C30 H54 N O7 P 571.36319 572.37046 310.38 [M+H]+1 2b 0 1 0 0 0 1 LysoPC(22:5(7Z,10Z,13Z,16Z,19Z)) LPC 22:5(7Z,10Z,13Z,16Z,19Z)* BIEOSECQPGGZMF C30 H52 N O7 P 569.34743 570.35471 295.26 [M+H]+1 2b 0 1 0 0 0 1 LysoPC(P-18:0) LPC P-18:0 IHNKQIMGVNPMTC C26 H54 N O6 P 507.36837 508.37565 318.6 [M+H]+1 2b 0 1 0 0 0 1 Malyngamide H - MNBBBIJBVPWYSD C26 H41 N O4 431.30302 432.31031 267 [M+H]+1 2b 0 1 0 0 0 1 Methohexital Methohexital NZXKDOXHBHYTKP C14 H18 N2 O3 262.13142 263.1387 62.16 [M+H]+1 4 0 1 0 0 0 1 Methyl indole-3-acetate Indole-3-methyl acetate KTHADMDGDNYQRX C11 H11 N O2 189.07872 190.08599 225.54 [M+H]+1 2a 0 1 0 0 1 0 N-(2-Hydroxyethyl)-9-octadecenamide - BOWVQLFMWHZBEF C20 H39 N O2 325.29763 326.30491 352.56 [M+H]+1 2b 0 1 0 0 0 1 N-(3-hydroxy-dodecanoyl)-homoserine lactone1 - RGTXFFYJJNWEPV C16 H29 N O4 299.20913 300.2165 210.36 [M+H]+1 2b 0 1 0 0 0 1 N-(3-hydroxy-dodecanoyl)-homoserine lactone2 - RGTXFFYJJNWEPV C16 H29 N O4 299.20925 300.21652 206.4 [M+H]+1 2b 0 1 0 0 0 1 N-[(1R)-2-hydroxy-1-methoxy-methyl ethyl]-(4E,7S)-7-methoxy-4-eicosenamide - GSYGVFBYRIDTHY C25 H49 N O4 427.36561 428.37289 290.34 [M+H]+1 2b 0 1 0 0 0 1 N-{3-[(4-Acetamidobutyl)amino]propyl} acetamide - BKCVMAZDKFQPHB C11 H23 N3 O2 229.1788 230.18608 31.5 [M+H]+1 2b 0 1 0 0 0 1 N-Arachidonoyl-L-serine N-Arachidonoyl L-serine FQUVPTVNRMUOPO C23 H37 N O4 391.27164 392.27891 242.46 [M+H]+1 2a 0 1 0 0 1 0 N-Benzylformamide N-benzylformamide IIBOGKHTXBPGEI C8 H9 N O 135.06837 136.07559 22.56 [M+H]+1 2a 0 1 0 0 1 0 N-docosahexaenoyl GABA N-Docosahexaenoyl GABA HZMSBMNSIHSLPJ C26 H39 N O3 413.29242 414.29969 260.76 [M+H]+1 2b 0 1 0 0 0 1 N-linoleoyl dopamine - SZYHQIGUKQSEJD C26 H41 N O3 415.30808 416.31536 203.28 [M+H]+1 2b 0 1 0 0 0 1 N-oleoyl threonine N-Oleoyl threonine NEMXEZCVUJCXDQ C22 H41 N O4 383.30295 384.31028 257.22 [M+H]+1 2b 0 1 0 0 0 1 N-palmitoyl glutamic acid N-Palmitoyl glutamic acid KMAOMYOPEIRFLB C21 H39 N O5 385.28221 386.28948 236.34 [M+H]+1 2b 0 1 0 0 0 1 N-palmitoyl serine1 N-Palmitoyl serine BFVRFWIQTACAPT C19 H37 N O4 343.27173 344.27901 240.06 [M+H]+1 1 1 0 1 1 0 0 N-palmitoyl serine2 N-Palmitoyl serine BFVRFWIQTACAPT C19 H37 N O4 343.27178 344.27905 243 [M+H]+1 1 1 0 1 1 0 0 N-palmitoyl threonine N-Palmitoyl threonine JOIXCEREMHWULC C20 H39 N O4 357.28732 358.2946 247.68 [M+H]+1 2b 0 1 0 0 0 1 N-Phenylacetylglutamine - JFLIEFSWGNOPJJ C13 H16 N2 O4 264.11069 265.11798 74.04 [M+H]+1 2a 0 1 0 0 1 0 N-stearoyl serine N-Stearoyl serine CLHUCXCVFSEJRR C21 H41 N O4 371.30304 372.31033 258.72 [M+H]+1 2b 0 1 0 0 0 1 N,N-Bis(2-hydroxyethyl)dodecanamide Lauroyl diethanolamide AOMUHOFOVNGZAN C16 H33 N O3 287.24567 288.25295 278.82 [M+H]+1 2b 0 1 0 0 0 1 N,N-Diisopropylethylamine (DIPEA) - JGFZNNIVVJXRND C8 H19 N 129.15166 130.15894 42.18 [M+H]+1 2a 0 1 0 0 1 0 N,N,N-Trimethyllysine N-6-Trimethyllysine MXNRLFUSFKVQSK C9 H20 N2 O2 188.15219 189.15947 17.16 [M+H]+1 1 1 0 1 1 0 0 N,N'-Diphenylguanidine - OWRCNXZUPFZXOS C13 H13 N3 211.11068 212.11796 84.12 [M+H]+1 2a 0 1 0 0 1 0 N1-[1-(2-furylcarbonyl)-4-piperidyl]benzamide1 - - C17 H18 N2 O3 298.13128 299.13856 442.8 [M+H]+1 2a 0 1 0 0 1 0 N1-[1-(2-furylcarbonyl)-4-piperidyl]benzamide2 - - C17 H18 N2 O3 298.1313 299.13858 292.5 [M+H]+1 2a 0 1 0 0 1 0 N1-[1-(2-furylcarbonyl)-4-piperidyl]benzamide3 - - C17 H18 N2 O3 298.13131 299.13859 283.14 [M+H]+1 2a 0 1 0 0 1 0 N1-acetyl-N7-4″-methyl-3″-pentenoyl cadaverine - DYULICJOTXQZMF C13 H24 N2 O2 240.18349 241.19077 232.44 [M+H]+1 2b 0 1 0 0 0 1 Naphthalen-2-amine 2-Aminonaphthalene JBIJLHTVPXGSAM C10 H9 N 143.07337 144.08065 28.08 [M+H]+1 2b 0 1 0 0 0 1 NSC 622050 N-Myristoylglycine DYUGTPXLDJQBRB C16 H31 N O3 285.23005 286.23733 317.58 [M+H]+1 4 0 1 0 0 0 1 Oleamide Oleamide FATBGEAMYMYZAF C18 H35 N O 281.27155 282.27883 372.66 [M+H]+1 2a 0 1 0 0 1 0 PAF C-18:1 - ZBOQHUSCQCEBGK C28 H56 N O7 P 549.37887 550.38615 347.82 [M+H]+1 2b 0 1 0 0 0 1 Palmitoylcarnitine CAR 16:0 XOMRRQXKHMYMOC C23 H45 N O4 399.33431 400.34159 274.32 [M+H]+1 2a 0 1 0 0 1 0 Pantetheine Pantetheine ZNXZGRMVNNHPCA C11 H22 N2 O4 S 278.12971 279.13699 183.06 [M+H]+1 2b 0 1 0 0 0 1 Pantothenicacid (VitaminB5) Pantothenic acid GHOKWGTUZJEAQD C9 H17 N O5 219.11043 220.11771 29.58 [M+H]+1 1 1 0 1 1 0 0 Paraxanthine Paraxanthine QUNWUDVFRNGTCO C7 H8 N4 O2 180.06446 181.07173 36.96 [M+H]+1 2a 0 1 1 0 1 0 PE(0:0/18:2(9Z,12Z))1 LPE 0:0/18:2(9Z,12Z)* SVRBKLJIDJHADS C23 H44 N O7 P 477.2849 478.29218 287.28 [M+H]+1 2b 0 1 0 0 0 1 PE(0:0/18:2(9Z,12Z))2 LPE 0:0/18:2(9Z,12Z)* SVRBKLJIDJHADS C23 H44 N O7 P 477.285 478.29228 283.5 [M+H]+1 2b 0 1 0 0 0 1 PE(0:0/20:4(5Z,8Z,11Z,14Z)) LPE 0:0/20:4(5Z,8Z,11Z,14Z)* YWOCITMXHHTBAW C25 H44 N O7 P 501.28492 502.2922 284.52 [M+H]+1 2b 0 1 0 0 0 1 PE(16:0/0:0) LPE 16:0/0:0 YVYMBNSKXOXSKW C21 H44 N O7 P 453.28488 454.29215 297.3 [M+H]+1 2b 0 1 0 0 0 1 PE(17:0/0:0)1 LPE 17:0/0:0 RVNBVQKDPQVSOY C22 H46 N O7 P 467.30053 468.30781 274.02 [M+H]+1 2b 0 1 0 0 0 1 PE(17:0/0:0)2 LPE 17:0/0:0 RVNBVQKDPQVSOY C22 H46 N O7 P 467.30065 468.30793 269.94 [M+H]+1 2b 0 1 0 0 0 1 PE(18:0/0:0)1 LPE 18:0/0:0 BBYWOYAFBUOUFP C23 H48 N O7 P 481.31619 482.32345 286.62 [M+H]+1 2b 0 1 0 0 0 1 PE(18:0/0:0)2 LPE 18:0/0:0 BBYWOYAFBUOUFP C23 H48 N O7 P 481.31632 482.3236 282.36 [M+H]+1 2b 0 1 0 0 0 1 PE(18:0/0:0)3 LPE 18:0/0:0 BBYWOYAFBUOUFP C23 H48 N O7 P 481.31638 482.32366 322.5 [M+H]+1 2b 0 1 0 0 0 1 PE(18:1(9Z)/0:0) PE 18:1(9Z)/0:0* PYVRVRFVLRNJLY C23 H46 N O7 P 479.30066 480.30793 304.38 [M+H]+1 2b 0 1 0 0 0 1 PE(18:3(6Z,9Z,12Z)/0:0) PE 18:3(6Z,9Z,12Z)/0:0* QULMFYLWLOKODU C23 H42 N O7 P 475.26922 476.2765 274.8 [M+H]+1 2b 0 1 0 0 0 1 PE(19:0/0:0)1 LPE 19:0/0:0* GEWUBFCXNZWHKH C24 H50 N O7 P 495.33152 496.33877 300.6 [M+H]+1 2b 0 1 0 0 0 1 PE(19:0/0:0)2 LPE 19:0/0:0* GEWUBFCXNZWHKH C24 H50 N O7 P 495.33164 496.3389 296.04 [M+H]+1 2b 0 1 0 0 0 1 PE(19:1(9Z)/0:0) PE 19:1(9Z)/0:0* QXOXODCLNBXHKD C24 H48 N O7 P 493.31609 494.32335 281.1 [M+H]+1 2b 0 1 0 0 0 1 PE(20:0/0:0)1 LPE 20:0/0:0 HEQMDGOBDIGJOC C25 H52 N O7 P 509.34759 510.35487 317.16 [M+H]+1 2b 0 1 0 0 0 1 PE(20:0/0:0)2 LPE 20:0/0:0 HEQMDGOBDIGJOC C25 H52 N O7 P 509.34765 510.35493 312.6 [M+H]+1 2b 0 1 0 0 0 1 PE(20:1(11Z)/0:0) PE 20:1(11Z)/0:0* JEAGLCKGAKACCE C25 H50 N O7 P 507.332 508.33927 294 [M+H]+1 2b 0 1 0 0 0 1 PE(20:2(11Z,14Z)/0:0) PE 20:2(11Z,14Z)/0:0* QJHRNPQXCMXOOH C25 H48 N O7 P 505.31639 506.32367 311.58 [M+H]+1 2b 0 1 0 0 0 1 PE(20:3(8Z,11Z,14Z)/0:0) PE 20:3(8Z,11Z,14Z)/0:0* RNWSKZCVPICGIX C25 H46 N O7 P 503.30038 504.30765 296.76 [M+H]+1 2b 0 1 0 0 0 1 PE(21:0/0:0) LPE 21:0/0:0* JPTRRYQAYCFMLQ C26 H54 N O7 P 523.36296 524.37023 338.4 [M+H]+1 2b 0 1 0 0 0 1 PE(22:1(11Z)/0:0) PE 22:1(11Z)/0:0* YIRCYBYHGSZKPX C27 H54 N O7 P 535.36329 536.37057 324.24 [M+H]+1 2b 0 1 0 0 0 1 PE(22:5(7Z,10Z,13Z,16Z,19Z)/0:0) PE 22:5(7Z,10Z,13Z,16Z,19Z)/0:0* OSRWIBSZJTWIKA C27 H46 N O7 P 527.30057 528.30783 292.92 [M+H]+1 2b 0 1 0 0 0 1 PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) PE 22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0* XEVRBOQZSXWGQO C27 H44 N O7 P 525.28478 526.29206 286.74 [M+H]+1 2b 0 1 0 0 0 1 PE(O-16:0/15:0) PE O-16:0/15:0 XUXKVNJUTDUDAN C36 H74 N O7 P 663.52006 664.52733 20.34 [M+H]+1 4 0 1 0 0 0 1 PE(O-18:1(9Z)/0:0) PE O-18:1(9Z)/0:0* CDONWGCJDDHTLP C23 H48 N O6 P 465.32145 466.32873 341.52 [M+H]+1 2b 0 1 0 0 0 1 Phthalic anhydride - LGRFSURHDFAFJT C8 H4 O3 148.0159 149.0232 321.6 [M+H]+1 2b 0 1 0 0 0 1 Piperine Piperine MXXWOMGUGJBKIW C17 H19 N O3 285.136 286.14327 271.68 [M+H]+1 2a 0 1 0 0 1 0 Proline Proline ONIBWKKTOPOVIA C5 H9 N O2 115.06324 116.07051 20.28 [M+H]+1 1 1 0 1 1 0 0 Propionylcarnitine CAR 3:0 UFAHZIUFPNSHSL C10 H19 N O4 217.13114 218.13842 23.7 [M+H]+1 1 1 0 1 1 0 0 PS(O-18:0/0:0) PS O-18:0/0:0* LLZPQHOZAQNDCM C24 H50 N O8 P 511.32688 512.33415 240.72 [M+H]+1 2b 0 1 0 0 0 1 PS(O-20:0/0:0) PS O-20:0/0:0* ZEPUSHULPSPFJG C26 H54 N O8 P 539.35817 540.36545 258 [M+H]+1 2b 0 1 0 0 0 1 Quinoline Quinoline SMWDFEZZVXVKRB C9 H7 N 129.0577 130.06497 38.52 [M+H]+1 2a 0 1 0 0 1 0 Serinolamides D - FPCGSXVPELFJGR C23 H43 N O4 397.3187 398.32597 263.46 [M+H]+1 2b 0 1 0 0 0 1 Serratamic acid - NDDJIMSGSZNACM C13 H25 N O5 275.17293 276.1802 31.62 [M+H]+1 2b 0 1 0 0 0 1 Solasodine Solasodine KWVISVAMQJWJSZ C27 H43 N O2 413.32879 414.33607 214.98 [M+H]+1 2b 0 1 0 0 0 1 Spirotoamide C - - C27 H47 N O5 465.34488 466.35216 259.56 [M+H]+1 4 0 1 0 0 0 1 Spylidone - - C26 H39 N O4 429.28737 430.29467 235.02 [M+H]+1 2b 0 1 0 0 0 1 Sundiversifolide - OXNJNKIMPIRBQC C14 H22 O3 238.15663 239.16391 304.86 [M+H]+1 2b 0 1 0 0 0 1 Symmetricdimethyl arginine Symmetric dimethylarginine HVPFXCBJHIIJGS C8 H18 N4 O2 202.14274 203.15001 17.52 [M+H]+1 1 1 0 1 1 0 0 Taurine Taurine XOAAWQZATWQOTB C2 H7 N O3 S 125.01452 126.02181 21.9 [M+H]+1 1 1 0 1 1 0 0 Tetradecenoyl-L-carnitine1 - OTCWVYFQGYOYJO C21 H39 N O4 369.28737 370.29465 254.64 [M+H]+1 1 1 0 1 1 0 0 Tetradecenoyl-L-carnitine2 - OTCWVYFQGYOYJO C21 H39 N O4 369.28738 370.29466 249.9 [M+H]+1 1 1 0 1 1 0 0 Tetrahydrocortisone1 Tetrahydrocortisone SYGWGHVTLUBCEM C21 H32 O5 364.2244 365.23168 207.66 [M+H]+1 2a 0 1 0 0 1 0 Tetrahydrocortisone2 Tetrahydrocortisone SYGWGHVTLUBCEM C21 H32 O5 364.22441 365.23169 210.84 [M+H]+1 2a 0 1 0 0 1 0 Theobromine Theobromine YAPQBXQYLJRXSA C7 H8 N4 O2 180.06448 181.07176 29.88 [M+H]+1 2a 1 0 1 1 0 0 Tiglylcarnitine CAR 4:1;2Me WURBQCVBQNMUQT C12 H21 N O4 243.14676 244.15404 38.7 [M+H]+1 1 1 0 1 1 0 0 trans-3-Indoleacrylic acid - PLVPPLCLBIEYEA C11 H9 N O2 187.06308 188.07035 52.98 [M+H]+1 2a 0 1 0 0 1 0 Trans-Non-2-en-(4.6.8)-triyn-1-ol - YHYFPSUUJPWSGM C9 H6 O 130.04174 131.04902 28.2 [M+H]+1 2b 0 1 0 0 0 1 Tributyl citrate acetate - QZCLKYGREBVARF C20 H34 O8 402.22479 403.23208 335.88 [M+H]+1 4 0 1 0 0 0 1 Triethylene glycol - ZIBGPFATKBEMQZ C6 H14 O4 150.08904 151.09632 25.2 [M+H]+1 2b 0 1 0 0 0 1 Triphenylphosphine oxide - FIQMHBFVRAXMOP C18 H15 O P 278.08566 279.09294 252.9 [M+H]+1 2b 0 1 0 0 0 1 Tris(2-butoxyethyl) phosphate - WTLBZVNBAKMVDP C18 H39 O7 P 398.24284 399.25012 313.2 [M+H]+1 2a 0 1 0 0 1 0 UNII:W45XXM0XWE - ZWVMLYRJXORSEP C6 H14 O3 134.09411 135.10139 33.42 [M+H]+1 2b 0 1 0 0 0 1 Uric acid Uric acid LEHOTFFKMJEONL C5 H4 N4 O3 168.02814 169.03542 22.14 [M+H]+1 1 1 0 1 1 0 0 Waol B - DMRIUUMAZLWLQW C14 H20 O5 268.13079 269.13804 238.98 [M+H]+1 2b 0 1 0 0 0 1 Wortmanamide A1 - OFAIMODNBSGXLZ C21 H37 N O4 367.27173 368.27901 241.98 [M+H]+1 2b 0 1 0 0 0 1 Wortmanamide A2 - OFAIMODNBSGXLZ C21 H37 N O4 367.27175 368.27903 244.74 [M+H]+1 2b 0 1 0 0 0 1 α-Pyrrolidinopropiophenone - C13 H17 N O 203.1308 204.13808 306.36 [M+H]+1 2a 0 1 0 0 1 0 METABOLITES_END #END