#METABOLOMICS WORKBENCH kbushley_20251010_003455 DATATRACK_ID:6546 STUDY_ID:ST004301 ANALYSIS_ID:AN007163 PROJECT_ID:PR002717 VERSION 1 CREATED_ON October 23, 2025, 7:46 am #PROJECT PR:PROJECT_TITLE Interactions between phloem microbiota and metabolomes in three North American PR:PROJECT_TITLE ash species (Fraxinus spp.) susceptible to Emerald Ash Borer (Agrilus PR:PROJECT_TITLE planipennis) PR:PROJECT_TYPE Widely Targeted Metabolomics for Plants PR:PROJECT_SUMMARY This study aimed to profile microbial communities associated with ash phloem and PR:PROJECT_SUMMARY Emerald Ash Borer (EAB; Agrilus planipennis) larval guts and their relationship PR:PROJECT_SUMMARY to ash phloem metabolites in three native susceptible North American ash PR:PROJECT_SUMMARY species: Fraxinus pennsylvanica (green ash), F. nigra (black ash) and F. PR:PROJECT_SUMMARY americana (white ash) using metabarcoding and widely targeted metabolomics to PR:PROJECT_SUMMARY establish the first global metabolomic profile of phloem in these ash species. PR:PROJECT_SUMMARY We examined interspecies differences in microbiota and metabolite profiles and PR:PROJECT_SUMMARY interactions of ash phloem microbiota and metabolites in relation to EAB PR:PROJECT_SUMMARY infestation. Samples of uninfested phloem, with no visible EAB infestation, but PR:PROJECT_SUMMARY located adjacent to an EAB gallery (PhloemA – Pa) and infested phloem from an PR:PROJECT_SUMMARY EAB gallery (Gallery – G), each represented by two pooled phloem punch samples PR:PROJECT_SUMMARY per tree, were collected from four trees of each ash species showing high EAB PR:PROJECT_SUMMARY infestation signs to track the ‘within-tree’ metabolite variation in PR:PROJECT_SUMMARY response to EAB infestation. We found that microbiota and metabolites in green PR:PROJECT_SUMMARY ash showed a distinct response to EAB infestation compared to the other ash PR:PROJECT_SUMMARY species. We also identified specific metabolites interacting with microbial PR:PROJECT_SUMMARY communities in ash phloem and/or the EAB larval gut. Green ash also displayed a PR:PROJECT_SUMMARY distinct global metabolite profile from the other two species and had the PR:PROJECT_SUMMARY highest number of differentially regulated metabolites. However, green and white PR:PROJECT_SUMMARY ash shared a strong upregulation of terpenoid compounds, several of which were PR:PROJECT_SUMMARY among compounds significantly associated with microbial communities in green ash PR:PROJECT_SUMMARY phloem or the EAB larval gut. PR:INSTITUTE Cornell University PR:DEPARTMENT College of Agricultural and Life Sciences PR:LABORATORY Bushley Lab PR:LAST_NAME Bushley PR:FIRST_NAME Kathryn PR:ADDRESS 538 Tower Road, Ithaca, NY, 14853 PR:EMAIL keb45@cornell.edu PR:PHONE (607) 255-1276 PR:FUNDING_SOURCE NSF PR:PUBLICATIONS Environmental Microbiome (in review) PR:CONTRIBUTORS Judith Mogouong, Claire Yager, Kathryn Bushley #STUDY ST:STUDY_TITLE Metabolomic profiling of three native North American ash trees (Fraxinus spp.) ST:STUDY_TITLE and their relationship to the Emerald ash borer (Agrilus planipennis) ST:STUDY_TITLE infestation ST:STUDY_TYPE Research ST:STUDY_SUMMARY This study aimed to profile microbial communities associated with ash phloem and ST:STUDY_SUMMARY Emerald Ash Borer (EAB; Agrilus planipennis) larval guts and their relationship ST:STUDY_SUMMARY to ash phloem metabolites in three native susceptible North American ash ST:STUDY_SUMMARY species: Fraxinus pennsylvanica (green ash), F. nigra (black ash) and F. ST:STUDY_SUMMARY americana (white ash) using metabarcoding and widely targeted metabolomics to ST:STUDY_SUMMARY establish the first global metabolomic profile of phloem in these ash species. ST:STUDY_SUMMARY We examined interspecies differences in microbiota and metabolite profiles and ST:STUDY_SUMMARY interactions of ash phloem microbiota and metabolites in relation to EAB ST:STUDY_SUMMARY infestation. Samples of uninfested phloem, with no visible EAB infestation, but ST:STUDY_SUMMARY located adjacent to an EAB gallery (PhloemA – Pa) and infested phloem from an ST:STUDY_SUMMARY EAB gallery (infested phloem)(Gallery – G), each represented by two pooled ST:STUDY_SUMMARY phloem punch samples per tree, were collected from four trees of each ash ST:STUDY_SUMMARY species showing high EAB infestation signs to track the ‘within-tree’ ST:STUDY_SUMMARY metabolite variation in response to EAB infestation. We found that microbiota ST:STUDY_SUMMARY and metabolites in green ash showed a distinct response to EAB infestation ST:STUDY_SUMMARY compared to the other ash species. We also identified specific metabolites ST:STUDY_SUMMARY interacting with microbial communities in ash phloem and/or the EAB larval gut. ST:STUDY_SUMMARY Green ash also displayed a distinct global metabolite profile from the other two ST:STUDY_SUMMARY species and had the highest number of differentially regulated metabolites. ST:STUDY_SUMMARY However, green and white ash shared a strong upregulation of terpenoid ST:STUDY_SUMMARY compounds, several of which were among compounds significantly associated with ST:STUDY_SUMMARY microbial communities in green ash phloem or the EAB larval gut. ST:INSTITUTE Cornell University ST:DEPARTMENT College of Agricultural and Life Sciences ST:LABORATORY Bushley Lab ST:LAST_NAME Bushley ST:FIRST_NAME Kathryn ST:ADDRESS 538 Tower Road, Ithaca, NY, 14853 ST:EMAIL keb45@cornell.edu ST:PHONE (607) 255-1276 ST:NUM_GROUPS 6 ST:TOTAL_SUBJECTS 48 ST:STUDY_COMMENTS Pairwise comparisons (PhloemA versus Gallery) in each tree species ST:PUBLICATIONS Environmental Microbiome in review #SUBJECT SU:SUBJECT_TYPE Plant SU:SUBJECT_SPECIES Fraxinus pennsylvanica, Fraxinus nigra, Fraxinus americana SU:TAXONOMY_ID 56036, 56031, 38872 #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 - F22ST1UG1R Sample source:Plant | Species:Green | Type:Gallery RAW_FILE_NAME_N=F22ST1UG1R_N.mzML; RAW_FILE_NAME_P=F22ST1UG1R_P.mzML SUBJECT_SAMPLE_FACTORS - F22ST1UP1R Sample source:Plant | Species:Green | Type:Phloem RAW_FILE_NAME_N=F22ST1UP1R_N.mzML; RAW_FILE_NAME_P=F22ST1UP1R_P.mzML SUBJECT_SAMPLE_FACTORS - F22ST120G1R Sample source:Plant | Species:Green | Type:Gallery RAW_FILE_NAME_N=F22ST120G1R_N.mzML; RAW_FILE_NAME_P=F22ST120G1R_P.mzML SUBJECT_SAMPLE_FACTORS - F22ST120P1R Sample source:Plant | Species:Green | Type:Phloem RAW_FILE_NAME_N=F22ST120P1R_N.mzML; RAW_FILE_NAME_P=F22ST120P1R_P.mzML SUBJECT_SAMPLE_FACTORS - F22ST121G1R Sample source:Plant | Species:Green | Type:Gallery RAW_FILE_NAME_N=F22ST121G1R_N.mzML; RAW_FILE_NAME_P=F22ST121G1R_P.mzML SUBJECT_SAMPLE_FACTORS - F22ST121P1R Sample source:Plant | Species:Green | Type:Phloem RAW_FILE_NAME_N=F22ST121P1R_N.mzML; RAW_FILE_NAME_P=F22ST121P1R_P.mzML SUBJECT_SAMPLE_FACTORS - F22ST122G1R Sample source:Plant | Species:Green | Type:Gallery RAW_FILE_NAME_N=F22ST122G1R_N.mzML; RAW_FILE_NAME_P=F22ST122G1R_P.mzML SUBJECT_SAMPLE_FACTORS - F22ST122P1R Sample source:Plant | Species:Green | Type:Phloem RAW_FILE_NAME_N=F22ST122P1R_N.mzML; RAW_FILE_NAME_P=F22ST122P1R_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR040G1B Sample source:Plant | Species:Black | Type:Gallery RAW_FILE_NAME_N=F22TR040G1B_N.mzML; RAW_FILE_NAME_P=F22TR040G1B_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR040P1B Sample source:Plant | Species:Black | Type:Phloem RAW_FILE_NAME_N=F22TR040P1B_N.mzML; RAW_FILE_NAME_P=F22TR040P1B_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR041G1B Sample source:Plant | Species:Black | Type:Gallery RAW_FILE_NAME_N=F22TR041G1B_N.mzML; RAW_FILE_NAME_P=F22TR041G1B_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR041P1B Sample source:Plant | Species:Black | Type:Phloem RAW_FILE_NAME_N=F22TR041P1B_N.mzML; RAW_FILE_NAME_P=F22TR041P1B_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR044G1B Sample source:Plant | Species:Black | Type:Gallery RAW_FILE_NAME_N=F22TR044G1B_N.mzML; RAW_FILE_NAME_P=F22TR044G1B_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR044P1B Sample source:Plant | Species:Black | Type:Phloem RAW_FILE_NAME_N=F22TR044P1B_N.mzML; RAW_FILE_NAME_P=F22TR044P1B_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR053G1B Sample source:Plant | Species:Black | Type:Gallery RAW_FILE_NAME_N=F22TR053G1B_N.mzML; RAW_FILE_NAME_P=F22TR053G1B_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR053P1B Sample source:Plant | Species:Black | Type:Phloem RAW_FILE_NAME_N=F22TR053P1B_N.mzML; RAW_FILE_NAME_P=F22TR053P1B_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR130G1W Sample source:Plant | Species:White | Type:Gallery RAW_FILE_NAME_N=F22TR130G1W_N.mzML; RAW_FILE_NAME_P=F22TR130G1W_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR130P1W Sample source:Plant | Species:White | Type:Phloem RAW_FILE_NAME_N=F22TR130P1W_N.mzML; RAW_FILE_NAME_P=F22TR130P1W_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR178G1W Sample source:Plant | Species:White | Type:Gallery RAW_FILE_NAME_N=F22TR178G1W_N.mzML; RAW_FILE_NAME_P=F22TR178G1W_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR178P1W Sample source:Plant | Species:White | Type:Phloem RAW_FILE_NAME_N=F22TR178P1W_N.mzML; RAW_FILE_NAME_P=F22TR178P1W_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR180G1W Sample source:Plant | Species:White | Type:Gallery RAW_FILE_NAME_N=F22TR180G1W_N.mzML; RAW_FILE_NAME_P=F22TR180G1W_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR180P1W Sample source:Plant | Species:White | Type:Phloem RAW_FILE_NAME_N=F22TR180P1W_N.mzML; RAW_FILE_NAME_P=F22TR180P1W_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR181G1W Sample source:Plant | Species:White | Type:Gallery RAW_FILE_NAME_N=F22TR181G1W_N.mzML; RAW_FILE_NAME_P=F22TR181G1W_P.mzML SUBJECT_SAMPLE_FACTORS - F22TR181P1W Sample source:Plant | Species:White | Type:Phloem RAW_FILE_NAME_N=F22TR181P1W_N.mzML; RAW_FILE_NAME_P=F22TR181P1W_P.mzML #COLLECTION CO:COLLECTION_SUMMARY Trees from three native North American ash species, including F. pennsylvanica CO:COLLECTION_SUMMARY (green), F. nigra (black), and F. americana (white) were sampled from natural CO:COLLECTION_SUMMARY forests in state or city parks near Ithaca, NY, U.S.A. F. pennsylvanica trees CO:COLLECTION_SUMMARY from Renwick woods natural area in Stewart Park, City of Ithaca (latitude CO:COLLECTION_SUMMARY 42.46037898, longitude -76.50254798, approx. elevation: 122 meters), F. nigra CO:COLLECTION_SUMMARY from Robert H. Treman State Park (latitude 42.39894499, longitude, -76.59105099, CO:COLLECTION_SUMMARY approx. elevation: 299 meters), and F. americana trees from Robert H. Treman CO:COLLECTION_SUMMARY State park (latitude 42.40109797, longitude -76.58934301, approx. elevation 316 CO:COLLECTION_SUMMARY meters). The uninfested phloem with no visible infestation, but located adjacent CO:COLLECTION_SUMMARY to a gallery (PhloemA – Pa), infested phloem from a gallery (Gallery – G) CO:COLLECTION_SUMMARY sample (region of phloem infested with emerald ash borer) types, each CO:COLLECTION_SUMMARY represented by two pooled punch samples, were collected from trees showing high CO:COLLECTION_SUMMARY infestation signs to track the ‘within-tree’ metabolite variation in CO:COLLECTION_SUMMARY response to EAB infestation and stored at -80ºC prior to metabolite extraction. CO:SAMPLE_TYPE Plant CO:COLLECTION_LOCATION City of Ithaca, New-York, USA CO:STORAGE_CONDITIONS -80℃ #TREATMENT TR:TREATMENT_SUMMARY No treatment. This was an observation environmental study. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Immediately after being removed from the -80ºC freezer, the samples were SP:SAMPLEPREP_SUMMARY chilled in liquid nitrogen and lyophilized for approximately 72 h using a SP:SAMPLEPREP_SUMMARY freeze-dry system (Labconco, Kansas City, MO, USA). The bark was gently removed, SP:SAMPLEPREP_SUMMARY and each sample was wrapped in aluminum foil, labelled, placed in a plastic bag SP:SAMPLEPREP_SUMMARY with desiccant, and shipped to MetWare Biotechnology Inc., MA, USA for SP:SAMPLEPREP_SUMMARY metabolomics analysis. Samples were ground using a ball mill (30 Hz, 1.5 min) SP:SAMPLEPREP_SUMMARY (MM 400, Retsh). For extraction, 50 mg of the ground tissue was mixed with 1.2 SP:SAMPLEPREP_SUMMARY mL of -20ºC pre-cooled 70% methanol with internal standards. The mixture was SP:SAMPLEPREP_SUMMARY then vortexed (30 sec every 30 min for a total of six times, centrifuged (12,000 SP:SAMPLEPREP_SUMMARY rpm, 3 min, 4ºC), and the supernatant collected and filtered through a 0.22µm SP:SAMPLEPREP_SUMMARY membrane filter. Extractions were run alongside internal standards on an SP:SAMPLEPREP_SUMMARY ultra-performance liquid chromatography and tandem mass spectrometry SP:SAMPLEPREP_SUMMARY (UPLC-MS/MS) system (Applied Biosystems Qtrap 6500, https://sciex.com/ accessed SP:SAMPLEPREP_SUMMARY 03 April 2025). The UPLC-MS/MS was performed as described in Koski, et al. 16. SP:SAMPLEPREP_SUMMARY The area of each chromatographic peak represents the relative abundance of the SP:SAMPLEPREP_SUMMARY corresponding compound, and the mass spectrum peak of each metabolite in SP:SAMPLEPREP_SUMMARY different samples was corrected based on retention time and peak distribution SP:SAMPLEPREP_SUMMARY information to ensure the accuracy of qualitative and quantitative analysis. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY The data acquisition instruments consisted of Ultra Performance Liquid CH:CHROMATOGRAPHY_SUMMARY Chromatography (UPLC) (Ex-ionLC™ AD, https://sciex.com/) and tandem mass CH:CHROMATOGRAPHY_SUMMARY spectrometry (MS/MS) (Applied Biosystems QTRAP. CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME ExionLC AD CH:COLUMN_NAME Agilent ZORBAX RRHD SB-C18 (100 x 2.1mm,1.8um) CH:SOLVENT_A 100% water; 0.1% formic acid CH:SOLVENT_B 100% acetonitrile; 0.1% formic acid CH:FLOW_GRADIENT Elution gradient: 0.00 min, the proportion of B phase was 5%, within 9.00 min, CH:FLOW_GRADIENT the proportion of B phase increased linearly to 95%, and remained at 95% for 1 CH:FLOW_GRADIENT min, 10.00-11.10 min, the proportion of B phase decreased to 5%, and balanced at CH:FLOW_GRADIENT 5% upto 14 min; CH:FLOW_RATE 0.35 mL/min CH:COLUMN_TEMPERATURE 40 #ANALYSIS AN:ANALYSIS_TYPE MS AN:ANALYSIS_PROTOCOL_FILE eab-metabolomics-short-report_v2.pdf #MS MS:INSTRUMENT_NAME ABI Sciex 6500 QTrap MS:INSTRUMENT_TYPE Triple quadrupole MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS LIT and Triple Quadrupole (QQQ) scans were obtained on a triple quadrupole MS:MS_COMMENTS Linear Ion TRAP Mass Spectrometer (Q TRAP) (AB6500 Q TRAP UPLC/MS/MS system). MS:MS_COMMENTS This system is equipped with ESI Turbo ion spray interface and both positive and MS:MS_COMMENTS negative ion modes can be controlled by Analyst 1.6.3 software (AB Sciex). This MS:MS_COMMENTS condition for positive mode is denoted (_P) in mzML files. Operating parameters MS:MS_COMMENTS of ESI source were as follows: ion source, turbine spray; Source temperature MS:MS_COMMENTS 550°C; Ion spray voltage (IS) 5500 V (positive ion mode) /-4500 V (negative ion MS:MS_COMMENTS mode); The ion source gas I (GSI), gas II (GSII) and curtain gas (CUR) were set MS:MS_COMMENTS to 50, 60 and 25.0 psi respectively, and the collision-induced ionization MS:MS_COMMENTS parameter was set to high. QQQ scan used MRM mode and collision gas (nitrogen) MS:MS_COMMENTS was set to medium. DP and CE of each MRM ion pair were completed by further DP MS:MS_COMMENTS and CE optimization. A specific set of MRM ion pairs was monitored at each MS:MS_COMMENTS period based on the eluted metabolites in each period. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS relative abundance MS_METABOLITE_DATA_START Samples F22TR130P1W F22TR178P1W F22TR180P1W F22TR181P1W F22TR040P1B F22TR041P1B F22TR044P1B F22TR053P1B F22TR053G1B F22TR044G1B F22TR041G1B F22TR040G1B F22ST122G1R F22ST120G1R F22TR181G1W F22TR180G1W F22TR178G1W F22TR130G1W F22ST121G1R F22ST1UG1R F22ST122P1R F22ST121P1R F22ST120P1R F22ST1UP1R Factors Sample source:Plant | Species:White | Type:Phloem Sample source:Plant | Species:White | Type:Phloem Sample source:Plant | Species:White | Type:Phloem Sample source:Plant | Species:White | Type:Phloem Sample source:Plant | Species:Black | Type:Phloem Sample source:Plant | Species:Black | Type:Phloem Sample source:Plant | Species:Black | Type:Phloem Sample source:Plant | Species:Black | Type:Phloem Sample source:Plant | Species:Black | Type:Gallery Sample source:Plant | Species:Black | Type:Gallery Sample source:Plant | Species:Black | Type:Gallery Sample source:Plant | Species:Black | Type:Gallery Sample source:Plant | Species:Green | Type:Gallery Sample source:Plant | Species:Green | Type:Gallery Sample source:Plant | Species:White | Type:Gallery Sample source:Plant | Species:White | Type:Gallery Sample source:Plant | Species:White | Type:Gallery Sample source:Plant | Species:White | Type:Gallery Sample source:Plant | Species:Green | Type:Gallery Sample source:Plant | Species:Green | Type:Gallery Sample source:Plant | Species:Green | Type:Phloem Sample source:Plant | Species:Green | Type:Phloem Sample source:Plant | Species:Green | Type:Phloem Sample source:Plant | Species:Green | Type:Phloem N-Methyl-α-aminoisobutyric acid 1.08E+04 2.50E+05 1.44E+05 3.68E+04 6.67E+04 5.74E+05 3.64E+06 1.92E+04 3.41E+04 1.08E+06 2.02E+06 9.25E+05 1.55E+06 1.31E+06 5.03E+04 9.65E+05 1.08E+05 5.04E+05 7.70E+06 6.10E+04 9.75E+05 2.07E+05 1.14E+05 3.43E+04 Senkyunolide H 1.13E+07 7.56E+06 5.38E+06 4.21E+06 1.37E+07 2.48E+06 1.16E+07 8.39E+06 9.05E+06 1.50E+07 5.75E+06 8.85E+06 6.77E+06 2.19E+06 5.31E+06 2.44E+06 7.82E+06 9.73E+06 3.06E+06 3.05E+06 4.87E+06 2.59E+06 5.88E+06 1.77E+06 Senkyunolide I 1.18E+07 8.93E+06 5.96E+06 3.84E+06 1.57E+07 1.85E+06 1.26E+07 8.80E+06 1.15E+07 1.42E+07 7.69E+06 1.28E+07 6.54E+06 3.57E+06 5.88E+06 2.67E+06 8.92E+06 1.26E+07 2.82E+06 2.96E+06 7.50E+06 3.73E+06 7.85E+06 1.89E+06 O-Phosphocholine 5.88E+06 6.56E+06 1.86E+07 3.92E+06 1.24E+07 1.12E+07 1.12E+07 3.63E+06 9.12E+06 1.61E+07 1.10E+07 1.43E+07 9.00E+06 9.47E+06 5.54E+06 2.08E+07 4.37E+06 1.62E+07 2.35E+06 2.35E+07 6.28E+06 1.01E+06 9.40E+05 8.22E+06 Caffeoylcholine 1.61E+05 2.55E+05 3.15E+05 2.78E+05 3.79E+05 2.48E+05 2.44E+05 1.83E+05 2.55E+05 2.03E+05 2.84E+05 1.16E+05 1.88E+05 4.66E+04 2.04E+05 1.47E+05 1.48E+05 3.97E+05 1.70E+05 1.64E+05 1.71E+05 7.01E+04 1.20E+05 3.25E+05 Thiamine (Vitamin B1) 9.99E+05 8.59E+05 2.58E+05 6.24E+05 2.27E+06 1.51E+06 1.68E+05 5.16E+05 3.26E+05 2.56E+05 1.93E+06 1.96E+06 9.33E+05 9.00E+05 8.22E+05 1.39E+05 1.13E+06 2.62E+06 2.96E+06 6.07E+05 2.00E+06 2.13E+06 1.48E+06 3.62E+05 Nicotinate D-ribonucleoside 9.50E+06 8.63E+07 4.46E+07 1.05E+07 3.17E+07 7.68E+07 6.93E+07 1.38E+07 5.18E+07 1.95E+07 3.62E+07 1.57E+07 5.27E+07 8.42E+06 4.75E+07 1.39E+07 1.99E+07 3.57E+07 7.99E+07 3.29E+07 7.70E+07 6.17E+07 1.03E+08 3.73E+07 S-Adenosylmethionine 4.63E+05 6.32E+05 5.75E+05 5.42E+05 9.54E+05 2.73E+05 2.32E+05 6.03E+05 1.05E+06 2.70E+05 6.76E+05 7.28E+05 4.96E+05 1.61E+05 8.88E+05 5.99E+05 4.71E+05 1.35E+06 1.55E+05 7.42E+05 2.81E+05 2.07E+05 3.45E+05 3.20E+06 2,6-Dihydroxy-4-isopropylphenyl-1-O-β-D-glucoside 1.43E+06 2.94E+06 1.83E+06 1.90E+06 3.88E+06 2.83E+06 1.54E+06 1.89E+06 2.30E+06 1.18E+06 2.50E+06 2.96E+06 1.11E+06 1.35E+06 2.16E+06 1.74E+06 2.54E+06 1.37E+06 1.13E+06 9.07E+05 1.08E+06 2.26E+06 2.14E+06 1.01E+06 Eugenyl formate 5.41E+07 3.44E+07 7.29E+07 4.89E+07 4.15E+07 5.28E+07 4.24E+07 3.66E+07 4.38E+07 1.31E+07 5.84E+07 3.98E+07 5.52E+07 6.94E+07 4.73E+07 1.48E+08 4.64E+07 5.29E+07 3.34E+07 5.59E+07 3.46E+07 5.67E+07 4.51E+07 3.39E+07 γ-Aminobutyric acid 6.90E+06 4.20E+06 1.05E+07 4.78E+06 3.41E+06 3.47E+05 1.45E+06 1.93E+06 2.36E+06 4.60E+05 2.13E+06 1.97E+06 4.68E+06 1.02E+05 1.82E+06 1.49E+05 1.01E+06 1.08E+06 8.16E+05 2.59E+06 1.01E+07 8.57E+06 7.42E+06 5.69E+06 Choline Alfoscerate 1.91E+07 1.70E+07 2.58E+07 1.07E+07 5.94E+07 7.87E+06 2.74E+07 3.89E+07 8.85E+06 2.54E+07 1.87E+07 3.24E+07 1.60E+07 1.06E+07 8.69E+06 2.08E+07 1.54E+07 1.33E+07 3.88E+07 4.20E+07 5.50E+06 5.87E+06 1.74E+07 2.85E+06 Methyl Hydroxycinnamate 1.94E+06 4.17E+06 3.93E+06 1.19E+06 5.13E+06 6.42E+06 5.46E+06 4.95E+06 4.78E+06 5.47E+06 5.85E+06 4.45E+06 4.14E+06 4.44E+06 5.13E+06 4.04E+06 4.32E+06 4.97E+06 5.98E+06 3.64E+06 1.07E+07 5.42E+06 4.82E+06 5.48E+06 Oleamide (9-Octadecenamide) 1.33E+06 1.13E+06 1.38E+06 1.62E+06 3.62E+06 5.18E+06 3.91E+06 4.18E+06 7.79E+06 7.90E+06 6.10E+06 4.39E+06 8.77E+06 1.09E+07 7.07E+06 1.22E+07 7.40E+06 7.14E+06 5.89E+06 6.70E+06 7.37E+06 7.34E+06 7.83E+06 5.01E+06 N-Benzylmethylene isomethylamine 4.66E+06 5.09E+07 1.06E+07 2.28E+07 6.45E+06 2.79E+06 5.94E+06 1.62E+07 1.87E+07 2.86E+06 8.92E+06 9.27E+06 3.84E+07 1.35E+06 9.51E+06 4.96E+05 4.93E+07 3.31E+06 1.63E+07 5.43E+07 2.87E+07 1.77E+07 3.40E+07 3.96E+07 2-benzoyl-4-[(2r)-1-hydroxy-7-methyl-3-methylideneoct-6-en-1-yl]benzene-1,3,5-triol 6.01E+05 6.37E+05 6.42E+05 5.30E+05 7.56E+05 9.36E+05 8.12E+05 9.75E+05 1.17E+06 1.40E+06 1.13E+06 1.04E+06 9.86E+05 1.22E+06 8.64E+05 8.55E+05 9.55E+05 9.77E+05 9.84E+05 1.08E+06 9.56E+05 1.04E+06 9.78E+05 1.18E+06 3,5-Diacetyltambulin 3.29E+06 3.87E+06 3.43E+06 4.21E+06 3.85E+06 4.11E+06 2.90E+06 3.37E+06 3.45E+06 2.76E+06 2.80E+06 2.76E+06 2.32E+06 2.67E+06 2.60E+06 2.47E+06 3.23E+06 3.19E+06 1.98E+06 2.63E+06 3.31E+06 4.69E+06 3.94E+06 3.96E+06 4-Hydroxy-L-Isoleucine 8.30E+05 7.49E+05 5.56E+05 6.77E+05 6.39E+05 2.96E+05 7.27E+05 8.92E+05 1.01E+06 4.26E+05 1.28E+06 6.70E+05 1.25E+06 2.68E+05 8.43E+05 1.36E+05 5.25E+05 6.03E+05 4.17E+05 9.37E+05 9.02E+05 4.80E+05 9.17E+05 1.19E+06 1-Aminocyclopropane-1-carboxylic acid* 2.10E+06 1.62E+06 1.32E+06 1.38E+06 1.36E+06 6.77E+05 1.65E+06 2.07E+06 2.26E+06 1.00E+06 2.46E+06 1.75E+06 2.60E+06 4.61E+05 2.01E+06 2.65E+05 1.17E+06 1.52E+06 8.43E+05 2.19E+06 2.12E+06 1.15E+06 2.49E+06 2.70E+06 L-Homomethionine 1.30E+05 4.43E+05 4.81E+05 2.60E+05 2.24E+05 2.68E+05 3.00E+05 3.94E+05 2.02E+05 3.00E+05 5.26E+05 3.57E+05 4.16E+05 2.96E+05 2.73E+05 2.62E+05 2.12E+05 5.22E+05 2.89E+05 2.96E+05 2.45E+05 4.39E+05 3.43E+05 3.05E+05 L-Homoserine 2.53E+06 3.57E+06 4.69E+06 3.56E+06 3.31E+06 3.00E+06 9.87E+06 3.97E+06 6.88E+06 7.67E+06 1.50E+07 3.23E+06 8.02E+06 1.63E+06 2.88E+06 1.29E+06 2.88E+06 4.20E+06 3.11E+06 1.14E+07 5.69E+06 4.51E+06 7.83E+06 8.41E+06 LysoPC 16:0* 7.83E+05 1.20E+06 1.31E+06 7.30E+05 9.99E+05 9.81E+05 1.77E+06 1.14E+06 6.66E+05 2.04E+06 1.26E+06 1.12E+06 1.42E+06 1.48E+06 8.22E+05 6.45E+06 1.94E+06 7.53E+05 2.23E+06 1.38E+06 5.91E+05 7.65E+05 1.24E+06 1.53E+06 Phenyl salicylate 7.60E+04 6.58E+03 1.04E+04 1.99E+04 2.85E+04 8.72E+04 2.44E+04 1.42E+04 7.76E+03 2.29E+04 4.65E+05 1.22E+05 2.22E+04 3.35E+04 6.46E+04 1.26E+04 2.85E+05 3.46E+05 5.44E+04 9.82E+06 2.70E+04 7.99E+03 8.42E+03 1.10E+04 Elemicin 8.70E+06 2.90E+06 2.48E+06 2.43E+06 2.84E+06 3.48E+06 9.26E+06 3.02E+06 2.17E+07 6.00E+06 8.92E+07 4.14E+07 2.19E+06 1.93E+06 5.42E+07 5.82E+06 5.47E+07 8.39E+07 2.03E+06 1.23E+07 2.52E+06 2.10E+06 2.15E+06 2.13E+06 (6S)-2-Methyl-6-[(1R,5S)-(4-methene-5-hydroxyl-2-cyclohexen)-2-hepten-4-one 2.15E+05 2.56E+05 6.78E+04 1.26E+04 5.83E+04 5.85E+04 2.80E+05 3.80E+04 4.29E+04 1.76E+05 1.68E+06 1.51E+06 2.87E+04 8.20E+04 1.99E+05 8.10E+04 4.00E+05 2.98E+06 3.57E+05 2.86E+07 3.78E+04 3.60E+04 3.26E+04 5.29E+04 epieudesmin 1.92E+07 3.51E+07 2.43E+07 2.50E+07 1.94E+07 2.05E+07 1.54E+07 1.94E+07 1.99E+07 1.11E+07 2.27E+07 1.97E+07 2.70E+07 8.67E+06 2.74E+07 1.33E+07 3.29E+07 1.80E+07 1.95E+07 1.80E+07 2.47E+07 2.13E+07 1.44E+07 1.92E+07 2',4'-Dimethylacetophenone 4.85E+06 5.13E+06 5.08E+06 5.19E+06 4.81E+06 6.27E+06 4.61E+06 4.89E+06 5.30E+06 6.21E+06 5.17E+06 4.96E+06 4.55E+06 4.22E+06 5.74E+06 4.62E+06 4.68E+06 6.25E+06 4.43E+06 3.75E+06 4.93E+06 6.56E+06 4.86E+06 6.09E+06 N-(gamma-L-glutamyl)tyramine O-glucoside 1.72E+06 1.52E+06 1.69E+06 1.53E+06 1.30E+06 1.43E+06 7.31E+05 1.65E+06 1.81E+06 1.02E+06 1.29E+06 1.32E+06 1.95E+06 4.15E+05 1.67E+06 8.73E+05 1.51E+06 1.90E+06 9.42E+05 1.08E+06 1.42E+06 1.04E+06 2.09E+06 1.12E+06 Beta-asarone* 5.01E+05 2.15E+05 3.11E+05 2.38E+05 3.22E+05 3.28E+05 5.53E+05 3.29E+05 4.79E+05 4.32E+05 2.23E+06 1.18E+06 3.54E+05 3.82E+05 1.60E+06 4.49E+05 1.45E+06 2.21E+06 4.62E+05 4.83E+05 2.61E+05 2.68E+05 2.63E+05 3.21E+05 2-Aminooctadecane-1,16,18,18-tetraol 1.07E+07 2.45E+07 2.59E+07 1.47E+07 1.40E+07 1.49E+07 1.74E+07 2.70E+07 1.51E+07 1.53E+07 2.37E+07 2.63E+07 2.60E+07 1.61E+07 1.46E+07 1.75E+07 1.51E+07 2.49E+07 1.73E+07 1.90E+07 1.58E+07 2.93E+07 2.65E+07 1.39E+07 Isosclerone;(4S)-4,8-Dihydroxy-3,4-Dihydronaphthalene-1(2H)-One 3.19E+05 4.08E+05 5.80E+05 2.81E+05 2.93E+05 2.28E+05 2.12E+05 3.05E+05 3.20E+05 4.33E+05 2.05E+05 3.84E+05 2.20E+05 3.87E+05 3.88E+05 4.89E+05 2.75E+05 6.80E+05 5.03E+05 1.99E+05 2.19E+05 4.11E+05 4.74E+05 2.45E+05 Isoalantolactone 8.47E+04 8.75E+04 1.21E+05 1.49E+05 1.09E+05 5.67E+04 4.36E+05 1.01E+05 2.82E+05 4.18E+05 1.08E+06 1.39E+06 3.27E+05 1.11E+06 1.91E+06 2.79E+05 2.70E+06 5.31E+05 1.30E+06 6.21E+07 3.38E+05 9.67E+04 2.36E+05 1.21E+05 cis-4-Hydroxy-D-proline* 3.05E+06 2.11E+07 1.69E+07 5.54E+06 1.47E+07 3.31E+06 2.30E+06 6.91E+06 9.82E+06 1.17E+06 4.82E+06 1.27E+07 8.91E+06 2.35E+06 3.57E+06 6.91E+05 1.36E+07 3.86E+06 3.07E+06 3.84E+06 9.65E+06 4.10E+06 4.43E+06 3.62E+06 2-aminodocoSane-1,5,7,21-tetraol 5.85E+06 6.35E+06 6.32E+06 5.77E+06 5.58E+06 5.55E+06 6.21E+06 6.18E+06 7.41E+06 5.84E+06 6.55E+06 6.66E+06 6.40E+06 5.92E+06 6.36E+06 6.75E+06 5.17E+06 6.62E+06 5.98E+06 6.63E+06 6.03E+06 6.47E+06 5.96E+06 6.35E+06 L-Valinol 1.55E+06 1.62E+06 1.40E+06 1.12E+06 1.81E+06 1.15E+06 1.39E+06 1.56E+06 1.48E+06 1.41E+06 1.55E+06 2.01E+06 1.29E+06 3.46E+05 1.27E+06 4.99E+05 9.80E+05 1.49E+06 1.11E+06 1.70E+06 1.02E+06 1.67E+06 1.76E+06 1.81E+06 (2e)-3-(4-hydroxyphenyl)-n-[2-(4-hydroxyphenyl)ethyl]prop-2-enimidic acid* 1.52E+05 2.04E+06 1.94E+07 3.73E+05 7.74E+05 8.48E+06 1.41E+07 3.07E+06 8.78E+05 1.81E+07 2.20E+07 1.36E+06 1.18E+07 3.06E+07 6.59E+05 4.99E+07 3.20E+07 2.68E+06 6.84E+06 5.97E+06 4.16E+06 2.41E+06 2.08E+06 4.60E+06 14,15-Dehydrocrepenynic acid* 6.91E+06 4.17E+06 1.44E+07 1.78E+06 6.23E+06 1.32E+07 5.48E+06 1.62E+07 6.29E+06 1.46E+06 6.71E+06 1.11E+07 1.14E+07 2.33E+05 3.29E+06 8.56E+06 2.93E+06 2.00E+06 3.15E+06 5.08E+06 2.67E+06 2.24E+06 5.65E+06 1.86E+07 9,12-Octadecadiynoic Acid* 6.91E+06 4.17E+06 1.44E+07 1.78E+06 6.23E+06 1.32E+07 5.48E+06 1.62E+07 6.29E+06 1.46E+06 6.71E+06 1.11E+07 1.14E+07 2.33E+05 3.29E+06 8.56E+06 2.93E+06 2.00E+06 3.15E+06 5.08E+06 2.67E+06 2.24E+06 5.65E+06 1.86E+07 Succinic anhydride 1.43E+05 2.73E+05 7.61E+04 1.29E+05 2.14E+05 8.58E+04 1.07E+05 1.96E+05 1.56E+05 1.09E+05 8.47E+04 2.26E+05 1.38E+05 1.92E+05 1.30E+05 1.24E+05 2.69E+05 9.88E+04 2.57E+05 1.99E+05 9.32E+04 1.48E+05 1.49E+05 1.47E+05 1-Methoxy-indole-3-acetamide 3.88E+07 1.97E+07 1.41E+07 1.59E+07 4.71E+07 2.84E+07 1.23E+07 9.44E+06 6.11E+07 1.60E+07 2.99E+07 1.13E+08 4.95E+07 1.83E+06 2.66E+07 8.88E+05 8.77E+06 2.07E+07 4.23E+06 6.82E+07 5.59E+07 4.34E+07 1.66E+07 5.03E+07 Linolenyl Alcohol 3.21E+06 2.82E+06 3.19E+06 4.55E+06 7.60E+06 1.02E+07 9.18E+06 8.15E+06 1.44E+07 1.55E+07 1.37E+07 1.01E+07 1.65E+07 1.80E+07 1.43E+07 2.25E+07 1.47E+07 1.30E+07 1.22E+07 1.43E+07 1.48E+07 1.50E+07 1.56E+07 1.15E+07 4-Nitrophenol 1.03E+07 1.14E+07 1.05E+07 8.08E+06 1.07E+07 1.46E+07 7.62E+06 6.87E+06 9.20E+06 8.98E+06 1.23E+07 8.97E+06 8.73E+06 1.33E+07 8.33E+06 1.45E+07 1.18E+07 1.07E+07 6.26E+06 1.07E+07 9.74E+06 8.14E+06 7.48E+06 8.80E+06 Collinusin 2.72E+05 3.31E+05 6.80E+05 8.13E+05 2.93E+05 1.85E+06 1.27E+06 2.44E+05 4.13E+05 1.15E+06 2.40E+06 7.05E+05 1.04E+06 1.71E+06 9.45E+05 3.78E+06 1.98E+06 1.38E+06 1.23E+06 1.52E+06 5.44E+06 1.94E+06 7.02E+05 8.77E+05 Feruloyl syringic acid 6.62E+06 1.12E+07 1.06E+07 9.75E+06 1.35E+07 5.58E+06 7.96E+06 1.02E+07 1.07E+07 6.51E+06 5.07E+06 1.26E+07 1.08E+07 3.11E+06 9.99E+06 1.03E+06 1.39E+07 8.04E+06 8.51E+06 5.98E+06 9.07E+06 7.81E+06 6.71E+06 1.01E+07 Glu-Phe 4.80E+04 5.26E+05 9.44E+04 6.09E+04 7.63E+04 6.60E+04 5.30E+04 8.75E+04 2.89E+05 3.09E+04 1.56E+05 1.44E+05 4.63E+05 2.27E+04 1.05E+05 3.40E+04 1.43E+05 6.74E+04 5.73E+05 1.89E+05 2.27E+05 4.86E+05 7.18E+05 9.04E+04 DL-Threonine 1.53E+06 2.00E+06 2.59E+06 1.91E+06 2.16E+06 1.73E+06 2.65E+06 2.13E+06 3.73E+06 1.88E+06 3.54E+06 1.88E+06 4.11E+06 8.47E+05 1.66E+06 7.06E+05 1.61E+06 2.28E+06 1.66E+06 6.04E+06 3.36E+06 2.10E+06 4.00E+06 4.61E+06 Tetradecasphinganine* 6.66E+06 7.72E+06 7.56E+06 8.18E+06 8.15E+06 8.71E+06 8.73E+06 7.95E+06 8.73E+06 8.08E+06 7.63E+06 8.21E+06 6.69E+06 8.70E+06 8.24E+06 8.55E+06 6.72E+06 7.07E+06 9.08E+06 8.68E+06 8.30E+06 8.31E+06 7.88E+06 8.34E+06 N-Carbamoylsarcosine 4.03E+06 3.48E+06 3.94E+06 4.00E+06 3.18E+06 2.99E+06 2.62E+06 3.52E+06 3.57E+06 2.36E+06 3.39E+06 3.22E+06 3.90E+06 1.73E+06 3.56E+06 1.54E+06 3.70E+06 3.51E+06 3.17E+06 3.74E+06 3.00E+06 3.29E+06 3.39E+06 4.17E+06 N,N-Dimethylglycine* 2.42E+07 2.34E+07 2.18E+07 1.68E+07 2.73E+07 1.61E+07 1.85E+07 2.20E+07 2.30E+07 1.87E+07 2.12E+07 2.51E+07 1.89E+07 5.74E+06 1.97E+07 5.49E+06 1.51E+07 1.85E+07 1.62E+07 2.38E+07 1.62E+07 2.26E+07 2.32E+07 2.79E+07 8-hydroxy-2,3,3,9-tetramethyl-2h-furo[3,2-c]chromen-4-one 1.38E+04 6.70E+04 8.10E+04 6.13E+03 3.48E+04 1.10E+05 9.81E+04 9.67E+04 1.98E+05 7.55E+04 8.42E+04 1.10E+05 1.66E+06 2.44E+07 3.40E+04 1.00E+05 2.67E+04 5.12E+04 4.69E+07 9.72E+07 1.81E+06 2.88E+05 7.68E+05 1.38E+05 L-Asparagine 1.24E+06 1.48E+06 1.98E+06 2.01E+06 2.91E+06 7.78E+05 1.84E+07 1.65E+06 1.73E+06 1.01E+06 2.40E+07 3.04E+06 8.72E+06 5.92E+05 3.30E+06 2.89E+05 1.03E+06 1.05E+06 9.52E+05 3.63E+07 4.00E+06 1.34E+06 2.29E+06 5.99E+06 Nicotinamide 8.55E+05 1.66E+06 2.18E+06 1.00E+06 1.05E+06 1.83E+06 8.41E+06 2.33E+06 2.00E+06 5.02E+06 5.30E+06 1.55E+06 1.40E+06 1.52E+06 1.83E+06 1.52E+06 1.84E+06 2.12E+06 4.71E+06 5.03E+06 3.63E+06 2.73E+06 1.98E+06 3.68E+06 Lithospermoside 6.64E+06 1.17E+06 1.49E+06 1.31E+06 2.39E+06 6.63E+06 5.81E+06 2.61E+06 1.67E+06 2.30E+06 7.08E+06 2.24E+06 1.80E+07 6.17E+05 1.07E+06 1.38E+06 1.45E+06 1.31E+06 1.23E+06 7.32E+06 2.96E+06 3.08E+06 4.57E+06 1.93E+06 Methyl-3-(3-hydroxyphenyl)Propionate 6.24E+06 8.20E+06 5.87E+06 7.14E+06 9.66E+06 1.87E+07 8.55E+06 1.20E+07 1.08E+07 6.47E+06 1.55E+07 1.44E+07 2.69E+07 1.83E+07 7.31E+06 8.29E+06 8.48E+06 1.22E+07 1.47E+07 2.66E+07 1.06E+07 6.48E+06 6.09E+06 2.66E+07 2-Aminooctadecane-1,4-diol 3.97E+07 4.37E+07 4.47E+07 4.11E+07 4.20E+07 4.99E+07 4.46E+07 4.08E+07 4.33E+07 4.35E+07 4.44E+07 4.55E+07 4.31E+07 4.28E+07 4.22E+07 5.03E+07 3.97E+07 4.27E+07 3.94E+07 4.34E+07 4.03E+07 4.24E+07 4.10E+07 4.75E+07 2,3-Dihydro-1,4-naphthoquinone 3.82E+06 3.42E+06 3.64E+06 3.49E+06 3.06E+06 3.03E+06 2.48E+06 3.41E+06 3.36E+06 2.13E+06 3.20E+06 3.24E+06 3.88E+06 1.72E+06 3.56E+06 1.35E+06 3.13E+06 3.55E+06 2.86E+06 3.51E+06 2.77E+06 3.04E+06 3.29E+06 3.79E+06 2,3-Dihydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)propan-1-one 7.63E+05 4.37E+06 4.80E+06 1.19E+06 1.56E+06 3.81E+07 2.15E+07 1.20E+06 1.20E+06 6.80E+06 9.43E+06 2.17E+06 8.87E+06 2.43E+06 1.24E+06 6.36E+06 2.18E+06 4.87E+06 2.94E+06 2.30E+06 5.13E+06 3.10E+06 2.41E+06 2.54E+06 2,6-Dimethoxy-4-(7-methoxy-3-methyl-5-prop-1-enyl-2,3-dihydro-1-benzofuran-2-yl)phenol* 1.02E+05 1.54E+05 1.22E+05 1.71E+05 3.88E+05 2.02E+05 1.62E+06 3.49E+06 1.93E+05 9.82E+05 2.70E+05 1.05E+06 1.22E+05 1.33E+05 1.16E+05 4.41E+04 4.02E+05 8.83E+03 1.46E+06 5.06E+05 3.24E+04 7.08E+04 2.78E+06 1.26E+04 L-Glutamic acid 8.60E+06 6.83E+06 5.02E+06 5.75E+06 5.73E+06 2.51E+06 5.86E+06 8.76E+06 9.98E+06 3.68E+06 1.05E+07 7.00E+06 1.20E+07 1.89E+06 7.24E+06 8.76E+05 4.59E+06 5.25E+06 3.50E+06 8.59E+06 8.22E+06 4.29E+06 8.76E+06 1.14E+07 LysoPC 18:1(2n isomer) 3.15E+06 4.42E+06 6.92E+06 3.77E+06 4.57E+06 4.49E+06 1.84E+07 1.74E+07 8.85E+06 1.90E+07 6.18E+06 6.55E+06 8.77E+06 3.69E+07 5.98E+06 1.99E+07 1.07E+07 1.95E+06 3.03E+07 6.40E+06 5.04E+06 1.05E+07 1.67E+07 1.53E+07 6-Aminocaproic acid 2.51E+06 2.79E+06 4.27E+06 3.09E+06 1.18E+07 2.67E+06 1.51E+07 2.44E+06 9.47E+06 4.02E+06 1.99E+07 6.15E+06 3.20E+07 2.08E+06 4.89E+06 4.26E+05 1.69E+06 3.07E+06 2.65E+06 2.81E+07 1.71E+07 1.70E+06 8.31E+06 3.18E+07 Betaine 4.63E+06 1.81E+07 1.44E+07 5.76E+06 1.86E+07 3.09E+07 3.42E+07 6.18E+06 7.67E+06 2.26E+07 5.14E+07 2.81E+07 3.65E+07 4.14E+07 5.51E+06 2.89E+07 1.56E+07 2.44E+07 5.97E+07 9.05E+06 3.43E+07 2.30E+07 1.89E+07 3.83E+06 L-Histidine 9.39E+05 7.89E+05 1.93E+06 2.94E+06 1.22E+07 6.10E+05 2.22E+05 5.78E+05 9.38E+05 1.18E+05 3.13E+06 8.78E+05 8.74E+06 5.67E+04 1.74E+06 7.99E+04 2.73E+05 3.15E+05 1.06E+05 2.14E+06 5.47E+06 5.94E+06 4.79E+06 2.87E+06 Imidazole-4-Acetic Acid 5.08E+06 7.03E+06 4.61E+06 5.77E+06 8.98E+06 5.74E+06 4.70E+06 5.86E+06 5.60E+06 4.50E+06 4.68E+06 6.78E+06 3.02E+06 2.40E+06 4.73E+06 3.99E+06 5.36E+06 5.38E+06 3.75E+06 4.74E+06 3.47E+06 7.38E+06 6.25E+06 6.02E+06 2-Pentyl-3-phenyl-2-propenal 6.44E+05 8.34E+05 8.56E+05 7.10E+05 8.13E+05 9.25E+05 8.54E+05 8.79E+05 1.13E+06 9.41E+05 9.63E+05 9.12E+05 7.78E+05 9.95E+05 9.50E+05 9.12E+05 1.04E+06 1.01E+06 9.48E+05 7.14E+05 1.04E+06 1.02E+06 9.05E+05 9.96E+05 Glycerol 9(E),11(Z),13(E)-octadecatrienoyl ester* 3.73E+06 4.75E+06 3.09E+06 1.01E+06 3.11E+06 5.21E+06 7.38E+06 4.84E+06 6.97E+06 1.86E+06 9.09E+06 6.39E+06 3.68E+06 4.95E+05 2.57E+06 5.80E+05 3.62E+06 3.81E+06 1.34E+06 3.48E+06 2.84E+06 6.44E+05 7.58E+05 1.28E+07 2-Aminohexadecane-1,16,16-triol 1.07E+07 2.94E+07 2.77E+07 1.54E+07 1.39E+07 1.48E+07 1.72E+07 3.12E+07 1.43E+07 1.68E+07 2.78E+07 2.80E+07 3.04E+07 1.49E+07 1.33E+07 1.79E+07 1.61E+07 3.08E+07 1.52E+07 1.89E+07 1.43E+07 3.18E+07 3.07E+07 1.23E+07 L-Cyclopentylglycine 1.02E+06 1.20E+06 5.96E+05 6.14E+05 1.89E+06 5.02E+05 1.60E+06 7.46E+05 1.02E+06 1.23E+06 1.11E+06 1.48E+06 1.88E+06 6.28E+05 1.75E+06 7.61E+05 2.64E+06 9.37E+05 3.13E+06 2.89E+06 5.88E+05 2.17E+06 2.57E+06 2.07E+06 N-benzylformamide 1.14E+07 1.68E+07 6.16E+06 1.55E+07 2.27E+07 3.42E+06 8.52E+06 1.95E+07 1.33E+07 3.67E+06 7.23E+06 1.43E+07 1.99E+07 6.07E+05 1.11E+07 4.61E+05 5.77E+06 1.39E+07 7.67E+06 1.83E+07 2.25E+07 1.58E+07 1.31E+07 4.86E+07 Casuarine Analogue* 2.03E+06 1.16E+06 1.94E+06 9.67E+05 1.41E+06 1.30E+06 3.20E+06 7.39E+05 1.64E+06 2.13E+06 4.48E+06 2.77E+06 3.87E+06 1.38E+06 2.55E+06 2.02E+06 1.23E+06 3.89E+06 2.81E+06 5.63E+06 3.28E+06 1.69E+06 3.39E+06 1.22E+06 L-Carnitine 2.65E+05 1.42E+05 4.26E+05 2.82E+05 1.39E+06 3.66E+05 4.70E+05 1.49E+05 1.92E+05 9.72E+05 2.02E+05 4.32E+05 3.51E+05 1.16E+06 1.48E+05 1.80E+05 1.82E+05 6.33E+04 6.56E+05 1.11E+05 2.90E+05 4.19E+05 1.08E+06 4.74E+04 3,4-Methylenedioxycinnamaldehyde 1.53E+06 1.61E+06 1.59E+06 1.52E+06 1.49E+06 1.71E+06 1.44E+06 1.63E+06 1.54E+06 1.49E+06 1.58E+06 1.51E+06 1.42E+06 1.47E+06 1.60E+06 1.51E+06 1.61E+06 1.63E+06 1.41E+06 1.25E+06 1.53E+06 1.67E+06 1.60E+06 1.45E+06 LysoPC 19:1 2.92E+04 2.77E+04 4.00E+04 4.37E+04 2.88E+04 4.45E+04 7.64E+04 6.29E+04 3.21E+04 6.31E+04 1.14E+05 3.58E+04 6.36E+04 5.22E+04 2.77E+04 7.63E+04 3.83E+04 1.63E+04 2.94E+05 3.84E+04 5.49E+04 6.38E+04 5.38E+04 2.47E+04 Glycylphenylalanine 3.88E+04 3.44E+05 1.53E+05 7.98E+04 1.43E+05 1.08E+05 1.34E+05 7.25E+04 4.04E+05 7.79E+04 3.43E+05 2.05E+05 6.48E+05 6.01E+04 1.09E+05 1.54E+05 2.05E+05 1.74E+05 1.10E+06 4.21E+05 1.68E+05 5.66E+05 2.01E+06 2.15E+05 2,3-cis-4-(3,4-hydroxyphenyl)-2,3-dihydro-2,3-dihydroxyphenalen-1-one 7.36E+04 3.02E+04 2.14E+05 2.25E+05 5.03E+04 1.27E+05 1.56E+05 1.88E+05 1.26E+05 2.59E+05 2.00E+05 1.89E+05 2.53E+05 2.82E+05 1.87E+05 3.29E+05 1.39E+05 2.43E+05 2.39E+05 3.73E+05 1.29E+06 1.64E+06 1.21E+05 3.13E+05 Asp-Pro-Asn 2.65E+07 2.99E+07 3.20E+07 4.94E+07 9.50E+06 7.64E+06 1.17E+07 2.49E+07 2.53E+07 2.46E+07 1.41E+07 8.91E+06 3.14E+07 2.68E+07 5.10E+07 2.61E+07 3.30E+07 3.17E+07 1.03E+07 4.29E+07 1.58E+07 1.28E+07 1.32E+07 6.90E+07 Α-hydroxyquinoline 6.01E+06 2.99E+06 1.58E+06 2.43E+06 7.23E+06 3.85E+06 2.20E+06 1.68E+06 8.49E+06 2.25E+06 5.08E+06 1.83E+07 6.99E+06 2.51E+05 3.77E+06 1.62E+05 2.56E+06 2.89E+06 6.25E+05 1.08E+07 7.57E+06 6.07E+06 5.79E+06 7.97E+06 Dihydrocostunolide 1.43E+05 9.43E+04 6.17E+04 7.96E+04 3.95E+04 9.21E+04 9.59E+04 3.03E+04 2.43E+04 6.89E+04 5.79E+05 3.50E+07 1.08E+05 4.48E+04 5.30E+05 4.13E+04 2.28E+06 7.93E+05 6.18E+05 9.53E+06 8.77E+04 4.35E+04 1.99E+05 3.28E+04 Crotonoside; 2-Hydroxyadenosine 2.36E+06 1.84E+07 1.60E+07 4.04E+06 3.82E+06 1.35E+07 2.16E+07 5.98E+06 9.85E+06 9.21E+06 1.90E+07 9.16E+06 3.49E+07 6.03E+06 4.02E+06 9.47E+05 7.21E+06 2.13E+06 2.56E+07 1.90E+07 2.36E+07 1.75E+07 1.85E+07 3.26E+07 5-O-β-D-Glucopyranosyl-3-hydrobenzo(b)fu-ran-2-one 1.08E+07 9.82E+06 1.27E+07 1.78E+07 6.34E+06 1.05E+07 3.77E+06 5.96E+06 5.92E+06 4.45E+06 3.91E+06 5.52E+06 4.13E+06 3.68E+06 9.62E+06 9.28E+06 9.26E+06 1.18E+07 6.72E+06 4.97E+06 3.51E+06 6.87E+06 3.10E+06 5.57E+06 Pipecolic acid 2.38E+07 1.30E+07 1.31E+07 1.87E+07 2.09E+07 6.51E+06 2.64E+07 2.77E+07 2.20E+07 1.11E+07 2.16E+07 2.35E+07 2.65E+07 3.52E+06 1.27E+07 1.88E+06 1.09E+07 2.76E+07 6.47E+06 5.05E+07 2.91E+07 1.43E+07 2.36E+07 3.30E+07 6-Chloropurine 9.99E+06 1.06E+07 8.27E+06 2.81E+07 1.08E+07 9.84E+06 7.87E+06 1.04E+07 1.20E+07 8.59E+06 9.75E+06 2.33E+07 1.00E+07 6.95E+06 1.10E+07 6.17E+06 9.07E+06 1.21E+07 1.03E+07 1.00E+07 2.79E+07 1.24E+07 9.92E+06 1.09E+07 Octadec-8-enamide 8.22E+06 6.91E+06 7.67E+06 9.92E+06 1.89E+07 2.70E+07 2.28E+07 2.37E+07 4.08E+07 4.22E+07 3.24E+07 2.59E+07 4.38E+07 5.10E+07 3.61E+07 5.77E+07 3.90E+07 3.63E+07 3.08E+07 3.48E+07 3.92E+07 3.76E+07 3.83E+07 2.79E+07 2'-O-Methyladenosine 2.04E+05 4.91E+05 7.08E+05 3.86E+05 2.21E+05 3.95E+05 3.54E+05 4.58E+05 4.85E+05 3.25E+05 4.77E+05 4.70E+05 1.85E+06 2.45E+05 2.68E+05 5.45E+05 7.84E+05 2.32E+05 1.28E+06 8.26E+05 1.14E+06 1.87E+06 7.45E+05 1.16E+06 2-Aminohexadecane-1,5,6-triol 7.76E+06 2.07E+07 1.97E+07 1.07E+07 1.01E+07 1.08E+07 1.28E+07 2.27E+07 1.01E+07 1.08E+07 2.01E+07 2.28E+07 2.17E+07 1.08E+07 9.52E+06 1.16E+07 1.08E+07 2.17E+07 1.17E+07 1.25E+07 9.92E+06 2.35E+07 2.13E+07 9.71E+06 Aketrilignoside B 2.56E+06 1.87E+06 1.51E+06 2.28E+06 1.97E+06 2.72E+06 1.69E+06 2.20E+06 2.19E+06 1.33E+06 2.12E+06 1.66E+06 1.08E+06 1.47E+06 1.89E+06 1.32E+06 2.01E+06 1.77E+06 1.60E+06 1.45E+06 2.48E+06 1.74E+06 1.64E+06 1.33E+06 Val-Tyr 2.08E+04 1.31E+05 1.08E+06 2.26E+04 1.74E+05 1.42E+05 3.20E+06 9.40E+05 8.17E+04 5.75E+05 2.71E+05 2.55E+05 3.67E+05 1.50E+05 4.85E+04 1.74E+05 5.45E+05 2.97E+05 2.13E+05 1.39E+06 3.58E+05 2.99E+05 2.99E+05 1.03E+06 DL-2-Aminoadipic acid 1.56E+06 1.59E+06 1.75E+06 1.54E+06 4.43E+06 1.28E+06 2.81E+06 2.35E+06 1.91E+06 1.89E+06 3.06E+06 2.49E+06 5.51E+06 6.59E+05 2.05E+06 5.42E+05 1.69E+06 1.31E+06 1.52E+06 3.24E+06 3.78E+06 1.57E+06 1.52E+06 2.07E+07 LysoPC 16:0(2n isomer)* 5.37E+05 7.71E+05 8.40E+05 6.10E+05 7.12E+05 6.74E+05 1.02E+06 7.71E+05 4.32E+05 1.42E+06 8.85E+05 7.57E+05 1.08E+06 1.14E+06 5.81E+05 3.99E+06 1.31E+06 5.13E+05 1.69E+06 1.07E+06 4.27E+05 5.32E+05 8.98E+05 9.48E+05 L-Pipecolic Acid 1.75E+07 1.80E+07 1.90E+06 2.20E+07 2.17E+07 2.94E+06 1.62E+07 2.52E+07 8.97E+06 3.79E+06 4.35E+06 1.90E+07 4.86E+06 1.80E+06 2.89E+06 3.45E+05 5.04E+06 1.33E+06 3.14E+06 5.33E+07 3.96E+06 7.62E+06 7.45E+06 8.41E+06 LysoPE 16:1* 9.44E+04 3.76E+04 3.27E+04 1.43E+05 1.14E+05 6.00E+04 8.84E+04 1.07E+05 5.91E+04 3.00E+04 1.37E+05 8.06E+04 6.35E+04 1.60E+04 8.53E+04 8.17E+03 5.56E+04 6.09E+04 4.03E+04 1.63E+04 6.29E+03 2.08E+04 3.57E+04 3.35E+04 Punicic acid (9Z,11E,13Z-octadecatrienoic acid) 1.01E+07 7.49E+06 4.64E+07 4.57E+06 1.04E+07 5.09E+07 1.13E+07 2.83E+07 9.96E+06 8.09E+06 1.24E+07 1.21E+07 2.72E+07 1.63E+06 6.56E+06 6.87E+07 7.49E+06 3.95E+06 7.85E+06 7.77E+06 4.97E+06 4.01E+06 1.70E+07 1.49E+07 3,5-Dihydro-2H-Furo[3,2-C]Quinolin-4-One* 1.74E+06 7.75E+05 4.80E+05 8.34E+05 2.17E+06 1.12E+06 1.19E+06 6.02E+05 2.61E+06 7.29E+05 1.61E+06 6.51E+06 2.05E+06 5.95E+04 1.05E+06 3.08E+04 3.61E+05 9.99E+05 1.86E+05 3.22E+06 2.32E+06 1.87E+06 6.51E+05 2.51E+06 Acacetin-7-O-glucuronide 6.65E+04 6.45E+04 1.55E+05 2.03E+05 7.91E+04 3.50E+04 1.54E+05 1.33E+05 7.32E+04 1.59E+05 1.08E+05 8.02E+04 1.58E+05 8.03E+05 2.46E+05 4.68E+05 1.59E+05 4.69E+05 1.06E+05 2.90E+05 6.20E+05 4.08E+05 1.51E+05 3.63E+05 Lauryldiethanolamine* 1.72E+07 1.92E+07 1.91E+07 1.98E+07 1.96E+07 2.00E+07 2.03E+07 2.07E+07 2.14E+07 2.16E+07 2.03E+07 1.89E+07 1.69E+07 2.10E+07 2.10E+07 2.25E+07 1.88E+07 1.99E+07 2.08E+07 2.13E+07 2.01E+07 1.98E+07 1.90E+07 2.09E+07 3,4-dihydroxy phenylethanol 6.71E+05 2.09E+06 7.73E+05 1.15E+06 2.19E+06 1.86E+06 1.94E+06 1.97E+06 1.98E+06 1.93E+06 1.95E+06 2.37E+06 1.97E+06 2.42E+06 8.45E+05 1.96E+06 8.15E+05 2.39E+06 3.06E+06 8.54E+05 1.26E+06 7.09E+05 7.83E+05 8.63E+05 O-Acetyl-L-carnitine 1.71E+06 2.96E+06 3.82E+06 2.49E+06 4.26E+06 3.52E+06 6.29E+06 2.03E+06 8.69E+06 1.88E+07 5.05E+06 7.34E+06 1.56E+07 1.51E+07 3.30E+06 4.73E+06 3.86E+06 2.53E+06 1.59E+07 4.61E+06 5.12E+06 3.36E+06 6.32E+06 3.50E+06 5-Hydroxy-2-pyrrolidinone 7.94E+05 6.32E+05 4.88E+05 6.77E+05 5.92E+05 2.38E+05 5.21E+05 8.64E+05 8.32E+05 3.84E+05 1.34E+06 7.55E+05 1.21E+06 2.07E+05 1.11E+06 1.49E+05 4.52E+05 5.22E+05 3.35E+05 9.18E+05 8.86E+05 4.36E+05 8.06E+05 1.01E+06 Sugiol 2.27E+04 1.97E+05 1.11E+05 1.60E+05 7.50E+04 7.63E+05 3.50E+06 5.05E+04 2.75E+04 7.15E+05 2.49E+05 6.21E+05 1.07E+06 3.04E+05 1.11E+05 1.58E+05 4.03E+05 3.13E+04 4.27E+06 3.05E+04 5.68E+05 9.45E+04 1.03E+06 1.77E+04 Myristicanol B* 1.49E+05 1.08E+06 5.44E+05 6.94E+05 1.02E+06 5.12E+05 1.69E+06 2.77E+06 2.02E+05 1.40E+06 4.24E+05 3.21E+06 1.09E+06 4.46E+05 2.03E+05 2.29E+05 1.57E+06 6.15E+04 3.27E+06 5.37E+05 2.76E+05 1.77E+04 2.40E+06 2.30E+04 Carvylacetate 1.81E+05 2.53E+05 3.07E+05 1.61E+05 1.38E+05 4.12E+05 7.61E+04 1.44E+05 2.64E+05 5.69E+04 1.52E+05 1.72E+05 4.23E+05 2.86E+04 2.46E+05 2.74E+05 1.36E+05 7.18E+04 4.31E+05 1.98E+05 1.71E+05 2.46E+05 3.14E+05 3.98E+05 Hyp-Ser 1.01E+05 1.17E+06 2.62E+05 9.37E+04 1.60E+05 3.20E+05 3.71E+05 9.77E+04 1.10E+06 2.39E+05 6.27E+05 2.13E+05 1.38E+06 1.04E+05 2.19E+05 3.01E+04 5.61E+05 1.22E+05 1.85E+06 8.66E+05 4.43E+05 7.17E+05 2.97E+06 2.57E+05 Dihydrocaffeic acid 6.32E+05 1.31E+06 1.31E+06 6.30E+05 1.28E+06 1.77E+06 8.32E+05 4.18E+05 1.26E+06 1.03E+06 1.88E+06 2.75E+06 1.39E+06 7.00E+05 8.53E+05 7.58E+05 1.24E+06 1.11E+06 1.42E+06 6.07E+05 1.27E+06 1.20E+06 4.41E+05 2.57E+06 (10Z,14E,16E)-10,14,16-Octadecatrien-12-Ynoic Acid 2.02E+05 2.19E+05 4.15E+05 4.96E+04 1.56E+05 6.43E+05 3.63E+05 3.34E+05 2.58E+05 1.49E+05 4.49E+05 1.93E+05 3.78E+05 2.84E+04 2.59E+05 8.27E+05 2.32E+05 9.47E+04 2.94E+05 2.51E+05 2.29E+05 7.32E+04 7.58E+04 5.76E+05 Ribosyladenosine 4.05E+06 3.22E+06 3.38E+06 1.87E+06 2.72E+06 2.19E+06 5.64E+06 5.74E+06 6.90E+06 3.51E+06 4.71E+06 3.72E+06 2.97E+06 4.42E+06 1.33E+07 1.25E+07 2.83E+06 7.26E+06 2.41E+06 5.72E+07 9.99E+05 1.23E+06 2.35E+06 1.48E+06 Alanylproline 8.78E+05 1.24E+06 1.23E+06 7.91E+05 1.68E+06 1.86E+06 1.03E+06 7.96E+05 1.17E+06 1.20E+06 1.42E+06 1.05E+06 9.56E+05 1.43E+06 9.58E+05 1.94E+06 1.18E+06 1.19E+06 8.04E+05 7.34E+05 9.78E+05 1.03E+06 1.60E+06 7.94E+05 (1S,3R,3a1S,8R,10S,11aS)-1,5,10-trihydroxy-3,3a1,8,11a-tetramethyl-2,11-dioxohexadecahydrodibenzo[de,g]chromen-4-yl acetate 1.01E+05 9.04E+04 9.36E+04 1.03E+05 1.84E+05 1.58E+05 2.14E+05 2.29E+05 3.07E+05 2.67E+05 3.15E+05 2.85E+05 3.34E+05 5.53E+05 2.51E+05 2.67E+05 1.85E+05 5.33E+05 3.57E+05 4.27E+05 6.13E+05 3.70E+05 2.20E+05 7.58E+05 3-Hydroxy-3,7,11-trimethyldodeca-1,6E,10-trien-9-yl isobutyrate 2.77E+05 3.40E+05 1.06E+06 1.61E+05 5.80E+05 1.26E+06 2.79E+05 3.84E+05 2.46E+05 5.30E+05 5.53E+05 5.07E+05 7.54E+05 1.30E+05 2.24E+05 1.92E+06 2.93E+05 1.42E+05 3.63E+05 3.01E+05 1.91E+05 2.23E+05 8.21E+05 5.20E+05 Homoproline 1.17E+06 7.77E+05 8.44E+05 1.07E+06 9.46E+05 1.24E+06 1.68E+06 7.69E+05 8.03E+05 1.10E+06 9.13E+05 1.12E+06 2.85E+06 7.83E+05 1.14E+06 8.77E+05 7.93E+05 9.16E+05 1.61E+06 8.02E+06 3.33E+06 2.10E+07 1.53E+06 2.43E+06 N-Methyl-Trans-4-Hydroxy-L-Proline 2.80E+05 4.32E+05 4.42E+05 3.52E+05 6.36E+05 5.59E+05 9.79E+05 2.45E+05 3.59E+05 7.37E+05 7.35E+05 8.19E+05 1.72E+06 1.25E+06 5.99E+05 5.29E+05 3.73E+05 4.47E+05 1.33E+06 5.37E+05 1.73E+06 1.59E+06 8.10E+05 5.54E+05 LysoPC 20:2 1.96E+05 1.29E+05 2.23E+05 1.62E+05 2.10E+05 8.29E+04 8.50E+04 1.06E+05 7.70E+04 5.59E+04 1.13E+05 1.88E+05 5.64E+04 7.28E+04 8.88E+04 1.94E+05 3.65E+05 1.87E+05 8.12E+04 1.23E+05 5.48E+04 1.33E+05 8.75E+04 7.15E+04 (3r,4r)-3-(2h-1,3-benzodioxol-5-ylmethyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one* 1.06E+06 3.00E+06 7.93E+06 2.17E+06 2.68E+06 4.97E+06 7.19E+06 1.05E+07 2.69E+06 7.32E+06 9.75E+06 6.69E+06 1.11E+07 3.20E+07 5.29E+06 1.64E+07 1.90E+07 9.21E+06 1.55E+07 4.37E+07 1.52E+07 7.15E+06 1.34E+07 4.53E+07 alanine betaine* 2.06E+06 2.75E+06 4.01E+06 3.50E+06 8.43E+06 2.14E+06 1.23E+07 2.82E+06 4.08E+06 3.15E+06 1.30E+07 4.75E+06 1.89E+07 2.10E+06 3.81E+06 6.91E+05 2.55E+06 2.20E+06 2.26E+06 9.20E+06 1.27E+07 2.42E+06 5.35E+06 1.32E+07 4-Methoxybenzaldehyde 3.00E+07 3.86E+07 2.70E+07 4.16E+07 3.82E+07 2.84E+07 1.88E+07 3.93E+07 3.23E+07 3.25E+07 2.91E+07 3.79E+07 2.70E+07 1.25E+07 3.42E+07 2.55E+07 4.09E+07 3.44E+07 2.01E+07 2.04E+07 2.74E+07 4.09E+07 1.94E+07 3.60E+07 L-Serine 4.69E+05 7.28E+05 6.88E+05 9.21E+05 8.77E+05 8.08E+05 9.91E+05 5.93E+05 1.05E+06 7.26E+05 1.25E+06 5.21E+05 6.15E+05 3.63E+05 8.68E+05 3.61E+05 5.20E+05 4.25E+05 4.93E+05 1.01E+06 7.65E+05 4.90E+05 5.62E+05 8.63E+05 Azetidine-2-carboxylic acid* 7.05E+06 5.75E+06 4.34E+06 4.73E+06 4.82E+06 2.33E+06 5.69E+06 7.20E+06 8.32E+06 3.27E+06 9.10E+06 5.69E+06 9.80E+06 1.60E+06 6.75E+06 9.05E+05 3.95E+06 5.59E+06 2.95E+06 7.87E+06 7.59E+06 3.78E+06 8.05E+06 9.38E+06 10-Acetyligustroside 9.63E+05 1.23E+06 7.79E+05 7.35E+05 1.06E+06 8.29E+05 4.64E+05 9.72E+05 8.88E+05 7.37E+05 6.29E+05 9.86E+05 8.25E+05 2.94E+05 7.39E+05 6.32E+05 6.35E+05 4.14E+05 8.68E+05 4.38E+05 8.24E+05 1.04E+06 8.77E+05 4.11E+05 2,3,19-Trihydroxy-24-oxo-olean-12-en-28-oic acid 2.30E+05 1.74E+04 3.26E+05 4.60E+04 1.90E+05 1.66E+05 1.52E+06 2.29E+05 2.93E+05 2.87E+06 8.08E+05 1.02E+06 9.90E+05 2.65E+06 3.31E+05 5.02E+06 1.18E+06 8.69E+05 3.19E+06 1.70E+05 3.77E+05 7.81E+04 1.45E+05 4.11E+04 Riboflavin (Vitamin B2) 2.19E+06 2.26E+06 5.31E+06 2.20E+06 8.27E+06 6.17E+06 7.79E+06 1.42E+06 2.72E+06 2.31E+06 2.30E+07 9.04E+06 4.83E+06 6.75E+06 5.36E+06 5.55E+06 6.15E+06 7.41E+06 2.68E+06 7.15E+06 3.70E+06 2.21E+06 4.07E+06 4.76E+06 8-[3-oxo-2-[(E)-pent-2-enyl]cyclopenten-1-yl]octanoic acid 4.10E+05 5.94E+05 6.56E+05 8.11E+04 3.20E+05 1.31E+06 6.91E+05 4.87E+05 6.98E+05 2.86E+05 8.54E+05 3.01E+05 1.05E+06 3.01E+04 5.91E+05 1.57E+06 4.30E+05 1.33E+05 6.83E+05 8.39E+05 5.05E+05 2.35E+05 1.86E+05 1.96E+06 2-α-Linolenoyl-glycerol* 4.09E+06 4.71E+06 3.61E+06 9.11E+05 3.37E+06 5.45E+06 7.56E+06 5.07E+06 7.62E+06 2.04E+06 9.87E+06 8.35E+06 4.19E+06 5.46E+05 2.92E+06 6.81E+05 4.20E+06 3.98E+06 1.35E+06 3.95E+06 3.15E+06 7.84E+05 7.68E+05 1.49E+07 2-AminoicoSane-1,5,19-triol 5.38E+06 5.43E+06 5.23E+06 5.05E+06 5.34E+06 5.85E+06 5.70E+06 5.51E+06 5.88E+06 5.54E+06 5.46E+06 5.63E+06 5.40E+06 4.99E+06 5.52E+06 5.95E+06 4.80E+06 5.39E+06 4.85E+06 5.59E+06 5.22E+06 5.51E+06 4.89E+06 5.57E+06 Balsaminace G 8.00E+04 1.77E+05 1.38E+05 1.88E+05 1.27E+05 1.11E+05 1.92E+05 6.63E+04 7.66E+04 6.50E+04 8.81E+04 1.17E+05 1.82E+05 4.49E+04 1.34E+05 6.93E+04 1.58E+05 1.34E+05 1.17E+05 1.59E+05 1.02E+05 4.89E+04 1.33E+05 1.67E+05 N-Methyl-L-proline 6.21E+06 5.82E+06 3.40E+06 4.32E+06 5.11E+06 1.95E+06 8.11E+06 6.98E+06 6.07E+06 3.24E+06 6.75E+06 5.52E+06 8.22E+06 1.09E+06 3.55E+06 5.39E+05 3.29E+06 7.31E+06 2.08E+06 1.23E+07 8.35E+06 4.56E+06 6.98E+06 9.28E+06 Lys-Gly 6.11E+06 4.81E+06 5.24E+06 6.68E+06 4.48E+06 3.94E+06 8.34E+06 6.28E+06 6.50E+06 6.89E+06 4.83E+06 7.56E+06 7.75E+06 6.16E+06 7.27E+06 4.76E+06 8.25E+06 9.35E+06 9.07E+06 6.63E+06 7.06E+06 6.24E+06 5.18E+06 7.20E+06 11,12-O-Isopropyfidenesolajiangxin F 1.99E+05 2.83E+05 3.11E+05 2.00E+05 1.85E+05 5.46E+05 1.29E+05 1.62E+05 2.59E+05 6.45E+04 1.98E+05 1.57E+05 4.01E+05 4.95E+04 2.58E+05 3.06E+05 1.78E+05 4.37E+04 5.16E+05 2.57E+05 1.93E+05 2.23E+05 3.83E+05 4.87E+05 LysoPC 18:1 1.11E+07 8.93E+06 1.44E+07 1.63E+07 1.17E+07 9.08E+06 2.16E+07 1.66E+07 1.70E+07 2.98E+07 2.37E+07 2.34E+07 1.11E+07 2.32E+07 1.57E+07 4.55E+07 3.19E+07 1.88E+07 3.22E+07 2.54E+07 5.20E+06 1.01E+07 1.10E+07 1.63E+07 dihydrosesamin* 1.56E+06 2.30E+06 5.92E+06 1.90E+06 2.46E+06 4.66E+06 6.09E+06 8.33E+06 2.49E+06 6.14E+06 6.66E+06 5.15E+06 9.62E+06 2.54E+07 3.99E+06 1.33E+07 1.60E+07 7.40E+06 1.29E+07 3.77E+07 1.28E+07 5.72E+06 1.03E+07 3.93E+07 Fraxiresinol 5.45E+05 1.71E+06 1.45E+06 9.84E+05 7.84E+05 3.79E+06 1.05E+06 7.55E+05 7.76E+05 7.84E+05 2.90E+06 2.02E+06 1.34E+06 1.65E+06 1.20E+06 2.76E+06 1.91E+06 1.67E+06 1.21E+06 1.42E+06 1.62E+06 7.95E+05 1.27E+06 7.12E+05 cyclo-(Gly-Phe) 3.68E+07 2.00E+07 1.25E+07 1.89E+07 4.58E+07 2.55E+07 1.47E+07 1.30E+07 5.61E+07 1.84E+07 3.42E+07 1.10E+08 4.80E+07 1.65E+06 2.10E+07 6.34E+05 8.28E+06 2.15E+07 4.48E+06 7.44E+07 5.27E+07 3.52E+07 1.42E+07 5.90E+07 Justicidinoside A 4.54E+04 6.35E+04 6.43E+04 5.66E+04 1.64E+05 4.93E+05 1.05E+05 1.24E+05 1.82E+05 2.35E+05 3.07E+04 7.54E+04 1.22E+05 1.92E+05 1.01E+05 6.23E+04 1.26E+05 2.86E+05 2.92E+05 1.40E+06 3.88E+04 7.43E+04 1.56E+05 2.19E+05 5-Hydroxy-1-tetralone 3.75E+06 4.94E+06 3.24E+06 8.10E+05 4.63E+06 4.00E+06 4.78E+06 3.41E+06 4.66E+06 3.99E+06 4.80E+06 4.89E+06 5.09E+06 1.00E+06 1.31E+06 7.81E+05 3.67E+06 5.86E+06 2.69E+06 3.61E+06 4.78E+06 1.07E+06 3.02E+06 2.49E+06 Skimmin (7-Hydroxycoumarin-7-O-glucoside) 2.74E+06 9.36E+06 2.75E+06 2.49E+06 4.14E+06 7.93E+06 2.63E+07 5.15E+06 2.02E+06 2.38E+07 2.02E+07 1.93E+07 1.82E+07 6.06E+06 4.88E+06 6.81E+06 6.32E+06 2.81E+06 2.26E+07 2.05E+07 3.24E+07 1.15E+07 1.13E+07 1.72E+07 16-oxo-21β-hydroxyserrat-14-en-3α-yl acetate 5.03E+05 4.04E+05 1.48E+06 5.81E+05 9.98E+05 1.08E+06 4.08E+06 1.37E+06 1.27E+06 5.74E+06 2.67E+06 6.13E+06 5.35E+06 2.62E+06 1.79E+06 2.03E+07 2.12E+06 2.16E+06 1.05E+07 3.87E+06 2.31E+06 1.04E+06 2.49E+06 1.16E+06 D-Threose 4.80E+05 2.23E+06 3.29E+05 1.06E+06 2.62E+05 8.09E+04 1.97E+05 2.80E+06 1.83E+06 7.77E+05 7.60E+05 2.88E+05 1.27E+05 1.35E+06 1.29E+05 2.36E+05 1.09E+06 2.97E+05 5.70E+05 3.38E+05 1.90E+05 2.18E+05 7.98E+05 3.87E+05 1-18:3-LysoPC 8.39E+06 4.42E+06 7.37E+06 3.67E+06 7.71E+06 4.05E+06 7.21E+07 1.98E+07 1.21E+07 5.17E+07 1.22E+07 2.39E+07 6.37E+06 1.82E+07 6.09E+06 1.12E+07 1.64E+07 1.54E+07 1.87E+07 5.11E+06 1.84E+06 2.97E+06 2.77E+06 5.07E+06 Methyl 3-aminopropanoate 1.40E+07 1.47E+07 2.96E+07 9.36E+06 1.68E+07 1.08E+07 1.20E+07 1.26E+07 1.39E+07 1.11E+07 1.23E+07 1.43E+07 1.21E+07 3.48E+06 1.22E+07 3.89E+06 9.09E+06 1.08E+07 9.87E+06 1.36E+07 9.06E+06 1.54E+07 1.47E+07 1.60E+07 2-Aminotetradecane-1,4-diol* 5.32E+07 6.06E+07 5.58E+07 5.88E+07 5.46E+07 6.29E+07 6.13E+07 6.09E+07 5.56E+07 6.35E+07 5.71E+07 5.81E+07 4.53E+07 6.08E+07 6.45E+07 6.19E+07 5.41E+07 6.43E+07 6.20E+07 5.99E+07 5.95E+07 5.84E+07 5.44E+07 6.21E+07 3'-Methoxy-6''-O-xylosyl puerarin 7.38E+06 1.48E+07 1.83E+07 7.02E+06 1.53E+07 1.89E+07 8.30E+06 1.08E+07 1.50E+07 5.86E+06 1.63E+07 2.51E+07 1.79E+07 3.44E+06 8.00E+06 4.34E+06 1.08E+07 4.77E+07 1.03E+07 5.84E+06 1.08E+07 6.10E+06 2.94E+06 3.00E+06 Tetradecyldiethanolamine 3.54E+07 4.35E+07 3.76E+07 3.89E+07 4.16E+07 4.47E+07 3.98E+07 4.09E+07 4.45E+07 4.09E+07 4.25E+07 4.43E+07 3.93E+07 4.65E+07 3.90E+07 4.79E+07 3.85E+07 3.61E+07 4.16E+07 4.25E+07 4.20E+07 4.04E+07 4.05E+07 4.33E+07 5-hydroxyindene-1,3-dione 2.69E+06 3.23E+06 3.08E+06 3.35E+06 2.76E+06 2.81E+06 2.68E+06 3.11E+06 3.05E+06 2.91E+06 2.62E+06 2.78E+06 2.51E+06 2.87E+06 2.94E+06 2.56E+06 2.52E+06 2.91E+06 2.79E+06 2.39E+06 2.50E+06 3.15E+06 2.81E+06 2.69E+06 DL-Dopa 3.26E+05 2.39E+05 4.26E+05 1.41E+05 1.64E+05 1.13E+06 1.17E+06 2.02E+05 2.78E+05 1.15E+06 7.47E+05 1.20E+06 4.10E+06 9.82E+04 4.29E+05 8.17E+04 1.18E+05 2.62E+05 2.10E+06 1.51E+06 7.58E+05 5.63E+05 1.07E+06 1.59E+06 Macrophypene B* 6.41E+06 4.89E+06 1.07E+07 1.73E+06 5.49E+06 1.01E+07 3.94E+06 9.91E+06 5.30E+06 8.15E+05 1.15E+07 1.01E+07 8.22E+06 1.61E+05 3.10E+06 6.00E+06 5.19E+06 1.71E+06 2.86E+06 4.43E+06 1.85E+06 1.84E+06 4.94E+06 1.85E+07 1-Stearidonoyl-Glycerol 9.63E+05 2.55E+05 5.68E+05 1.23E+05 3.43E+05 1.40E+06 1.03E+06 4.78E+06 5.21E+05 3.12E+05 5.64E+05 4.33E+05 8.91E+05 1.07E+04 2.49E+05 2.26E+05 2.39E+05 2.52E+05 2.15E+05 3.51E+05 2.73E+05 7.93E+04 1.41E+04 1.64E+06 N-Phenylacetylglycine 2.13E+06 2.02E+06 2.25E+06 2.31E+06 2.07E+06 1.68E+06 1.14E+06 1.91E+06 2.10E+06 1.17E+06 2.35E+06 1.87E+06 2.42E+06 8.20E+05 2.03E+06 5.65E+05 1.44E+06 2.01E+06 1.35E+06 2.06E+06 1.43E+06 1.14E+06 2.72E+06 2.35E+06 5-Aminoimidazole ribonucleotide 7.25E+05 7.56E+05 3.10E+06 4.64E+05 9.60E+05 8.22E+05 2.32E+06 1.53E+06 3.32E+05 4.54E+06 1.29E+06 2.04E+06 8.79E+05 4.07E+06 7.75E+05 8.40E+06 1.67E+06 6.30E+05 1.38E+06 3.15E+06 7.38E+05 2.09E+05 6.26E+05 1.43E+05 4-methyl-1,5,2,3-dioxadiazinan-2-amine 4.37E+06 4.85E+07 1.13E+07 2.24E+07 6.31E+06 2.48E+06 5.35E+06 1.46E+07 1.81E+07 2.75E+06 6.97E+06 8.85E+06 3.40E+07 1.33E+06 8.83E+06 5.13E+05 5.18E+07 3.24E+06 1.51E+07 5.45E+07 2.58E+07 1.40E+07 3.01E+07 3.85E+07 Licarin A 1.57E+05 1.79E+05 7.52E+04 1.63E+05 7.28E+05 2.28E+05 5.80E+06 1.21E+07 5.30E+05 3.05E+06 2.68E+05 1.46E+06 4.99E+04 7.90E+04 8.79E+04 2.65E+04 3.97E+05 6.23E+04 6.84E+05 3.87E+05 1.17E+04 1.79E+04 1.63E+06 8.95E+03 Yuanhuanin* 1.06E+06 5.13E+05 2.00E+05 9.15E+05 3.22E+05 4.55E+05 6.31E+05 5.01E+05 5.04E+05 6.01E+05 2.40E+05 4.07E+05 1.90E+05 3.88E+05 8.06E+05 4.86E+05 5.77E+05 8.63E+05 2.60E+05 8.63E+05 1.40E+05 4.80E+05 1.12E+06 5.68E+05 Vanillin acetate 2.47E+05 3.71E+05 4.55E+05 3.35E+05 2.49E+05 8.72E+05 1.59E+05 3.86E+05 4.19E+05 1.05E+05 3.16E+05 2.74E+05 5.19E+05 1.70E+05 3.39E+05 5.91E+05 4.53E+05 3.87E+05 7.03E+05 6.48E+05 2.70E+05 3.51E+05 5.00E+05 5.50E+05 L-Leucyl-L-phenylalanine 8.94E+04 8.45E+05 4.17E+04 6.39E+04 1.07E+05 1.76E+05 2.17E+05 1.01E+05 6.11E+05 1.17E+05 5.08E+05 1.44E+05 7.71E+05 5.09E+04 1.21E+05 1.72E+04 5.02E+05 8.42E+04 1.61E+06 6.48E+05 2.55E+05 5.43E+05 4.67E+05 1.07E+05 Nectandrin B* 1.32E+04 7.52E+04 6.87E+04 7.86E+04 2.51E+05 6.02E+04 1.49E+06 2.42E+06 8.69E+04 8.36E+05 9.26E+04 3.27E+05 9.79E+04 1.23E+05 1.88E+04 1.70E+04 1.22E+05 2.81E+04 3.02E+05 1.52E+05 1.44E+05 1.95E+04 4.98E+05 1.49E+04 N-Methylserotonin 9.01E+04 1.50E+05 1.35E+05 4.88E+05 1.69E+05 3.09E+05 2.01E+05 5.82E+04 1.02E+05 1.44E+05 3.35E+05 3.11E+05 2.11E+05 1.34E+05 5.66E+05 5.98E+04 1.68E+05 1.27E+05 8.15E+04 3.17E+05 1.28E+05 1.46E+05 2.80E+05 4.28E+05 Hexadecyl ethanolamine 1.72E+06 9.69E+05 3.36E+06 2.78E+06 1.66E+06 4.51E+06 1.49E+06 2.49E+06 1.53E+06 2.24E+06 2.48E+06 2.34E+06 6.16E+06 5.91E+06 2.59E+06 6.60E+06 2.80E+06 2.58E+06 3.25E+06 2.87E+06 2.54E+06 2.76E+06 2.63E+06 5.76E+06 3,4-Dehydro-DL-proline 2.07E+05 2.03E+05 1.36E+05 2.03E+05 1.39E+05 3.78E+05 6.31E+05 2.02E+05 3.03E+05 4.86E+05 4.82E+05 5.38E+05 5.01E+05 4.71E+05 2.33E+05 3.33E+05 3.13E+05 3.25E+05 5.64E+05 1.41E+06 4.19E+05 2.82E+05 3.26E+05 2.79E+05 L-Isoserine 3.17E+06 9.34E+06 6.94E+06 7.31E+06 6.84E+06 5.80E+06 1.08E+07 7.99E+06 1.11E+07 7.01E+06 1.72E+07 5.76E+06 8.70E+06 2.08E+06 7.15E+06 1.70E+06 5.09E+06 4.06E+06 4.10E+06 1.33E+07 6.81E+06 4.00E+06 7.51E+06 9.40E+06 6-Deoxyfagomine 5.05E+05 5.71E+05 6.92E+05 4.99E+05 2.00E+06 4.98E+05 2.54E+06 4.16E+05 1.70E+06 7.20E+05 3.84E+06 1.13E+06 5.29E+06 3.61E+05 8.24E+05 9.34E+04 3.64E+05 5.69E+05 5.00E+05 4.78E+06 3.13E+06 3.12E+05 1.49E+06 5.15E+06 4-Methylazetidine-2-Carboxylic acid* 3.03E+06 6.32E+06 9.91E+06 3.66E+06 2.92E+06 5.20E+06 6.58E+06 6.25E+06 4.67E+06 4.23E+06 7.33E+06 3.89E+06 1.43E+07 2.83E+06 2.96E+06 3.70E+06 5.08E+06 4.01E+06 4.42E+06 1.98E+07 9.99E+06 4.13E+06 5.37E+06 2.28E+07 3,7,11-trimethyl-2-oxa-6,10,13-triazatricyclo[7.3.1.05,13]tridecane 5.55E+05 4.25E+05 4.81E+05 6.67E+05 4.95E+05 4.79E+05 4.71E+05 4.79E+05 5.51E+05 5.29E+05 4.80E+05 4.70E+05 4.76E+05 4.69E+05 6.30E+05 5.83E+05 5.74E+05 4.91E+05 5.69E+05 4.56E+05 5.58E+05 5.05E+05 5.41E+05 4.70E+05 Hexadecylsphingosine 9.93E+05 1.09E+06 1.14E+06 1.17E+06 1.14E+06 1.21E+06 1.24E+06 1.27E+06 1.18E+06 1.25E+06 1.30E+06 1.18E+06 1.18E+06 1.26E+06 1.06E+06 1.23E+06 1.05E+06 1.19E+06 1.27E+06 1.33E+06 1.12E+06 1.18E+06 1.01E+06 1.19E+06 Nicotianamine 1.44E+06 2.95E+06 1.77E+07 1.27E+06 3.41E+06 9.50E+06 9.06E+06 1.17E+06 1.23E+07 1.10E+07 1.55E+07 1.19E+07 7.10E+07 1.33E+07 8.44E+06 1.04E+07 2.23E+06 5.82E+06 2.68E+07 2.81E+07 2.66E+07 4.84E+07 2.15E+07 2.16E+07 3-Hydroxy-4H-pyran-4-one 7.82E+05 5.21E+05 4.34E+05 4.78E+05 4.39E+05 5.50E+05 5.41E+05 3.39E+05 4.53E+05 5.70E+05 3.86E+05 4.53E+05 4.67E+05 5.99E+05 5.00E+05 5.09E+05 5.87E+05 5.52E+05 4.81E+05 4.59E+05 4.43E+05 4.76E+05 5.55E+05 4.63E+05 2-Aminopurine 4.07E+06 2.73E+07 1.54E+07 7.08E+06 6.70E+06 1.49E+07 3.79E+07 5.21E+06 1.64E+07 2.10E+07 4.31E+07 6.53E+06 4.23E+06 3.07E+06 8.27E+06 4.13E+05 1.63E+07 8.26E+05 7.50E+06 1.47E+07 1.13E+07 9.22E+06 5.54E+06 1.82E+07 Virgatic acid 5.53E+05 2.07E+06 1.79E+07 2.95E+06 6.87E+06 1.64E+07 3.89E+07 1.80E+07 1.65E+07 4.47E+07 1.44E+07 2.73E+07 6.23E+06 7.65E+06 6.47E+06 1.43E+07 1.24E+07 7.99E+06 2.58E+07 1.34E+07 3.41E+06 3.88E+06 1.21E+07 1.47E+06 2-Aminotetradecan-1-ol* 3.20E+06 3.55E+06 3.51E+06 4.23E+06 4.00E+06 4.28E+06 4.13E+06 3.92E+06 3.94E+06 3.46E+06 3.37E+06 3.49E+06 3.11E+06 4.31E+06 4.42E+06 3.88E+06 4.01E+06 3.46E+06 3.97E+06 3.94E+06 3.75E+06 4.03E+06 3.50E+06 3.68E+06 9-Alpha-Ribofuranosyladenine* 1.53E+06 1.06E+07 7.11E+06 3.20E+06 2.87E+06 6.40E+06 1.54E+07 1.99E+06 6.50E+06 8.36E+06 1.89E+07 2.82E+06 1.48E+06 1.04E+06 3.68E+06 1.58E+05 6.40E+06 2.33E+05 3.11E+06 6.28E+06 4.83E+06 4.04E+06 2.90E+06 7.33E+06 Octadecadienamide 1.08E+07 9.60E+06 8.03E+06 9.86E+06 1.17E+07 1.51E+07 1.12E+07 1.05E+07 1.51E+07 1.37E+07 1.22E+07 1.06E+07 1.54E+07 1.56E+07 1.43E+07 2.18E+07 1.42E+07 1.59E+07 1.22E+07 1.19E+07 1.47E+07 1.46E+07 1.36E+07 1.19E+07 15(R)-Hydroxylinoleic Acid 1.94E+05 2.35E+05 6.23E+05 8.86E+04 2.29E+05 1.20E+06 2.73E+05 2.52E+05 1.92E+05 2.28E+05 4.97E+05 3.40E+05 5.74E+05 1.41E+05 2.76E+05 1.53E+06 3.30E+05 1.69E+05 2.66E+05 2.64E+05 1.43E+05 5.45E+04 3.59E+05 2.63E+05 L-Valyl-L-Phenylalanine 9.00E+03 5.05E+05 1.12E+05 6.62E+04 3.13E+04 1.01E+05 9.37E+04 4.82E+04 2.75E+05 6.79E+04 2.01E+05 6.11E+04 9.45E+05 3.26E+04 3.95E+04 7.72E+03 2.14E+05 1.94E+04 1.21E+06 4.22E+05 3.19E+05 5.09E+05 1.43E+06 1.02E+05 2-Aminotetradecane-1,5,13-triol 7.15E+07 8.68E+07 7.69E+07 9.20E+07 7.38E+07 8.26E+07 8.69E+07 8.38E+07 9.16E+07 9.60E+07 8.70E+07 8.16E+07 5.65E+07 9.04E+07 8.94E+07 9.69E+07 7.61E+07 8.79E+07 8.75E+07 8.24E+07 1.00E+08 8.60E+07 7.64E+07 7.83E+07 Val-Val 1.84E+06 1.89E+06 6.47E+05 5.64E+05 1.91E+06 1.05E+06 1.74E+06 9.89E+05 1.19E+06 1.51E+06 1.36E+06 2.68E+06 1.20E+06 6.00E+05 5.78E+05 1.12E+06 1.70E+06 1.42E+06 6.49E+05 2.02E+06 2.09E+06 9.68E+05 7.46E+05 2.05E+06 1,4-Benzodioxin-6-propanol 1.30E+07 1.08E+07 1.24E+07 1.28E+07 1.00E+07 1.02E+07 8.58E+06 1.13E+07 1.20E+07 7.25E+06 1.03E+07 1.06E+07 1.34E+07 5.26E+06 1.23E+07 4.23E+06 1.12E+07 1.12E+07 1.08E+07 1.13E+07 9.82E+06 1.02E+07 1.11E+07 1.36E+07 O-Acetylserine 1.39E+06 1.04E+06 2.67E+06 1.43E+06 1.11E+06 1.43E+06 1.04E+06 1.48E+06 1.62E+06 8.73E+05 1.75E+06 1.33E+06 1.02E+06 8.08E+05 1.70E+06 1.07E+06 8.84E+05 1.23E+06 9.13E+05 1.73E+06 1.27E+06 7.44E+05 8.07E+05 1.03E+06 7-oxo-11-Dodecenoic acid 6.73E+04 2.26E+05 1.95E+05 2.94E+05 1.04E+05 2.44E+05 1.15E+04 4.75E+04 8.11E+04 6.54E+04 7.16E+04 1.18E+05 1.90E+05 5.64E+04 2.40E+05 1.66E+05 1.66E+05 4.45E+04 2.56E+05 1.09E+05 8.51E+04 2.27E+05 4.09E+05 1.37E+05 Otobaphenol* 1.93E+05 1.97E+05 1.25E+05 1.87E+05 1.11E+06 3.21E+05 7.70E+06 1.62E+07 7.48E+05 4.35E+06 3.77E+05 1.95E+06 6.68E+04 8.98E+04 1.06E+05 2.87E+04 5.23E+05 3.48E+04 1.20E+06 5.22E+05 1.91E+04 3.36E+04 2.49E+06 1.55E+03 3-(Cyclohexen-1-yl)-2-hydroxy-4a,5-dimethyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one* 7.08E+06 4.11E+06 1.33E+07 1.91E+06 6.51E+06 1.34E+07 5.27E+06 1.53E+07 6.32E+06 1.49E+06 6.92E+06 6.69E+06 1.07E+07 2.71E+05 3.60E+06 8.13E+06 3.00E+06 2.09E+06 3.55E+06 5.24E+06 2.58E+06 2.13E+06 5.51E+06 2.01E+07 L-Phenylalanine 1.73E+07 1.37E+08 4.22E+07 7.70E+07 2.13E+07 9.56E+06 2.21E+07 5.08E+07 6.30E+07 1.22E+07 3.08E+07 3.81E+07 1.10E+08 5.17E+06 3.40E+07 2.13E+06 1.44E+08 1.16E+07 5.51E+07 1.42E+08 8.91E+07 4.98E+07 9.71E+07 1.18E+08 3-O-Acetylnarcissidine 8.34E+03 3.49E+05 1.10E+06 2.30E+05 3.78E+05 7.69E+05 2.98E+06 2.69E+06 5.58E+05 1.74E+06 3.67E+06 5.80E+05 2.59E+06 2.92E+05 1.26E+05 6.76E+05 4.66E+06 1.77E+05 3.30E+06 2.98E+06 5.19E+05 1.18E+05 1.90E+06 1.28E+06 2-Aminohexadecane-1,4-diol* 1.80E+07 2.17E+07 2.10E+07 2.10E+07 2.07E+07 2.19E+07 2.22E+07 2.16E+07 2.21E+07 2.28E+07 2.18E+07 2.13E+07 1.67E+07 2.23E+07 2.33E+07 2.34E+07 1.95E+07 1.99E+07 2.15E+07 2.17E+07 2.18E+07 2.03E+07 2.06E+07 2.20E+07 LysoPC 18:2 2.60E+07 1.77E+07 2.68E+07 3.64E+07 2.17E+07 1.15E+07 2.07E+07 1.49E+07 1.60E+07 2.52E+07 3.07E+07 3.40E+07 1.02E+07 1.76E+07 1.94E+07 2.80E+07 4.71E+07 3.36E+07 3.00E+07 2.34E+07 6.60E+06 1.49E+07 1.82E+07 1.17E+07 L-Methionine Sulfoxide 9.19E+04 1.48E+05 1.17E+05 9.32E+04 1.10E+05 1.73E+05 3.05E+05 1.15E+05 9.88E+04 1.19E+05 2.39E+05 8.53E+04 2.98E+05 8.61E+04 1.02E+05 5.82E+04 1.52E+05 1.30E+05 1.48E+05 1.15E+05 6.85E+05 1.59E+05 1.84E+05 1.71E+05 Ile-Asn 9.04E+04 1.15E+06 1.90E+05 1.41E+05 1.78E+05 1.56E+05 1.49E+05 6.70E+04 4.79E+05 1.31E+05 1.70E+05 1.62E+05 6.39E+05 9.53E+04 1.56E+05 6.02E+04 2.35E+05 1.08E+05 8.26E+05 3.28E+05 2.69E+05 2.92E+05 1.30E+06 1.32E+05 Procurcumenol 2.14E+05 6.70E+04 1.23E+05 5.55E+04 4.59E+04 9.94E+04 1.20E+05 2.39E+05 9.55E+04 1.32E+05 3.04E+05 4.79E+05 1.79E+05 2.33E+05 1.61E+05 3.11E+05 2.71E+05 2.21E+05 3.96E+05 8.29E+06 1.66E+05 5.30E+04 7.62E+04 1.43E+05 cedrusinin 3.94E+06 9.50E+06 3.94E+06 5.88E+06 1.53E+07 7.78E+06 1.63E+06 2.97E+06 3.55E+06 1.64E+06 1.04E+07 1.49E+07 2.68E+06 1.19E+06 2.40E+06 4.91E+06 3.53E+06 2.13E+06 2.48E+06 3.88E+05 3.63E+06 2.58E+06 1.64E+06 2.16E+05 2-Amino-3-methoxybenzoic acid 3.09E+05 9.24E+04 3.01E+05 1.75E+05 1.55E+05 3.71E+05 2.70E+05 1.69E+05 1.21E+05 2.78E+05 3.83E+05 2.32E+05 5.26E+05 2.75E+05 1.55E+05 4.14E+05 1.63E+05 1.49E+05 1.89E+05 4.72E+05 2.83E+05 1.91E+05 3.50E+05 1.53E+05 L-Proline* 6.15E+06 1.37E+07 2.30E+07 7.62E+06 6.29E+06 1.01E+07 1.48E+07 1.42E+07 9.53E+06 7.74E+06 1.61E+07 8.13E+06 2.87E+07 6.80E+06 6.24E+06 7.84E+06 1.09E+07 8.31E+06 8.52E+06 4.09E+07 1.99E+07 6.64E+06 9.43E+06 4.73E+07 Lauramine oxide 6.26E+06 7.18E+06 7.62E+06 8.72E+06 8.22E+06 8.28E+06 8.07E+06 7.77E+06 7.77E+06 7.55E+06 7.09E+06 7.31E+06 6.89E+06 8.77E+06 8.90E+06 8.11E+06 8.34E+06 7.51E+06 7.61E+06 7.88E+06 7.21E+06 8.12E+06 7.37E+06 7.02E+06 (3S)-1,3-dihydroxy-2,3,3a,4-tetrahydropyrrolo[2,1-b]quinazolin-9(1H)-one 1.03E+06 1.94E+06 2.82E+06 1.07E+06 1.94E+06 1.86E+06 2.50E+06 2.49E+06 2.33E+06 2.57E+06 1.65E+06 2.29E+06 2.66E+06 6.83E+05 2.59E+06 7.80E+05 1.93E+06 3.67E+06 6.04E+05 3.00E+06 1.64E+06 1.41E+06 2.12E+06 1.34E+06 Phenylethanolamine 1.17E+04 1.13E+05 1.67E+05 4.19E+04 9.60E+04 1.69E+05 2.03E+05 1.49E+05 7.83E+04 1.99E+05 2.85E+05 3.41E+05 1.09E+05 1.14E+06 2.72E+05 9.67E+05 6.72E+05 4.06E+05 1.17E+06 3.58E+05 1.55E+05 3.16E+04 1.74E+05 4.70E+04 L-Glutamine 5.04E+05 6.35E+05 6.38E+05 1.46E+05 7.80E+05 3.77E+05 2.42E+06 9.86E+05 6.54E+05 7.70E+05 7.62E+05 7.32E+05 1.84E+06 6.87E+04 1.20E+05 3.77E+04 4.14E+05 2.76E+06 1.48E+05 3.14E+06 2.73E+06 1.13E+06 1.38E+06 2.15E+06 7,8-Dihydrofurocoumarin 2.80E+04 3.80E+04 4.35E+04 1.51E+04 2.01E+04 4.69E+04 3.32E+04 2.66E+04 3.89E+04 3.29E+04 1.76E+05 1.65E+05 8.97E+04 6.42E+05 7.38E+04 8.09E+04 1.77E+05 1.39E+05 1.50E+05 8.89E+06 9.44E+04 2.97E+04 5.84E+04 1.45E+04 3-Dehydrosphinganine 2.32E+04 2.29E+04 2.73E+04 1.44E+04 2.88E+04 1.33E+05 1.58E+04 1.63E+04 1.92E+04 2.29E+04 2.55E+04 2.59E+04 1.62E+05 3.18E+04 1.13E+04 4.63E+04 8.50E+03 2.11E+04 7.62E+04 3.39E+04 9.38E+05 4.35E+05 3.21E+04 5.31E+04 2-Aminohexadecane-1,5,15-triol 1.14E+07 1.22E+07 1.09E+07 1.32E+07 1.20E+07 1.21E+07 1.14E+07 1.16E+07 1.10E+07 1.02E+07 1.03E+07 1.09E+07 8.82E+06 1.18E+07 1.18E+07 1.19E+07 1.07E+07 1.13E+07 1.27E+07 1.18E+07 1.10E+07 1.21E+07 1.05E+07 1.16E+07 9β-hydroxyeudesma-4,11(13)-dien-12-al 1.27E+05 3.67E+04 1.13E+05 2.26E+05 1.31E+05 1.02E+05 1.68E+05 1.52E+05 8.81E+04 2.25E+05 2.54E+05 1.76E+05 9.22E+04 1.51E+05 7.59E+04 1.86E+05 1.92E+05 6.70E+04 1.55E+05 8.28E+06 9.60E+04 3.98E+04 9.06E+04 3.89E+04 5-hydroxy-6,7-dimethoxy-2-[2-(4'-methoxyphenyl)ethyl]chromone 9.29E+06 1.76E+07 1.30E+07 1.69E+07 1.19E+07 1.05E+07 6.85E+06 8.91E+06 1.17E+07 8.94E+06 9.45E+06 7.76E+06 2.01E+07 6.63E+06 1.59E+07 7.03E+06 1.52E+07 1.07E+07 1.28E+07 1.52E+07 1.34E+07 1.52E+07 8.17E+06 1.71E+07 Cubebin Dimethyl Ether 2.55E+04 4.21E+04 3.22E+04 6.28E+04 4.47E+04 2.31E+04 1.05E+05 3.24E+05 1.84E+04 7.51E+04 3.87E+04 2.81E+05 2.79E+05 7.74E+04 2.99E+04 9.31E+04 1.66E+05 1.85E+04 9.59E+05 2.15E+04 2.56E+04 9.46E+03 3.97E+05 6.61E+03 balanophon n 6.73E+06 1.65E+07 1.22E+07 5.10E+06 2.30E+07 1.83E+07 1.01E+07 1.53E+07 1.72E+07 6.55E+06 1.66E+07 2.12E+07 6.98E+06 7.02E+06 5.07E+06 3.99E+06 1.89E+07 6.26E+06 1.73E+07 1.91E+06 3.89E+06 1.80E+07 1.48E+07 1.85E+06 Ser-Lys 3.04E+05 4.57E+05 3.81E+05 2.31E+05 2.97E+05 2.90E+05 3.92E+05 2.50E+05 3.38E+05 2.76E+05 3.77E+05 3.37E+05 4.46E+05 3.21E+05 3.99E+05 3.02E+05 4.24E+05 4.32E+05 5.66E+05 4.15E+05 5.24E+05 3.64E+05 6.27E+05 3.61E+05 3-Chloroaniline 8.96E+05 8.46E+06 3.91E+06 2.94E+07 1.05E+07 6.53E+05 7.88E+05 1.31E+07 1.31E+07 7.88E+05 9.45E+05 2.97E+06 5.28E+05 3.29E+06 1.75E+07 1.45E+06 9.28E+06 9.07E+06 1.28E+06 7.42E+05 8.50E+05 6.13E+06 6.44E+06 9.38E+05 (S)-2,3-dihydroxypropyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate 8.56E+05 2.02E+06 1.24E+06 1.28E+05 1.73E+06 1.90E+06 4.94E+06 7.51E+05 2.51E+06 3.50E+06 1.53E+06 1.45E+06 1.79E+06 2.12E+05 3.86E+05 5.29E+05 1.19E+06 1.29E+06 9.40E+05 1.28E+06 6.41E+05 5.66E+05 5.98E+05 1.07E+06 LysoPE 18:1* 4.21E+06 2.07E+06 2.76E+06 4.72E+06 5.05E+06 2.35E+06 1.75E+06 4.57E+06 2.81E+06 1.45E+06 2.02E+06 3.47E+06 1.20E+06 1.90E+05 3.28E+06 1.04E+06 4.74E+06 3.74E+06 1.33E+06 1.91E+06 7.47E+05 2.04E+06 1.52E+06 2.62E+06 2-Aminoisobutyric acid* 2.32E+07 2.23E+07 2.08E+07 1.69E+07 2.66E+07 1.75E+07 1.99E+07 2.10E+07 2.50E+07 1.82E+07 2.25E+07 2.63E+07 2.18E+07 5.59E+06 1.98E+07 5.96E+06 1.46E+07 1.82E+07 1.71E+07 2.25E+07 1.47E+07 2.47E+07 2.47E+07 2.68E+07 Dehydrodiisoeugenol* 2.13E+05 2.14E+05 1.48E+05 2.03E+05 1.18E+06 3.10E+05 7.52E+06 1.67E+07 7.91E+05 4.24E+06 3.73E+05 2.06E+06 4.55E+04 9.58E+04 8.67E+04 1.68E+04 5.14E+05 3.00E+04 1.22E+06 5.85E+05 1.29E+04 3.35E+04 2.55E+06 3.48E+03 Lys-Tyr 8.38E+05 1.10E+06 8.27E+05 5.51E+05 1.10E+06 7.82E+05 7.69E+05 7.90E+05 1.09E+06 6.24E+05 8.62E+05 1.14E+06 8.99E+05 3.25E+05 6.25E+05 4.27E+05 5.48E+05 7.19E+05 7.98E+05 6.02E+05 9.07E+05 6.81E+05 1.18E+06 7.91E+05 DL-Methionine 3.58E+05 7.08E+05 5.73E+05 1.62E+05 4.07E+05 1.41E+05 3.39E+05 3.48E+05 5.33E+05 1.95E+05 1.30E+06 4.39E+05 1.42E+06 8.33E+04 2.05E+05 2.68E+04 3.70E+05 3.84E+05 6.04E+05 4.32E+05 1.10E+06 3.73E+05 1.52E+06 5.71E+05 Abu-Val-OH 4.94E+07 4.86E+07 4.51E+07 3.47E+07 3.11E+07 2.67E+07 3.03E+07 3.45E+07 4.13E+07 3.53E+07 1.46E+07 4.61E+07 5.47E+07 1.49E+07 5.65E+07 1.23E+07 4.31E+07 4.28E+07 3.37E+07 3.95E+07 2.19E+07 3.21E+07 2.94E+07 7.74E+07 Piperonylic acid 4.07E+07 2.15E+07 3.28E+07 2.46E+07 1.95E+07 1.57E+07 1.11E+07 2.83E+07 3.03E+07 8.83E+06 1.54E+07 1.47E+07 1.69E+07 3.08E+06 1.86E+07 9.66E+06 2.02E+07 3.37E+07 2.63E+07 1.04E+07 1.36E+07 1.38E+07 5.56E+06 1.30E+07 LysoPC 16:1(2n isomer)* 4.44E+05 2.49E+05 3.13E+05 4.20E+05 5.21E+05 5.16E+05 1.80E+06 8.68E+05 4.57E+05 9.29E+05 5.59E+05 5.68E+05 1.93E+05 5.50E+05 3.84E+05 2.82E+05 4.77E+05 2.85E+05 9.13E+05 3.10E+05 9.67E+04 3.05E+05 3.39E+05 2.08E+05 N-(beta-D-Glucosyl)nicotinate 3.57E+05 3.34E+04 1.85E+05 3.48E+04 9.32E+04 2.28E+05 5.48E+05 7.76E+04 1.21E+05 4.67E+05 2.62E+05 9.46E+05 1.13E+05 2.53E+05 7.77E+04 9.51E+05 1.03E+05 1.07E+06 1.25E+05 1.04E+06 5.07E+04 1.02E+05 7.59E+04 3.09E+04 Ala-His 3.23E+05 3.00E+05 2.49E+05 1.83E+05 2.89E+05 1.76E+05 2.81E+05 2.29E+05 3.57E+05 2.12E+05 1.88E+05 4.52E+05 2.22E+05 1.22E+05 2.51E+05 1.76E+05 1.68E+05 2.69E+05 1.56E+05 2.87E+05 1.58E+05 1.48E+05 2.64E+05 1.82E+05 Asp-Lys 7.69E+05 1.05E+06 8.87E+05 8.09E+05 9.25E+05 5.11E+05 1.15E+06 5.72E+05 1.30E+06 6.21E+05 1.14E+06 1.13E+06 1.12E+06 5.37E+05 8.74E+05 3.40E+05 6.48E+05 8.62E+05 4.89E+05 2.62E+06 1.32E+06 8.44E+05 1.53E+06 1.10E+06 L-Valyl-L-Leucine 4.04E+04 1.00E+06 1.68E+05 6.00E+04 8.64E+04 1.59E+05 2.17E+05 4.30E+04 5.20E+05 1.30E+05 2.72E+05 1.29E+05 1.55E+06 9.29E+04 1.22E+05 1.52E+04 3.19E+05 4.57E+04 1.77E+06 6.85E+05 4.08E+05 4.94E+05 9.50E+05 1.57E+05 Leu-Abu-OH 2.63E+06 2.06E+06 1.21E+07 3.34E+05 1.54E+06 1.25E+06 6.09E+06 2.90E+06 2.15E+06 5.52E+06 1.88E+06 3.05E+06 2.46E+06 1.58E+06 9.27E+05 3.46E+06 2.10E+06 1.62E+06 9.12E+06 3.54E+06 3.22E+06 3.44E+06 3.96E+06 3.23E+06 Cinnamic acid 1.48E+05 2.38E+05 2.13E+05 1.48E+05 2.96E+05 1.15E+06 1.07E+06 1.28E+06 1.30E+05 9.75E+05 3.00E+05 5.15E+05 3.68E+05 7.04E+05 4.92E+05 8.92E+05 4.12E+05 2.31E+05 1.40E+06 4.93E+05 1.68E+05 1.24E+05 1.15E+06 1.26E+05 2'-Deoxyinosine-5'-monophosphate 5.39E+06 5.57E+06 5.09E+06 5.05E+06 4.37E+06 4.78E+06 7.21E+06 7.28E+06 7.89E+06 8.66E+06 8.12E+06 8.28E+06 7.14E+06 9.17E+06 8.15E+06 9.99E+06 1.01E+07 6.59E+06 4.61E+06 8.26E+06 6.50E+06 4.72E+06 6.14E+06 8.30E+06 LysoPC 18:3(2n isomer) 8.01E+06 4.56E+06 7.34E+06 3.33E+06 8.24E+06 4.16E+06 6.68E+07 1.89E+07 1.19E+07 5.03E+07 1.24E+07 2.18E+07 5.91E+06 1.78E+07 5.81E+06 1.11E+07 1.77E+07 1.59E+07 1.95E+07 5.25E+06 1.74E+06 2.80E+06 2.81E+06 4.37E+06 Fragransin B3 5.17E+04 4.68E+05 2.59E+05 2.91E+05 4.44E+05 1.97E+05 7.33E+05 1.16E+06 8.02E+04 6.01E+05 2.20E+05 1.22E+06 4.15E+05 2.36E+05 1.15E+05 9.67E+04 6.76E+05 6.01E+04 1.49E+06 2.38E+05 1.06E+05 3.44E+04 9.46E+05 1.31E+03 Peucedanol 7-O-glucoside 3.83E+06 2.73E+06 5.09E+06 2.34E+06 5.03E+06 4.51E+06 2.28E+06 9.58E+06 6.09E+06 4.22E+06 5.15E+06 6.57E+06 6.93E+05 8.31E+05 2.20E+06 1.66E+06 1.90E+06 9.75E+06 4.67E+05 7.60E+05 8.52E+05 3.30E+05 7.27E+05 2.98E+05 Machilusol A* 8.52E+04 1.70E+05 1.70E+05 1.67E+05 3.74E+05 2.65E+05 1.47E+06 3.61E+06 1.94E+05 8.57E+05 2.37E+05 9.32E+05 2.72E+05 1.43E+05 9.23E+04 1.62E+05 3.84E+05 2.74E+04 1.31E+06 4.16E+05 7.82E+04 1.29E+05 2.53E+06 2.35E+04 δ-Guanidinovaleric acid 4.64E+04 1.53E+05 3.64E+05 1.85E+05 2.05E+05 1.32E+05 5.71E+05 5.81E+05 9.72E+04 7.22E+05 1.86E+06 4.42E+05 4.73E+05 7.42E+06 3.77E+05 2.83E+06 1.25E+06 6.76E+05 8.09E+05 1.18E+06 6.68E+04 2.89E+04 4.09E+05 3.66E+04 Guanosine 2.31E+06 1.01E+07 8.77E+06 3.89E+06 3.08E+06 8.83E+06 1.38E+07 3.98E+06 6.47E+06 7.33E+06 1.56E+07 6.01E+06 2.77E+07 4.20E+06 2.47E+06 8.16E+05 7.04E+06 1.44E+06 1.55E+07 1.97E+07 1.89E+07 1.36E+07 1.46E+07 2.85E+07 Adenosine* 1.58E+06 1.02E+07 7.24E+06 3.19E+06 3.00E+06 6.91E+06 1.66E+07 2.14E+06 6.70E+06 8.94E+06 1.75E+07 3.24E+06 1.47E+06 1.14E+06 4.03E+06 1.55E+05 6.90E+06 2.89E+05 3.08E+06 6.09E+06 4.92E+06 3.95E+06 2.15E+06 7.88E+06 14-Amino-15-hydroxy-11-methylpentadecanoic acid 3.51E+06 1.17E+07 1.20E+07 6.27E+06 5.02E+06 4.08E+06 6.57E+06 1.22E+07 5.27E+06 5.01E+06 9.95E+06 1.07E+07 1.10E+07 5.40E+06 5.08E+06 5.36E+06 4.33E+06 1.23E+07 5.66E+06 5.43E+06 5.19E+06 1.39E+07 1.11E+07 4.40E+06 Lys-Thr 2.92E+05 4.57E+05 2.79E+05 2.03E+05 2.25E+05 2.42E+05 2.76E+05 2.75E+05 3.43E+05 2.59E+05 2.84E+05 3.01E+05 3.77E+05 1.79E+05 2.68E+05 1.65E+05 2.87E+05 2.87E+05 3.45E+05 2.95E+05 3.19E+05 3.30E+05 5.30E+05 2.60E+05 Oxaceprol 3.40E+05 3.37E+05 3.11E+05 2.42E+05 3.90E+05 5.17E+05 4.77E+05 2.77E+05 4.28E+05 5.31E+05 7.18E+05 6.25E+05 8.39E+05 8.02E+05 3.65E+05 5.30E+05 4.41E+05 4.14E+05 8.56E+05 6.10E+05 4.14E+05 5.15E+05 5.50E+05 3.53E+05 N-Acetyl-D-galactosamine 4.00E+05 3.94E+05 3.66E+05 2.93E+05 4.19E+05 5.01E+05 4.75E+05 3.95E+05 5.69E+05 3.95E+05 4.71E+05 6.01E+05 5.68E+05 3.59E+05 5.26E+05 4.46E+05 3.88E+05 4.51E+05 7.40E+05 4.57E+05 4.55E+05 3.10E+05 4.36E+05 4.32E+05 (2-Oxo-5-methoxyindoline-1-yl)carbamic acidmethylester 4.20E+05 2.42E+05 7.27E+05 4.86E+05 5.61E+05 3.09E+05 3.23E+05 6.39E+05 6.10E+05 3.67E+05 3.78E+05 5.95E+05 2.43E+05 1.91E+05 2.61E+05 4.26E+05 1.62E+05 5.73E+05 2.21E+05 6.00E+04 2.73E+05 2.96E+05 1.75E+05 1.44E+05 Prolylproline 5.78E+04 8.92E+04 6.58E+04 8.93E+04 5.56E+04 7.13E+04 5.34E+04 6.45E+04 7.01E+04 7.48E+04 1.13E+05 6.27E+04 5.66E+04 5.94E+04 7.66E+04 5.35E+04 7.25E+04 2.33E+04 8.73E+04 7.68E+04 6.74E+04 6.59E+04 1.43E+05 1.27E+05 2-Amino-7-methyltridecan-1-ol* 3.27E+06 3.99E+06 3.99E+06 4.77E+06 4.15E+06 3.95E+06 4.83E+06 4.37E+06 4.99E+06 3.72E+06 3.55E+06 3.71E+06 3.57E+06 4.38E+06 5.02E+06 4.25E+06 4.28E+06 4.12E+06 4.10E+06 4.45E+06 4.13E+06 4.20E+06 3.94E+06 4.20E+06 Horsfieldin* 1.16E+06 2.48E+06 6.25E+06 2.19E+06 2.43E+06 4.85E+06 5.63E+06 7.62E+06 2.34E+06 6.38E+06 7.70E+06 5.60E+06 1.02E+07 2.33E+07 4.45E+06 1.16E+07 1.42E+07 7.76E+06 1.24E+07 3.19E+07 1.27E+07 5.95E+06 1.02E+07 3.49E+07 Diethanolamine 3.55E+05 8.29E+05 6.38E+05 7.65E+05 7.12E+05 7.29E+05 8.28E+05 6.87E+05 1.01E+06 6.59E+05 1.46E+06 5.30E+05 6.73E+05 3.30E+05 7.51E+05 3.77E+05 4.69E+05 4.00E+05 4.63E+05 1.07E+06 6.70E+05 3.82E+05 6.18E+05 8.55E+05 Phenylacetaldehyde 1.86E+07 1.95E+07 1.90E+07 1.30E+07 1.54E+07 1.41E+07 1.47E+07 1.93E+07 1.93E+07 1.38E+07 1.70E+07 1.77E+07 1.95E+07 1.31E+07 1.61E+07 5.03E+06 1.76E+07 2.03E+07 2.35E+07 1.43E+07 1.48E+07 2.37E+07 2.00E+07 2.71E+07 Acetoxypinoresinol 1.04E+06 1.67E+07 1.54E+07 1.12E+06 3.19E+06 3.07E+07 6.57E+06 8.73E+06 3.89E+06 6.08E+06 7.22E+06 2.07E+06 8.26E+06 4.25E+07 1.05E+06 2.27E+06 6.63E+06 8.85E+05 9.46E+06 5.17E+06 3.93E+06 5.98E+06 3.16E+06 3.42E+07 Coccilignan A* 1.57E+05 9.95E+05 5.17E+05 6.66E+05 8.63E+05 4.11E+05 1.57E+06 2.45E+06 1.36E+05 1.16E+06 4.44E+05 2.61E+06 8.79E+05 3.74E+05 1.95E+05 1.92E+05 1.38E+06 7.21E+04 2.56E+06 4.11E+05 2.38E+05 3.41E+04 2.11E+06 2.58E+04 24-Hydroxy-3-oxooleana-11,13(18)-dien-28-oic acid 4.10E+05 4.97E+03 3.04E+04 7.39E+03 2.39E+05 6.44E+04 1.16E+06 8.59E+04 1.65E+05 5.99E+05 1.03E+06 1.01E+06 4.60E+05 1.31E+06 1.49E+05 1.21E+06 5.40E+05 7.89E+05 2.93E+06 1.01E+05 2.58E+05 1.05E+04 9.53E+04 1.57E+04 linoleoyl ethanolamine 1.12E+05 2.11E+05 1.56E+05 1.32E+05 1.86E+05 2.21E+05 1.83E+05 5.06E+04 1.45E+05 1.22E+05 3.21E+05 2.83E+05 9.84E+05 1.24E+05 1.86E+05 1.43E+05 2.60E+05 3.20E+05 6.84E+05 7.11E+05 4.73E+05 3.77E+05 1.21E+06 8.42E+04 Dihydrodehydrodiconiferyl alcohol 1.48E+05 2.77E+05 6.07E+05 1.36E+05 3.32E+05 9.12E+05 4.91E+05 2.82E+05 1.71E+05 2.74E+05 9.13E+05 2.99E+05 2.02E+05 7.42E+05 1.71E+05 1.78E+06 1.86E+06 2.81E+05 1.60E+05 1.59E+05 9.10E+04 1.26E+05 3.25E+05 6.00E+04 (2S)-5,7-dimethoxy-3',4'-methylenedioxyflavanone 5.87E+04 7.68E+04 3.74E+05 8.09E+04 9.69E+04 4.25E+05 3.31E+05 3.48E+04 4.95E+04 5.07E+05 1.59E+05 1.20E+05 4.24E+05 1.82E+05 1.14E+05 7.72E+05 8.80E+04 1.16E+05 1.57E+05 2.14E+05 2.50E+05 1.94E+05 3.90E+05 9.24E+04 3-Ethyl-7-hydroxyphthalide 1.76E+07 5.05E+07 2.46E+07 3.34E+07 4.14E+07 4.20E+07 2.59E+07 8.92E+06 6.93E+06 2.50E+07 3.85E+07 4.57E+07 3.93E+07 1.11E+07 3.68E+07 2.57E+07 5.44E+07 1.47E+07 2.09E+07 3.90E+07 2.78E+07 2.37E+07 3.34E+07 6.59E+07 LysoPC 18:0 1.13E+06 9.69E+05 5.62E+06 9.05E+05 1.56E+06 3.85E+06 3.01E+06 9.52E+05 6.52E+05 7.90E+06 2.56E+06 2.29E+06 5.69E+06 2.86E+06 1.22E+06 5.59E+07 3.28E+06 1.50E+06 2.55E+06 2.77E+06 1.14E+06 9.18E+05 1.10E+06 2.64E+06 Isorhamnetin-3-O-(2''-O-xylosyl)glucoside 7.96E+04 7.02E+04 6.88E+05 4.83E+04 3.22E+05 1.49E+06 7.64E+05 3.29E+05 2.94E+05 9.73E+05 1.64E+06 4.24E+05 1.70E+06 6.39E+05 7.14E+04 6.93E+05 8.19E+04 8.41E+04 1.15E+06 2.47E+05 9.32E+05 2.37E+05 1.66E+05 2.08E+05 Chrysin-7-O-glucoside 1.95E+05 1.96E+05 1.30E+05 4.13E+04 1.61E+05 3.87E+05 7.84E+04 1.77E+05 8.03E+04 1.06E+05 3.54E+05 6.60E+04 4.88E+05 1.23E+05 7.11E+04 1.82E+04 7.18E+04 1.21E+05 4.32E+05 3.05E+05 1.65E+05 3.50E+05 2.47E+05 8.27E+05 1-(2-Amino-4-methylpentanoyl)pyrrolidine-2-carboxylic acid 1.43E+05 3.93E+05 2.02E+05 2.62E+05 2.16E+05 2.36E+05 3.39E+05 3.64E+05 6.44E+05 2.27E+05 3.29E+05 1.16E+05 1.11E+06 7.44E+04 2.35E+05 1.22E+05 1.79E+05 2.65E+05 1.15E+06 5.05E+05 5.04E+05 2.88E+05 4.35E+06 1.57E+05 LysoPC 16:1* 6.82E+05 4.38E+05 4.88E+05 8.54E+05 6.36E+05 3.81E+05 7.38E+05 8.73E+05 6.44E+05 7.29E+05 6.29E+05 5.36E+05 1.22E+05 1.14E+05 4.57E+05 2.28E+05 1.07E+06 5.95E+05 3.50E+05 5.60E+05 8.47E+04 2.19E+05 2.58E+05 2.33E+05 LysoPC 18:2(2n isomer) 3.11E+07 2.40E+07 3.03E+07 2.51E+07 3.07E+07 1.84E+07 5.47E+07 2.38E+07 2.64E+07 5.09E+07 1.99E+07 2.91E+07 1.60E+07 3.99E+07 1.71E+07 2.35E+07 4.35E+07 2.34E+07 4.72E+07 2.34E+07 9.99E+06 2.03E+07 3.02E+07 1.17E+07 LysoPC 17:0(2n isomer)* 1.78E+05 2.40E+05 2.35E+05 1.06E+05 1.30E+05 4.48E+05 3.43E+05 1.81E+05 1.76E+05 3.90E+05 4.12E+05 3.14E+05 5.06E+05 5.04E+05 2.49E+05 3.17E+06 2.83E+05 2.32E+05 3.46E+05 2.64E+05 2.56E+05 2.01E+05 2.22E+05 2.83E+05 trans-1,2-dihydrodehydroguaiaretic acid 2.19E+05 3.07E+04 7.29E+04 6.17E+04 2.61E+05 8.43E+04 8.55E+05 8.11E+05 3.16E+05 6.34E+05 1.64E+05 2.52E+05 9.47E+04 1.03E+05 4.08E+04 1.40E+04 4.59E+04 4.70E+04 8.24E+04 1.00E+05 8.20E+04 1.84E+04 1.46E+05 6.57E+04 4,6-dimethoxy-2-methoxyphenyl-1-O-beta-D-glucopyranoside 3.86E+05 3.48E+05 4.27E+05 2.41E+05 3.33E+05 1.53E+05 1.07E+05 3.13E+05 1.03E+05 1.64E+05 1.16E+05 3.16E+05 1.37E+05 1.82E+05 2.60E+05 2.02E+05 2.82E+05 4.85E+05 2.43E+05 4.24E+04 1.56E+05 2.82E+05 1.25E+05 7.38E+04 Gln-Gly 4.62E+06 4.05E+06 3.58E+06 2.82E+06 6.98E+06 5.92E+06 3.50E+06 3.62E+06 4.52E+06 3.00E+06 5.17E+06 6.33E+06 3.25E+06 2.10E+06 4.99E+06 3.19E+06 3.53E+06 4.62E+06 3.65E+06 4.59E+06 2.61E+06 3.32E+06 5.04E+06 5.01E+06 Creatinine 5.54E+05 5.10E+05 5.14E+05 5.74E+05 4.38E+05 3.27E+05 5.30E+05 6.03E+05 5.27E+05 4.69E+05 4.18E+05 5.07E+05 5.27E+05 3.94E+05 5.18E+05 3.60E+05 5.23E+05 6.62E+05 6.74E+05 4.52E+05 4.78E+05 5.13E+05 4.74E+05 5.83E+05 N-Oleoylethanolamine 3.78E+03 5.29E+03 9.12E+03 4.18E+03 9.65E+03 1.56E+04 2.69E+04 1.36E+04 2.36E+04 4.01E+04 4.45E+04 3.39E+04 1.44E+05 6.74E+04 2.38E+04 1.26E+05 2.51E+04 2.08E+04 1.92E+05 7.43E+04 6.01E+04 5.78E+04 1.34E+05 3.18E+04 5'-Deoxy-5'-(methylthio)adenosine 7.02E+06 2.29E+07 2.88E+07 1.20E+07 2.82E+07 2.53E+07 5.09E+07 2.20E+07 2.69E+07 3.63E+07 6.67E+07 3.14E+07 3.42E+07 6.32E+06 1.80E+07 8.56E+06 2.00E+07 1.48E+07 2.07E+07 3.84E+07 1.97E+07 1.40E+07 1.30E+07 8.44E+07 3-hydroxy-1-methylpyrrolidin-2-one* 4.27E+06 8.90E+06 1.48E+07 5.29E+06 4.12E+06 6.82E+06 9.67E+06 9.45E+06 6.43E+06 5.58E+06 1.06E+07 5.30E+06 2.13E+07 4.49E+06 3.94E+06 5.28E+06 7.89E+06 5.22E+06 6.17E+06 2.52E+07 1.42E+07 5.07E+06 6.01E+06 3.28E+07 alpha-hexylcinnamaldehyde 1.39E+05 8.95E+04 1.05E+05 9.20E+04 1.15E+05 1.20E+05 1.27E+05 1.08E+05 1.95E+05 1.57E+05 1.54E+05 2.26E+05 1.50E+05 1.55E+05 1.33E+05 1.45E+05 1.80E+05 1.36E+05 1.89E+05 6.19E+05 1.49E+05 1.64E+05 1.53E+05 1.34E+05 D-Pantothenic Acid* 7.90E+06 3.69E+06 6.80E+06 3.01E+06 4.40E+06 4.36E+06 1.12E+07 2.02E+06 6.34E+06 7.66E+06 1.46E+07 8.01E+06 1.28E+07 4.72E+06 8.73E+06 6.37E+06 4.37E+06 1.39E+07 9.43E+06 1.83E+07 9.99E+06 6.12E+06 1.06E+07 3.91E+06 L-Homocysteine 1.80E+05 3.07E+05 2.32E+05 3.42E+05 2.88E+05 1.05E+05 1.10E+05 2.65E+05 2.08E+05 1.85E+05 2.16E+05 2.85E+05 2.87E+05 1.35E+05 1.98E+05 6.88E+04 1.12E+05 2.56E+05 1.53E+05 3.32E+05 4.09E+05 5.34E+04 2.69E+05 6.85E+05 4,4'-dihydroxy-2'-methoxychalcone 5.47E+06 7.19E+06 6.40E+06 5.23E+06 5.71E+06 4.16E+06 3.03E+06 6.82E+06 6.71E+06 3.47E+06 5.82E+06 6.33E+06 6.21E+06 3.90E+06 5.32E+06 3.52E+05 5.01E+06 8.50E+06 8.82E+06 4.20E+06 5.48E+06 9.30E+06 6.64E+06 1.04E+07 Divanillyltetrahydrofuran 5.25E+06 7.81E+06 6.65E+06 7.10E+06 5.50E+06 4.08E+06 3.66E+06 4.87E+06 5.23E+06 3.93E+06 3.93E+06 4.67E+06 6.47E+06 3.11E+06 7.14E+06 3.36E+06 6.03E+06 5.45E+06 5.30E+06 4.75E+06 5.36E+06 5.51E+06 4.02E+06 4.74E+06 2-Aminooctadecane-1,5,7,17-tetraol 1.15E+06 2.69E+06 2.82E+06 1.83E+06 1.32E+06 1.62E+06 1.79E+06 2.97E+06 1.60E+06 1.79E+06 2.48E+06 2.90E+06 2.88E+06 1.53E+06 1.56E+06 1.88E+06 1.83E+06 2.83E+06 1.90E+06 1.89E+06 1.60E+06 3.13E+06 3.09E+06 1.47E+06 1,8-dimethyl-1,3a,8,8a-tetrahydropyrrolo[2,3-b]indole 1.08E+07 1.29E+07 9.90E+06 1.49E+07 8.38E+06 6.55E+06 4.55E+06 6.89E+06 8.61E+06 3.89E+06 5.95E+06 1.00E+07 6.69E+06 2.08E+06 1.36E+07 3.20E+06 1.09E+07 9.50E+06 4.05E+06 1.07E+07 1.08E+07 2.13E+06 3.08E+06 2.12E+07 2-Methyl-5-acetonyl-7-hydroxychromone glucoside 6.34E+07 4.63E+07 6.04E+07 6.70E+07 5.72E+07 7.55E+07 5.14E+07 6.75E+07 8.00E+07 6.48E+07 7.93E+07 4.96E+07 6.27E+07 4.86E+07 8.01E+07 4.76E+07 6.96E+07 8.33E+07 7.24E+07 7.62E+07 7.18E+07 7.53E+07 7.40E+07 6.39E+07 LysoPC 17:0* 1.26E+05 1.68E+05 1.71E+05 1.03E+05 1.39E+05 3.18E+05 1.82E+05 1.24E+05 1.44E+05 4.20E+05 2.83E+05 2.28E+05 4.69E+05 3.35E+05 1.78E+05 2.45E+06 2.20E+05 1.78E+05 2.87E+05 2.15E+05 1.76E+05 1.23E+05 1.65E+05 2.07E+05 LysoPC 17:1 6.15E+05 3.85E+05 7.31E+05 6.37E+05 4.72E+05 4.07E+05 5.45E+05 2.43E+05 3.38E+05 3.38E+05 5.39E+05 3.35E+05 2.86E+05 1.86E+05 1.55E+05 4.86E+05 5.27E+05 2.74E+05 5.46E+05 5.20E+05 2.38E+05 6.13E+05 1.90E+05 1.84E+05 4-MethoxycinnaMaldehyde 6.07E+05 5.24E+05 5.72E+05 5.75E+05 7.44E+05 6.59E+05 1.08E+06 1.11E+06 6.75E+05 9.03E+05 8.84E+05 8.31E+05 8.26E+05 6.33E+05 5.56E+05 6.04E+05 5.86E+05 6.30E+05 1.03E+06 1.18E+06 1.24E+06 5.05E+05 4.10E+05 4.65E+05 10,11-Dihydroxy-N-(2-hydroxy-2-methylpropyl)-2,6,8-dodecatrienam-Ide 8.77E+05 9.05E+05 5.63E+05 6.90E+05 6.95E+05 8.75E+05 7.83E+05 7.54E+05 1.28E+06 9.16E+05 1.00E+06 5.75E+05 1.08E+06 1.31E+06 1.14E+06 1.87E+06 1.12E+06 1.13E+06 8.64E+05 9.52E+05 1.25E+06 8.47E+05 1.28E+06 7.57E+05 2-Aminotetradecane-1,5,11-triol 1.53E+06 4.60E+06 4.10E+06 2.62E+06 1.97E+06 2.34E+06 2.58E+06 4.89E+06 2.13E+06 2.25E+06 4.27E+06 4.67E+06 4.06E+06 2.15E+06 2.07E+06 2.38E+06 2.42E+06 4.61E+06 2.49E+06 2.78E+06 1.92E+06 5.08E+06 4.83E+06 1.96E+06 Succinyladenosine 4.92E+06 3.82E+06 3.73E+06 4.95E+06 4.23E+06 3.84E+06 1.02E+07 2.89E+06 8.41E+06 7.35E+06 9.72E+06 1.52E+07 2.51E+07 1.05E+07 2.49E+07 7.66E+06 8.55E+06 7.88E+06 2.26E+07 2.01E+07 1.89E+07 6.72E+06 1.43E+07 1.03E+07 Dihydromonotropein methyl ester 1.62E+06 7.98E+05 2.22E+06 1.78E+06 1.89E+06 2.10E+06 5.16E+06 1.93E+06 2.62E+06 5.91E+06 2.25E+06 1.77E+06 6.79E+05 1.99E+05 1.95E+06 1.09E+06 6.83E+05 2.73E+06 3.75E+05 2.47E+05 2.93E+05 4.94E+05 1.87E+05 2.00E+06 3,4,5-trihydroxy-6-(4-octylphenoxy)oxane-2-carboxylic acid 1.90E+05 2.09E+05 1.68E+05 1.82E+05 2.38E+05 2.78E+05 3.16E+05 3.18E+05 4.45E+05 4.86E+05 3.57E+05 3.22E+05 2.76E+05 4.62E+05 3.17E+05 3.23E+05 2.83E+05 3.76E+05 3.69E+05 3.78E+05 3.13E+05 3.31E+05 2.87E+05 3.68E+05 4-Guanidinobutyric acid 1.89E+06 3.59E+06 3.94E+06 1.52E+06 3.27E+06 4.03E+06 4.62E+06 3.73E+06 4.54E+06 3.39E+06 6.50E+06 4.15E+06 3.37E+06 1.44E+06 4.03E+06 1.67E+06 3.23E+06 1.69E+06 2.84E+06 5.90E+06 4.57E+06 8.28E+06 3.53E+06 1.39E+06 2,5-Bis(1,3-benzodioxol-5-yl)-3,4-dimethyloxolane-2,3-diol 2.15E+04 8.42E+04 1.56E+05 6.07E+04 4.65E+04 2.01E+05 1.62E+05 1.66E+05 6.38E+04 1.88E+05 2.41E+05 1.67E+05 2.33E+05 1.16E+06 1.15E+05 7.58E+05 4.67E+05 1.32E+05 2.88E+05 6.54E+05 2.32E+05 5.32E+04 2.73E+05 3.07E+05 Cytidine 5'-monophosphate(Cytidylic acid) 8.61E+05 4.22E+05 7.10E+05 1.88E+05 3.76E+05 2.24E+05 5.42E+05 1.75E+06 1.01E+06 4.12E+05 6.45E+05 4.53E+05 1.93E+05 7.75E+05 3.82E+05 8.19E+05 9.14E+05 3.59E+05 1.67E+05 1.35E+06 2.14E+05 1.14E+05 1.52E+05 5.42E+05 L-Homocitrulline 1.61E+05 2.13E+05 2.64E+05 1.61E+05 3.25E+05 1.92E+05 3.95E+05 2.57E+05 2.21E+05 2.99E+05 4.49E+05 3.50E+05 4.51E+05 1.68E+05 1.84E+05 1.35E+05 1.67E+05 2.24E+05 1.92E+05 4.20E+05 4.67E+05 2.15E+05 2.24E+05 3.40E+05 2,6-Diaminooimelic acid 3.62E+05 3.52E+05 6.20E+05 4.01E+05 5.06E+05 3.41E+05 8.06E+05 3.49E+05 2.70E+05 3.96E+05 3.40E+05 6.02E+05 6.32E+05 4.80E+05 4.20E+05 2.74E+05 2.77E+05 5.34E+05 1.15E+06 5.31E+05 5.14E+05 3.70E+05 9.69E+05 3.84E+05 7-Ethoxy-4-hydroxy-3,4-dihydroisochromen-1-one 1.12E+06 7.92E+05 3.09E+06 8.79E+05 2.05E+06 4.81E+06 2.64E+06 1.21E+06 1.91E+06 2.48E+06 6.23E+06 1.89E+06 3.82E+06 1.79E+07 2.77E+06 9.47E+06 3.92E+06 3.00E+06 1.92E+06 2.45E+06 4.89E+06 2.30E+06 1.69E+06 1.37E+06 8-hydroxyquinoline 9.33E+06 4.19E+06 1.99E+06 4.08E+06 1.01E+07 5.02E+06 3.51E+06 2.70E+06 1.44E+07 3.77E+06 7.64E+06 2.70E+07 1.21E+07 3.28E+05 4.85E+06 4.16E+05 2.03E+06 4.58E+06 9.78E+05 1.65E+07 1.31E+07 8.49E+06 3.09E+06 1.32E+07 4,6-Dihydroxyquinoline 1.04E+07 8.97E+06 1.03E+07 1.18E+07 8.48E+06 6.83E+06 6.40E+06 8.16E+06 9.77E+06 6.23E+06 6.21E+06 8.10E+06 9.68E+06 5.19E+06 1.28E+07 6.91E+06 9.28E+06 9.36E+06 5.73E+06 8.59E+06 7.70E+06 7.26E+06 7.17E+06 1.07E+07 5-Methoxyfurfural* 3.02E+06 2.66E+06 2.92E+06 2.17E+06 2.84E+06 2.86E+06 4.37E+06 3.49E+06 3.43E+06 4.39E+06 2.34E+06 2.69E+06 3.03E+06 1.36E+06 2.78E+06 2.64E+06 2.55E+06 3.18E+06 3.24E+06 2.15E+06 1.52E+06 1.94E+06 3.41E+06 3.38E+06 6-Hydroxy-7-Methoxy-2-[2-(3'-Hydroxy-4'-Methoxyphenyl)Ethyl]Chromone 7.02E+05 1.03E+06 1.14E+06 1.10E+06 3.05E+06 1.94E+06 1.27E+06 1.77E+06 1.04E+06 1.31E+06 1.53E+06 2.09E+06 7.15E+05 1.35E+06 8.80E+05 1.20E+06 9.31E+05 8.45E+05 8.89E+05 5.45E+05 4.28E+05 3.93E+05 1.60E+06 4.75E+05 p-Coumaroylcadaverine 3.37E+05 8.61E+04 1.00E+05 2.44E+05 6.06E+05 6.77E+05 3.77E+05 1.43E+05 1.74E+05 2.67E+05 1.63E+06 4.46E+05 2.49E+05 1.79E+05 9.88E+05 1.80E+05 5.18E+05 1.05E+05 2.02E+06 5.21E+05 2.13E+06 3.62E+05 3.64E+05 1.15E+05 LysoPE 16:0(2n isomer) 1.16E+07 5.32E+06 8.17E+06 6.90E+06 1.29E+07 1.07E+07 1.78E+06 4.90E+06 2.75E+06 2.45E+06 5.60E+06 1.06E+07 1.28E+07 1.96E+06 3.69E+06 4.09E+06 8.49E+06 3.38E+06 7.03E+06 5.59E+06 3.90E+06 7.95E+06 7.63E+06 1.45E+07 Clemaphenol A* 1.47E+07 2.73E+07 1.51E+07 2.19E+07 2.19E+07 1.74E+07 1.10E+07 1.70E+07 1.34E+07 8.91E+06 9.67E+06 1.47E+07 3.74E+06 7.60E+06 6.04E+06 4.24E+07 2.45E+07 1.20E+07 4.14E+06 2.37E+06 2.88E+06 1.69E+07 9.07E+06 2.76E+06 L-Arginine 6.81E+05 5.73E+05 2.89E+05 7.60E+05 7.59E+05 2.93E+05 5.32E+05 6.32E+05 7.09E+05 6.90E+04 5.88E+05 6.93E+05 2.53E+06 3.50E+04 2.37E+05 1.23E+04 1.65E+05 5.62E+05 6.58E+05 1.35E+07 3.29E+06 6.09E+07 3.01E+06 2.94E+06 4'-Hydroxy-5,6,7,8,3',5'-Hexamethoxyflavone O-Glucoside 1.25E+06 1.38E+06 1.00E+06 9.62E+05 9.16E+05 9.19E+05 6.12E+05 1.14E+06 9.21E+05 7.44E+05 7.72E+05 8.97E+05 5.51E+05 5.44E+05 8.96E+05 2.28E+05 1.11E+06 1.26E+06 8.40E+05 5.52E+05 8.17E+05 9.68E+05 7.92E+05 5.36E+05 6,7-dimethoxy-2-[2-(4'-hydroxy-3'-methoxyphenyl)ethyl]chromone* 1.18E+06 2.22E+06 6.49E+06 2.27E+06 2.51E+06 4.79E+06 5.95E+06 8.27E+06 2.53E+06 6.62E+06 7.50E+06 6.15E+06 1.04E+07 2.37E+07 4.38E+06 1.31E+07 1.56E+07 7.96E+06 1.34E+07 3.50E+07 1.33E+07 5.95E+06 1.05E+07 4.03E+07 Vidarabine 1.57E+06 9.40E+06 6.49E+06 3.05E+06 2.76E+06 5.88E+06 1.54E+07 1.96E+06 6.40E+06 7.73E+06 1.67E+07 2.92E+06 1.49E+06 9.31E+05 3.46E+06 1.45E+05 6.56E+06 3.02E+05 3.11E+06 6.23E+06 4.54E+06 3.42E+06 2.20E+06 7.18E+06 L-Citrulline 3.75E+05 2.83E+05 4.80E+05 4.59E+05 3.32E+05 2.93E+05 3.10E+05 3.89E+05 2.12E+05 2.30E+05 5.74E+05 2.63E+05 2.81E+05 1.51E+05 3.23E+05 2.47E+05 4.13E+05 3.32E+05 4.27E+05 1.21E+06 2.15E+05 4.58E+05 5.71E+05 2.18E+05 1-Methylguanidine 1.90E+05 2.66E+05 3.08E+05 2.23E+05 2.86E+05 2.28E+05 3.19E+05 2.80E+05 4.93E+05 2.28E+05 4.82E+05 2.26E+05 5.84E+05 1.17E+05 2.34E+05 1.16E+05 1.99E+05 2.61E+05 1.72E+05 7.22E+05 4.32E+05 1.68E+05 4.91E+05 6.37E+05 1,7-bis(4-hydroxy-3-methoxyphenyl)hept-1-ene-3-ol 4.14E+05 4.34E+05 4.68E+05 2.33E+05 4.70E+05 4.54E+05 5.94E+05 1.08E+06 1.15E+06 1.12E+06 5.96E+05 1.04E+05 7.97E+05 1.04E+06 4.67E+05 5.22E+05 7.25E+05 4.23E+05 8.17E+05 1.21E+06 7.88E+05 4.90E+05 7.67E+05 1.10E+06 Lys-Asn 2.03E+05 3.67E+05 3.24E+05 2.34E+05 3.34E+05 3.72E+05 4.85E+05 1.95E+05 4.12E+05 3.80E+05 2.99E+05 4.53E+05 6.51E+05 2.60E+05 2.94E+05 2.50E+05 2.54E+05 4.08E+05 5.29E+05 5.48E+05 4.01E+05 3.83E+05 7.33E+05 3.02E+05 2-Aminotetradecane-1,5,7,11-tetraol 4.50E+05 1.18E+06 1.24E+06 7.16E+05 6.14E+05 5.62E+05 8.00E+05 1.38E+06 6.97E+05 7.28E+05 1.25E+06 1.39E+06 1.17E+06 5.73E+05 6.74E+05 6.70E+05 7.12E+05 1.39E+06 7.09E+05 8.16E+05 7.78E+05 1.38E+06 1.21E+06 5.59E+05 11-O-Vanilloylbergenin 1.06E+06 6.24E+06 9.06E+05 1.72E+06 3.62E+06 7.48E+05 8.19E+05 1.57E+06 1.78E+06 1.14E+06 7.95E+05 3.43E+05 1.31E+06 1.14E+06 5.97E+06 6.13E+05 2.06E+06 5.36E+05 1.30E+06 1.27E+06 2.34E+06 1.08E+06 3.24E+06 1.94E+06 2-AminoicoSane-1,5,7,19-tetraol 4.78E+06 5.44E+06 5.69E+06 5.64E+06 5.72E+06 5.43E+06 6.00E+06 5.71E+06 5.10E+06 5.14E+06 5.16E+06 4.98E+06 5.87E+06 6.39E+06 5.82E+06 5.79E+06 5.23E+06 5.28E+06 5.31E+06 5.52E+06 5.99E+06 6.50E+06 4.94E+06 6.10E+06 8-hydroxy-1,4a-dimethyl-7-(prop-1-en-2-yl)-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one 1.18E+05 4.33E+04 1.36E+05 2.65E+04 1.83E+05 3.09E+04 2.52E+05 1.51E+05 9.83E+04 2.24E+05 1.96E+05 3.78E+05 1.14E+05 1.33E+05 6.69E+04 2.42E+05 1.71E+05 2.72E+05 1.73E+05 8.64E+06 5.63E+04 5.28E+04 1.56E+05 2.79E+04 5-ethyl-6-hydroxy-7-((7-hydroxyhexahydro-1H-pyrrolizin-1-yl)methoxy)-6-methyl-7-oxoheptanoic acid 3.30E+05 8.06E+05 6.01E+05 1.82E+05 1.17E+06 1.01E+06 2.36E+05 6.79E+05 8.10E+05 2.88E+05 8.26E+05 9.70E+05 1.23E+05 7.39E+05 1.61E+05 2.03E+05 6.48E+05 3.65E+05 7.07E+05 1.28E+05 6.97E+04 1.47E+06 7.43E+05 9.89E+04 LysoPE 18:0 1.60E+05 1.16E+05 4.29E+05 9.41E+04 1.37E+05 1.85E+05 4.44E+04 7.68E+04 3.91E+04 6.58E+04 1.02E+05 8.91E+04 2.13E+05 8.50E+03 5.62E+04 4.63E+05 1.13E+05 1.04E+05 5.48E+04 6.46E+04 6.55E+04 7.67E+04 5.58E+04 1.46E+05 Histamine 1.20E+06 3.18E+06 3.63E+06 1.04E+06 1.09E+06 2.34E+06 4.54E+06 2.26E+06 4.62E+06 1.26E+06 2.02E+06 1.65E+06 5.49E+06 1.13E+06 1.77E+06 6.53E+05 2.16E+06 1.59E+06 4.05E+06 4.41E+06 3.73E+06 2.81E+06 4.19E+06 5.95E+06 Acutissimalignan B* 1.10E+06 2.84E+06 7.14E+06 2.47E+06 2.85E+06 5.22E+06 7.14E+06 9.85E+06 2.74E+06 7.54E+06 9.52E+06 6.15E+06 1.25E+07 3.28E+07 5.16E+06 1.63E+07 1.89E+07 8.92E+06 1.51E+07 4.41E+07 1.48E+07 7.05E+06 1.24E+07 4.80E+07 3,4,5-trihydroxy-5-[4-(prop-2-enoyloxymethyl)phenoxy]oxane-2-carboxylic acid 1.56E+06 2.30E+06 1.28E+06 1.76E+06 1.32E+06 1.49E+06 1.32E+06 1.25E+06 1.64E+06 1.84E+06 1.53E+06 1.04E+06 1.69E+06 5.79E+05 2.56E+06 4.82E+06 3.86E+06 2.81E+06 2.47E+06 1.68E+06 1.34E+06 2.00E+06 4.67E+06 1.09E+06 2-Aminotetradecane-1,11,13-triol 1.97E+07 2.18E+07 2.07E+07 2.56E+07 2.13E+07 2.31E+07 2.56E+07 2.23E+07 2.37E+07 2.60E+07 2.30E+07 2.33E+07 1.59E+07 2.50E+07 2.49E+07 2.81E+07 2.09E+07 2.33E+07 2.35E+07 2.20E+07 2.63E+07 2.48E+07 2.05E+07 2.05E+07 L-Cystine 2.26E+05 5.19E+05 1.60E+05 2.35E+05 2.48E+05 2.08E+05 5.16E+05 4.61E+05 3.81E+05 2.13E+05 1.42E+05 2.32E+05 2.57E+05 2.74E+05 2.09E+05 2.34E+05 5.30E+05 3.64E+05 4.81E+05 4.76E+05 2.06E+05 6.62E+05 1.50E+06 2.33E+05 8-(P-Hydroxyphenyl)-Menthone 4.82E+06 8.75E+05 2.20E+06 1.47E+05 5.66E+06 1.24E+06 3.99E+06 1.15E+06 7.20E+06 3.78E+06 1.39E+07 1.49E+07 5.07E+06 4.58E+06 3.03E+06 6.73E+06 5.35E+06 1.73E+07 1.36E+07 6.55E+06 1.64E+06 6.87E+05 3.96E+05 1.10E+05 p-Coumaroyltyramine* 1.24E+05 1.94E+06 1.93E+07 3.49E+05 7.47E+05 8.90E+06 1.37E+07 2.95E+06 8.12E+05 1.99E+07 2.04E+07 1.27E+06 1.10E+07 3.01E+07 5.93E+05 4.85E+07 3.32E+07 2.98E+06 6.93E+06 5.26E+06 4.57E+06 2.51E+06 2.02E+06 5.00E+06 4-Hydroxysphinganine; Phytosphingosine 4.58E+05 1.45E+06 1.33E+06 4.99E+05 1.24E+06 5.35E+06 7.23E+05 7.19E+05 6.51E+05 9.17E+05 1.08E+06 1.35E+06 7.16E+06 1.60E+06 3.96E+05 1.31E+06 6.01E+05 1.22E+06 2.44E+06 1.16E+06 3.76E+07 2.20E+07 1.37E+06 2.34E+06 O-phosphate-L-tyrosine 4.97E+05 3.67E+05 4.94E+05 3.08E+05 6.44E+05 3.33E+05 8.42E+05 3.69E+05 4.55E+05 3.46E+05 5.43E+05 5.19E+05 7.66E+05 4.45E+05 5.08E+05 7.95E+05 2.81E+05 6.51E+05 1.06E+06 4.00E+05 8.81E+05 4.82E+05 6.99E+05 4.96E+05 NG,NG-Dimethyl-L-arginine* 1.96E+05 7.41E+05 3.17E+05 4.26E+05 3.29E+05 1.87E+05 3.20E+05 3.33E+05 4.86E+05 2.99E+05 2.94E+05 4.62E+05 5.61E+05 1.38E+05 3.25E+05 1.31E+05 5.02E+05 1.42E+05 3.80E+05 5.37E+05 5.94E+05 1.56E+06 9.78E+05 4.80E+05 Deoxypodophyllotoxin 5.27E+04 2.68E+05 1.39E+05 3.50E+05 3.18E+05 1.15E+05 3.19E+05 6.55E+05 8.61E+04 5.77E+05 2.84E+05 3.41E+05 2.89E+05 1.03E+05 5.92E+04 1.84E+05 2.75E+05 2.06E+04 4.28E+05 2.91E+05 2.75E+05 5.04E+04 2.92E+05 2.33E+04 1-(9Z,12Z-Octadecadienoyl)-Sn-Glycero-3-Phosphocholine 3.02E+07 2.30E+07 3.01E+07 2.69E+07 3.34E+07 1.65E+07 5.56E+07 2.30E+07 2.70E+07 5.60E+07 1.92E+07 2.95E+07 1.61E+07 4.28E+07 1.92E+07 2.29E+07 4.80E+07 2.37E+07 4.38E+07 2.52E+07 9.75E+06 1.90E+07 2.95E+07 1.33E+07 1-(4-hydroxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-4-ene-3-heptanone 1.20E+05 2.59E+05 1.24E+05 5.11E+05 2.91E+05 2.41E+05 2.20E+05 2.49E+05 1.93E+05 5.32E+05 2.61E+05 5.07E+05 2.82E+05 6.49E+05 3.10E+05 1.84E+05 3.03E+05 3.01E+05 3.40E+05 2.69E+05 8.02E+05 3.71E+05 5.52E+05 5.72E+05 5-Hydroxymethylfurfural* 3.56E+06 2.75E+06 3.84E+06 2.40E+06 2.55E+06 2.36E+06 4.29E+06 3.48E+06 3.32E+06 4.65E+06 1.99E+06 2.72E+06 2.87E+06 1.40E+06 2.92E+06 2.77E+06 1.90E+06 3.40E+06 3.46E+06 2.77E+06 1.74E+06 2.23E+06 3.28E+06 2.72E+06 Senkyunolide K 1.81E+06 3.25E+05 1.35E+05 1.04E+05 2.18E+05 4.26E+05 2.10E+06 2.99E+05 1.87E+06 1.14E+06 2.74E+07 1.17E+07 1.56E+05 1.02E+05 1.45E+07 1.10E+06 1.48E+07 2.46E+07 1.25E+05 3.20E+06 1.05E+05 9.83E+04 7.74E+04 6.73E+04 γ-Glutamyl-L-valine 1.71E+05 9.90E+04 9.78E+04 8.82E+04 3.83E+05 5.77E+04 5.28E+05 1.49E+05 1.54E+05 9.50E+04 3.01E+05 2.05E+05 7.24E+05 3.01E+04 9.38E+04 3.85E+04 9.69E+04 1.37E+05 1.55E+05 3.91E+05 2.23E+05 8.80E+04 1.00E+05 1.92E+05 Dehydrodiconiferyl alcohol* 1.74E+07 2.16E+07 1.72E+07 1.87E+07 1.35E+07 1.50E+07 1.26E+07 2.12E+07 2.02E+07 1.31E+07 1.15E+07 1.22E+07 5.09E+06 7.58E+06 9.43E+06 4.50E+07 2.38E+07 1.19E+07 4.04E+06 2.32E+06 3.85E+06 1.64E+07 1.13E+07 3.12E+06 N-[3-(4-Hydroxyphenyl)acryloyl]-L-tyrosine 1.18E+05 2.72E+05 1.68E+05 2.18E+05 1.14E+05 1.45E+05 2.47E+05 2.63E+05 2.93E+05 1.95E+05 1.80E+05 2.10E+05 1.93E+05 1.69E+05 2.60E+05 2.77E+05 2.41E+05 1.20E+05 1.64E+05 2.27E+05 1.03E+05 1.88E+05 1.50E+05 2.07E+05 Pyridoxine-5'-O-glucoside 3.28E+06 3.50E+06 1.51E+06 2.51E+05 3.21E+06 1.23E+06 1.25E+06 5.12E+05 8.63E+05 1.66E+06 1.04E+06 2.61E+06 2.64E+06 6.50E+05 9.38E+05 4.78E+05 3.68E+06 1.99E+06 4.99E+06 1.01E+06 2.10E+06 9.30E+05 7.62E+05 8.45E+05 2,5-Dimethyl pyrazine 3.16E+05 2.78E+05 3.53E+05 2.73E+05 2.67E+05 3.86E+05 3.64E+05 5.16E+05 3.98E+05 2.71E+05 3.53E+05 2.75E+05 2.01E+05 1.97E+05 2.03E+05 3.73E+05 2.03E+05 2.01E+05 2.55E+05 1.98E+05 1.26E+05 2.47E+05 1.56E+05 1.21E+05 Kaempferol-4'-O-glucoside 1.54E+06 5.03E+05 4.11E+05 2.60E+05 5.19E+05 2.42E+06 1.39E+06 1.27E+05 7.70E+05 2.71E+06 6.93E+05 2.43E+06 1.05E+06 1.29E+05 3.10E+05 6.38E+05 1.59E+06 1.08E+06 1.38E+06 1.83E+06 5.23E+05 2.80E+05 2.38E+05 3.49E+05 Umbelliferone 7-O-Rutinoside 0.00E+00 0.00E+00 0.00E+00 0.00E+00 1.86E+05 2.76E+05 8.94E+05 2.40E+05 3.92E+05 7.75E+05 7.92E+05 6.33E+05 5.48E+05 1.37E+05 1.12E+05 1.64E+05 3.26E+05 4.40E+05 8.83E+05 8.11E+05 1.56E+06 6.31E+05 4.18E+05 4.58E+05 antioxidant 5.31E+05 9.34E+05 1.14E+06 6.97E+05 1.35E+06 1.62E+06 1.10E+06 7.67E+05 7.16E+05 6.64E+05 1.96E+06 1.32E+06 8.38E+05 9.67E+05 6.44E+05 1.50E+06 1.43E+06 1.21E+06 5.89E+05 9.01E+05 2.17E+06 7.82E+05 7.92E+05 2.61E+05 Adenosine 5'-monophosphate 7.51E+06 8.31E+06 1.31E+07 4.86E+06 1.20E+07 4.41E+06 1.69E+07 1.40E+07 1.82E+07 2.07E+07 2.03E+07 1.52E+07 1.70E+06 1.85E+06 6.28E+06 3.20E+06 1.59E+07 7.47E+06 1.21E+06 2.04E+07 2.73E+06 3.63E+06 3.47E+06 7.67E+06 2-(Dimethylamino)guanosine* 7.67E+04 1.94E+05 4.81E+05 2.03E+05 1.74E+05 3.27E+05 3.89E+05 2.76E+05 3.73E+05 3.20E+05 4.15E+05 2.78E+05 8.18E+05 4.51E+05 1.52E+05 2.17E+05 2.45E+05 2.28E+05 5.03E+05 7.98E+05 1.73E+05 2.22E+05 1.12E+05 8.52E+05 N6-(2-Hydroxyethyl)adenosine* 7.67E+04 1.94E+05 4.81E+05 2.03E+05 1.74E+05 3.27E+05 3.89E+05 2.76E+05 3.73E+05 3.20E+05 4.15E+05 2.78E+05 8.18E+05 4.51E+05 1.52E+05 2.17E+05 2.45E+05 2.28E+05 5.03E+05 7.98E+05 1.73E+05 2.22E+05 1.12E+05 8.52E+05 Piperidine 4.81E+05 4.74E+05 7.76E+05 6.13E+05 1.72E+06 4.78E+05 2.62E+06 3.81E+05 1.78E+06 7.10E+05 3.46E+06 1.04E+06 4.93E+06 3.90E+05 8.88E+05 8.24E+04 3.16E+05 5.59E+05 3.95E+05 4.31E+06 3.40E+06 4.25E+05 1.31E+06 4.91E+06 Chloranthatone 9.30E+04 1.62E+05 1.11E+05 6.47E+04 1.40E+05 1.89E+05 5.51E+04 1.01E+05 1.89E+05 4.53E+04 6.94E+05 2.35E+05 1.75E+05 2.11E+05 1.87E+05 4.20E+05 2.77E+05 2.83E+05 2.38E+05 2.80E+05 3.23E+04 1.07E+05 5.27E+04 3.21E+04 Trimethyllysine 2.54E+05 5.76E+05 5.62E+05 6.06E+05 7.08E+05 4.70E+05 5.36E+05 5.27E+05 4.22E+05 4.38E+05 5.67E+05 5.15E+05 1.05E+06 2.98E+05 5.07E+05 2.65E+05 5.47E+05 4.77E+05 9.55E+05 1.03E+06 9.80E+05 6.53E+05 4.63E+05 1.26E+06 LysoPE 16:0 8.83E+06 5.84E+06 7.17E+06 6.74E+06 1.25E+07 9.42E+06 2.26E+06 3.11E+06 3.26E+06 1.82E+06 5.63E+06 9.43E+06 1.74E+07 1.77E+06 3.95E+06 4.41E+06 8.18E+06 4.61E+06 6.43E+06 5.93E+06 4.36E+06 8.24E+06 6.33E+06 1.18E+07 Arg-Gly 7.08E+04 9.79E+04 7.88E+04 9.48E+04 1.12E+05 1.37E+05 1.21E+05 7.48E+04 8.94E+04 1.30E+05 1.19E+05 1.31E+05 1.75E+05 1.10E+05 1.01E+05 8.34E+04 9.19E+04 1.07E+05 2.42E+05 1.17E+05 1.70E+05 1.17E+05 9.34E+04 8.99E+04 N-(4-Aminobutyl)benzamide 4.27E+07 5.58E+07 2.38E+07 3.02E+07 6.87E+07 7.43E+07 1.32E+07 6.03E+07 8.44E+07 9.06E+06 4.34E+07 3.70E+07 2.20E+07 1.26E+07 3.23E+07 1.08E+07 3.68E+07 1.79E+07 1.98E+07 1.56E+07 9.47E+06 3.25E+07 3.25E+07 2.97E+07 11β-Hydroxy-8,15-isopimaradiene-4-one(ISO3) 6.70E+05 2.07E+06 1.72E+06 9.87E+05 1.07E+06 8.55E+05 1.11E+06 2.06E+06 9.70E+05 8.60E+05 1.73E+06 1.82E+06 1.69E+06 8.75E+05 1.03E+06 9.18E+05 8.79E+05 1.98E+06 1.16E+06 1.16E+06 7.73E+05 2.13E+06 1.89E+06 8.30E+05 3-(Allylsulphinyl)-L-alanine 7.45E+04 2.60E+05 2.88E+05 1.19E+05 1.39E+05 2.29E+05 1.61E+05 1.45E+05 1.38E+05 1.18E+05 1.74E+05 2.05E+05 1.94E+05 2.08E+05 1.32E+05 1.97E+05 1.76E+05 2.83E+05 1.71E+05 1.65E+05 1.41E+05 2.09E+05 1.59E+05 7.57E+04 Apiosylskimmin (Adicardin) 2.59E+05 5.38E+04 2.48E+05 1.44E+05 1.33E+05 1.29E+05 2.05E+05 1.42E+05 1.66E+05 2.21E+05 2.07E+05 2.88E+05 1.18E+05 8.20E+04 4.85E+05 1.38E+05 2.10E+05 2.11E+05 2.37E+05 2.18E+05 9.43E+04 1.40E+05 1.99E+05 1.95E+05 Pro-Asp 3.49E+05 4.32E+05 4.06E+05 2.16E+05 3.61E+05 5.20E+05 5.30E+05 3.12E+05 6.44E+05 4.58E+05 5.26E+05 6.60E+05 7.82E+05 4.38E+05 3.89E+05 4.85E+05 3.72E+05 4.75E+05 1.51E+06 5.58E+05 6.61E+05 5.16E+05 3.92E+05 4.93E+05 3-(3-Hydroxyphenyl)-propionic acid 3.21E+07 3.53E+07 2.74E+07 3.06E+07 4.29E+07 3.23E+07 1.78E+07 1.68E+07 4.55E+07 1.85E+07 3.26E+07 3.80E+07 3.67E+07 9.99E+06 3.51E+07 2.04E+07 3.04E+07 3.24E+07 1.66E+07 1.47E+07 2.82E+07 2.17E+07 2.83E+07 1.50E+07 Lariciresinol acetate 5.69E+04 4.59E+04 5.85E+04 3.90E+04 4.64E+04 7.57E+04 3.63E+05 1.74E+05 8.26E+04 2.85E+05 1.61E+06 1.14E+06 1.58E+05 7.93E+04 1.06E+05 1.89E+05 4.32E+05 1.26E+06 1.39E+05 6.01E+04 4.20E+04 3.58E+04 9.56E+04 1.85E+04 2-AminoicoSane-1,6,18,19,20-pentaol 1.28E+06 2.03E+06 1.97E+06 1.66E+06 1.33E+06 1.39E+06 1.54E+06 2.46E+06 1.51E+06 1.72E+06 2.04E+06 2.15E+06 2.30E+06 1.62E+06 1.31E+06 1.65E+06 1.66E+06 2.14E+06 1.77E+06 1.95E+06 1.47E+06 2.54E+06 2.27E+06 1.54E+06 Triethyl citrate 1.23E+05 1.11E+05 7.11E+04 1.10E+05 9.06E+04 9.67E+04 6.05E+04 1.16E+05 1.10E+05 1.05E+05 1.18E+05 7.42E+04 6.78E+04 7.78E+04 1.15E+05 8.51E+04 9.63E+04 4.72E+04 5.14E+04 1.33E+05 1.01E+05 1.06E+05 1.34E+05 6.29E+04 4'-Methoxyacetophenone 6.82E+05 8.22E+05 1.16E+06 6.31E+05 8.62E+05 1.86E+06 6.57E+05 1.73E+06 4.95E+05 5.48E+05 1.16E+06 8.50E+05 7.22E+05 1.78E+06 4.20E+05 1.88E+05 5.29E+05 1.15E+06 3.37E+05 4.48E+05 4.07E+05 9.07E+05 5.83E+05 1.44E+06 Massoniresinol; Vladinol A 1.92E+06 1.87E+06 2.71E+06 2.26E+06 7.43E+05 6.32E+05 9.52E+05 9.04E+05 9.58E+05 7.39E+05 3.96E+05 6.80E+05 1.35E+06 4.80E+05 2.67E+06 1.43E+06 2.32E+06 2.16E+06 8.18E+05 1.67E+06 1.31E+06 9.00E+05 8.63E+05 2.10E+06 5-Hydroxytryptophol 7.88E+05 6.74E+05 7.44E+05 7.86E+05 6.64E+05 8.98E+05 6.16E+05 5.62E+05 6.55E+05 5.40E+05 7.12E+05 6.43E+05 7.76E+05 5.18E+05 6.63E+05 3.00E+05 5.75E+05 7.43E+05 8.00E+05 6.47E+05 5.64E+05 7.11E+05 6.86E+05 6.37E+05 Cycloolivil 6.87E+05 6.68E+06 6.39E+06 4.40E+05 2.72E+06 3.11E+07 4.09E+06 4.42E+06 1.76E+06 2.51E+06 3.72E+06 1.46E+06 3.32E+06 2.50E+07 5.44E+05 9.38E+05 2.14E+06 3.57E+05 4.98E+06 2.04E+06 1.83E+06 1.85E+06 1.49E+06 1.76E+07 N6-(4-hydroxybenzyl)adenine 8.47E+04 6.76E+04 1.37E+05 1.11E+05 5.85E+04 9.71E+04 9.28E+04 4.27E+04 5.46E+04 1.07E+05 1.60E+05 9.80E+04 1.05E+05 2.15E+05 1.37E+05 2.67E+05 1.37E+05 1.79E+05 2.61E+05 1.85E+05 8.92E+04 6.09E+04 2.74E+05 1.88E+05 (7'R,8'R)-7'8'-dihydro-7'-(5'-hydroxy-3'-methoxphenyl)-3-methoxy-8'-methyl-1-(E)-propenylbenzof-uran 5.74E+06 6.16E+06 3.90E+06 5.24E+06 8.25E+06 4.56E+06 3.04E+06 6.70E+06 6.01E+06 2.23E+06 7.71E+06 9.05E+06 1.14E+07 6.02E+06 7.56E+06 2.02E+06 3.68E+06 3.69E+06 1.10E+07 6.27E+06 8.48E+06 1.20E+07 4.02E+06 7.72E+06 Pro-Asn 1.01E+06 1.37E+06 1.29E+06 6.58E+05 1.40E+06 1.78E+06 2.33E+06 1.01E+06 2.22E+06 1.50E+06 1.67E+06 3.03E+06 3.00E+06 1.52E+06 1.42E+06 1.21E+06 1.34E+06 1.49E+06 3.12E+06 2.21E+06 2.55E+06 1.88E+06 1.21E+06 7.71E+05 L-Leucyl-L-Leucine 1.27E+05 1.24E+06 2.06E+05 8.41E+04 2.21E+05 2.78E+05 2.80E+05 9.32E+04 9.45E+05 2.37E+05 6.79E+05 2.01E+05 1.09E+06 1.47E+05 1.74E+05 4.02E+04 6.34E+05 7.43E+04 1.79E+06 9.70E+05 2.62E+05 3.35E+05 4.45E+05 1.95E+05 3ξ-(1ξ-hydroxyethyl)-7-hydroxy-1-isobenzofuranone 1.04E+06 8.76E+05 1.31E+06 9.91E+05 1.27E+06 1.09E+06 6.57E+05 1.25E+06 1.32E+06 9.14E+05 1.13E+06 1.08E+06 1.13E+06 6.02E+05 1.04E+06 9.63E+05 8.63E+05 1.09E+06 8.24E+05 4.44E+05 6.68E+05 8.95E+05 7.16E+05 4.26E+05 6-Hydroxypseudooxynicotine O-glucoside 1.62E+05 2.07E+05 1.49E+06 1.72E+05 1.17E+05 2.28E+05 2.16E+06 2.11E+05 1.10E+05 9.50E+05 9.69E+05 2.01E+05 6.44E+05 2.03E+05 2.34E+05 1.12E+06 7.49E+05 2.88E+05 2.37E+05 7.17E+05 7.18E+05 1.49E+05 7.76E+05 2.72E+05 Myrtucommulone B 2.29E+06 2.50E+06 2.32E+06 2.00E+06 2.95E+06 3.37E+06 4.43E+06 3.05E+06 3.12E+06 3.40E+06 4.20E+06 3.33E+06 3.35E+06 4.67E+06 4.00E+06 4.86E+06 3.00E+06 3.69E+06 3.24E+06 2.86E+06 3.99E+06 3.04E+06 4.43E+06 3.44E+06 3-Hydroxy-L-phenylalanine* 1.96E+07 2.79E+07 1.42E+07 3.35E+07 3.62E+07 5.20E+06 1.95E+07 2.94E+07 2.29E+07 5.73E+06 1.29E+07 3.11E+07 3.73E+07 1.63E+06 2.38E+07 9.57E+05 1.00E+07 2.55E+07 1.29E+07 3.16E+07 5.29E+07 3.63E+07 2.17E+07 8.08E+07 6,9-Dihydroxy-7-megastigmen-3-one 5.94E+05 1.86E+06 3.50E+05 1.80E+06 5.19E+05 8.89E+05 5.41E+05 3.56E+06 2.40E+06 4.99E+05 7.34E+05 4.56E+05 2.08E+06 3.08E+06 1.36E+06 7.19E+05 2.03E+06 6.01E+05 1.54E+06 1.09E+06 9.83E+05 1.50E+06 6.16E+05 9.46E+05 Elaidolinolenic acid 3.51E+05 3.13E+05 4.23E+05 2.06E+05 5.90E+05 6.14E+05 2.77E+05 5.49E+05 3.11E+05 2.07E+05 4.67E+05 5.08E+05 4.21E+05 1.37E+05 2.18E+05 4.27E+05 3.43E+05 2.16E+05 5.16E+05 2.55E+05 3.05E+05 1.16E+05 4.71E+05 3.07E+05 Cycloleucine 6.18E+06 5.65E+06 3.11E+06 4.21E+06 5.31E+06 1.39E+06 6.39E+06 6.09E+06 6.14E+06 3.26E+06 6.14E+06 5.06E+06 7.91E+06 9.71E+05 3.37E+06 4.22E+05 2.71E+06 6.93E+06 1.60E+06 1.21E+07 8.31E+06 3.54E+06 5.85E+06 8.09E+06 2-aminodocoSane-1,6,19,20,21-pentaol 1.71E+06 1.57E+06 1.52E+06 1.45E+06 1.61E+06 1.59E+06 1.64E+06 1.41E+06 1.69E+06 1.52E+06 1.65E+06 1.46E+06 1.39E+06 1.45E+06 1.74E+06 1.69E+06 1.33E+06 1.82E+06 1.49E+06 1.55E+06 1.61E+06 1.43E+06 1.49E+06 1.76E+06 Pyroglutamic acid 4.45E+07 4.03E+07 7.44E+06 4.42E+07 4.04E+07 7.29E+06 4.01E+07 4.32E+07 1.91E+07 9.31E+06 1.25E+07 4.05E+07 1.60E+07 4.72E+06 7.42E+06 2.07E+06 1.15E+07 8.14E+06 8.47E+06 8.82E+07 1.58E+07 1.93E+07 1.62E+07 1.95E+07 9-Oxooctadeca-10,12-Dienoic Acid 3.56E+05 5.58E+05 7.72E+05 1.74E+05 2.76E+05 1.12E+06 2.40E+05 1.98E+05 3.51E+05 1.24E+05 5.90E+05 2.19E+05 8.69E+05 3.01E+04 5.86E+05 1.62E+06 4.15E+05 1.21E+05 9.31E+05 7.59E+05 3.99E+05 4.39E+05 5.76E+05 8.25E+05 Barbituric acid;Malonylurea;2,4,6-Pyrimidinetrione 1.45E+06 5.95E+05 2.69E+06 6.08E+06 6.05E+05 4.37E+05 3.45E+06 4.98E+06 1.95E+06 6.80E+05 1.83E+06 7.72E+05 6.06E+06 1.75E+06 7.28E+06 3.00E+05 7.29E+05 2.04E+06 1.22E+07 3.15E+06 4.30E+06 5.69E+06 1.11E+06 5.37E+06 Phe-Ser 3.09E+04 5.60E+05 1.50E+05 6.36E+04 7.04E+04 1.14E+05 8.45E+04 6.32E+04 5.18E+05 5.72E+04 3.15E+05 8.33E+04 7.11E+05 2.66E+04 9.16E+04 6.34E+03 2.53E+05 3.49E+04 1.12E+06 4.28E+05 2.53E+05 8.58E+05 1.11E+06 1.04E+05 3,4,5-Trihydroxy-6-[1-(4-methoxyphenyl)pentan-3-yloxy]oxane-2-carboxylic acid* 2.89E+06 3.08E+06 1.30E+06 2.85E+06 3.98E+06 2.96E+06 3.48E+06 3.16E+06 4.12E+06 2.92E+06 2.82E+06 2.63E+06 3.08E+06 2.63E+06 2.19E+06 1.75E+06 1.55E+06 2.40E+06 2.88E+06 1.64E+06 3.48E+06 2.36E+06 2.96E+06 1.37E+06 L-Valine* 1.05E+07 1.32E+07 2.04E+07 1.79E+07 4.41E+07 9.78E+06 6.69E+07 1.43E+07 2.17E+07 1.64E+07 7.15E+07 2.58E+07 9.81E+07 8.13E+06 2.02E+07 4.00E+06 1.02E+07 1.05E+07 9.65E+06 5.32E+07 6.75E+07 1.07E+07 2.95E+07 7.79E+07 S-(Methyl)glutathione 9.46E+05 5.80E+05 9.30E+05 7.34E+05 1.15E+06 3.34E+05 5.05E+05 5.75E+05 9.99E+05 4.29E+05 9.87E+05 1.67E+06 6.71E+05 7.29E+04 1.05E+06 8.67E+04 6.26E+05 1.14E+06 1.60E+05 6.97E+05 6.21E+05 3.12E+05 4.02E+05 5.36E+05 2,3-Dihydroxyurs-12,18-dien-28-oic acid (Goreishic Acid I) 5.01E+05 1.46E+04 7.94E+04 1.03E+04 2.29E+05 5.53E+04 5.39E+05 4.38E+04 1.98E+05 3.83E+05 1.73E+06 4.52E+05 2.67E+05 2.05E+05 3.17E+05 4.30E+05 2.99E+05 6.01E+05 6.30E+05 2.68E+05 1.60E+05 4.66E+04 5.07E+04 1.46E+03 LysoPC 17:2 1.51E+05 9.56E+04 1.54E+05 1.65E+05 1.33E+05 6.21E+04 3.47E+05 6.99E+04 6.31E+04 2.29E+05 7.71E+04 1.46E+05 5.58E+04 1.57E+05 9.86E+04 8.63E+04 2.04E+05 1.24E+05 2.45E+05 8.72E+04 4.68E+04 6.68E+04 8.62E+04 3.89E+04 2-Aminododecane-1,4-diol 1.67E+07 2.20E+07 2.01E+07 2.42E+07 2.04E+07 2.19E+07 2.26E+07 2.16E+07 2.56E+07 2.42E+07 2.10E+07 2.35E+07 1.61E+07 2.36E+07 2.29E+07 2.29E+07 2.01E+07 2.16E+07 2.20E+07 2.12E+07 2.47E+07 2.12E+07 1.98E+07 2.12E+07 Butyl beta-D-glucoside 2.46E+05 2.47E+05 2.50E+05 3.07E+05 3.27E+05 2.66E+05 3.72E+05 4.28E+05 3.74E+05 3.92E+05 2.87E+05 4.04E+05 6.34E+04 3.77E+05 4.19E+05 2.42E+05 3.31E+05 3.16E+05 2.49E+05 2.67E+05 4.20E+05 4.85E+05 2.29E+05 3.41E+05 Xylocarpin I 1.23E+07 1.13E+07 1.64E+07 1.45E+07 1.23E+07 1.20E+07 8.84E+06 1.10E+07 1.11E+07 8.89E+06 1.08E+07 1.52E+07 1.38E+07 5.11E+06 1.75E+07 1.88E+07 1.33E+07 1.87E+07 1.67E+07 9.44E+06 1.20E+07 1.52E+07 6.30E+06 7.52E+06 Isolariciresinol-9-O-glucoside 9.31E+05 1.03E+06 6.33E+05 1.38E+06 8.00E+05 4.63E+05 3.82E+05 7.02E+05 7.52E+05 5.88E+05 6.00E+05 8.99E+05 7.81E+05 5.31E+05 1.27E+06 1.19E+06 5.93E+05 4.55E+05 4.61E+05 5.28E+05 6.76E+05 7.20E+05 8.95E+05 4.12E+05 L-Phenylalaninol 2.17E+05 3.22E+05 1.42E+05 1.76E+05 1.99E+05 1.90E+05 2.08E+05 2.33E+05 2.68E+05 1.70E+05 1.33E+05 1.56E+05 1.95E+05 1.48E+05 2.08E+05 8.50E+04 2.37E+05 1.54E+05 1.64E+05 2.44E+05 1.30E+05 1.20E+05 2.86E+05 1.93E+05 p-Coumaroylputrescine 2.46E+06 2.38E+06 2.27E+06 2.26E+06 2.17E+06 1.84E+06 1.70E+06 1.75E+06 1.94E+06 1.33E+06 1.90E+06 2.13E+06 1.94E+06 9.37E+05 2.26E+06 1.55E+06 1.81E+06 2.07E+06 1.38E+06 1.75E+06 1.42E+06 1.52E+06 1.76E+06 1.03E+06 Methyldopa 1.27E+06 4.32E+05 1.52E+06 5.87E+05 5.87E+05 3.82E+05 1.23E+06 1.76E+06 5.32E+05 8.93E+05 7.17E+05 1.15E+06 8.09E+05 5.54E+05 5.98E+05 6.41E+05 1.06E+06 7.79E+05 1.90E+06 1.04E+06 3.52E+05 1.99E+05 8.29E+05 2.20E+05 9,12-Octadecadien-6-Ynoic Acid 2.63E+05 2.38E+05 1.15E+06 1.74E+05 6.38E+05 8.78E+05 1.93E+05 6.45E+05 2.40E+05 2.12E+05 3.30E+05 4.79E+05 4.32E+05 4.33E+04 8.46E+04 1.13E+06 1.86E+05 1.10E+05 1.25E+05 2.99E+05 7.66E+04 7.97E+04 8.64E+05 2.83E+05 2-Methoxy-4-ethenylphenol 7.56E+06 1.05E+07 4.81E+06 7.63E+06 5.31E+06 5.20E+06 6.52E+06 7.84E+06 8.01E+06 4.82E+06 5.33E+06 5.03E+06 5.80E+06 3.02E+06 7.53E+06 2.24E+06 9.75E+06 6.29E+06 3.73E+06 6.20E+06 4.11E+06 4.50E+06 9.81E+06 7.19E+06 3-(4-methoxyphenyl)propyl methyl 4-O-methyl-alpha-d-glucopyranosiduronate* 1.38E+07 1.49E+07 8.81E+06 3.03E+07 1.54E+07 8.27E+06 8.49E+06 1.30E+07 1.32E+07 6.34E+06 1.11E+07 1.21E+07 7.10E+06 2.89E+06 1.32E+07 1.54E+06 1.31E+07 1.14E+07 8.21E+06 6.44E+06 4.16E+06 1.09E+07 1.07E+07 5.36E+06 2,4-Hexadienoic acid 1.11E+06 5.38E+05 3.07E+05 4.83E+05 3.67E+05 4.16E+04 3.51E+05 3.24E+05 6.67E+04 4.44E+05 3.20E+05 3.20E+05 6.77E+05 4.44E+05 3.35E+05 4.32E+05 5.87E+05 3.95E+05 6.07E+05 7.13E+05 3.68E+05 3.81E+05 7.76E+05 4.59E+05 D-Ornithine 9.87E+04 1.62E+05 1.92E+05 2.18E+05 2.49E+05 7.29E+04 1.11E+06 1.31E+05 1.42E+05 7.29E+04 1.38E+06 2.40E+05 5.06E+05 4.43E+04 4.46E+05 2.49E+04 8.03E+04 1.28E+05 8.49E+04 2.27E+06 2.45E+05 2.27E+05 2.12E+05 4.01E+05 Ala-Ser 1.02E+06 7.15E+05 1.16E+06 7.32E+05 6.45E+05 6.56E+05 4.57E+05 9.24E+05 8.15E+05 4.26E+05 4.75E+05 3.67E+05 4.24E+05 1.55E+05 5.64E+05 5.88E+05 5.37E+05 9.46E+05 3.59E+05 3.33E+05 3.39E+05 4.65E+05 3.38E+05 3.79E+05 3,4'-Dihydroxy-3',5'-dimethoxypropiophenone 5.40E+05 5.27E+05 8.55E+05 4.21E+05 8.17E+05 1.48E+06 2.28E+06 5.40E+05 1.02E+06 1.70E+06 2.88E+06 1.13E+06 2.30E+06 4.21E+06 1.40E+06 5.69E+06 2.07E+06 1.86E+06 8.71E+05 1.09E+06 7.99E+05 5.12E+05 8.12E+05 3.07E+05 LysoPC 15:1 1.39E+05 1.05E+05 1.05E+05 1.49E+05 1.48E+05 4.40E+04 7.64E+04 1.35E+05 8.19E+04 9.00E+04 1.09E+05 1.95E+05 9.58E+04 4.70E+04 4.06E+04 7.62E+04 3.24E+05 9.61E+04 2.30E+05 9.98E+04 4.68E+04 2.39E+05 3.24E+04 1.18E+05 3'-Deoxy-4-O-methylsappanol 2.92E+05 2.38E+05 2.04E+05 1.34E+05 1.71E+05 3.25E+05 1.57E+05 1.31E+05 2.10E+05 2.41E+05 2.65E+05 1.60E+05 3.66E+05 2.15E+05 1.42E+05 9.39E+04 9.64E+04 3.13E+05 3.30E+05 2.91E+05 2.42E+05 2.73E+05 1.72E+05 2.06E+05 O-Acetyl-L-homoserine 1.69E+05 1.90E+05 2.40E+05 1.64E+05 6.62E+05 1.89E+05 3.14E+05 2.97E+05 2.54E+05 1.85E+05 4.08E+05 2.58E+05 1.11E+06 1.81E+05 2.34E+05 1.57E+05 3.04E+05 2.06E+05 2.09E+05 5.73E+05 6.08E+05 1.90E+05 2.01E+05 1.81E+06 4-Hydroxy-L-phenylglycine 2.22E+05 1.32E+05 2.86E+05 1.62E+05 1.36E+05 1.89E+05 1.24E+05 2.39E+05 1.66E+05 1.16E+05 1.76E+05 1.75E+05 1.44E+05 9.31E+04 1.63E+05 1.96E+05 1.37E+05 2.31E+05 1.72E+05 1.35E+05 1.77E+05 1.13E+05 1.33E+05 9.66E+04 Thr-Thr 1.47E+05 2.70E+05 1.66E+05 1.57E+05 1.56E+05 1.04E+05 1.97E+05 1.68E+05 2.78E+05 1.69E+05 2.04E+05 2.00E+05 2.64E+05 4.52E+04 2.07E+05 5.99E+04 1.94E+05 2.82E+05 2.34E+05 2.04E+05 1.58E+05 1.27E+05 3.34E+05 1.46E+05 fragransin A2* 5.08E+04 6.77E+04 6.65E+04 8.12E+04 2.49E+05 9.25E+04 1.88E+06 2.75E+06 1.13E+05 9.51E+05 9.27E+04 4.07E+05 5.68E+04 1.75E+05 1.47E+04 5.80E+04 1.45E+05 2.00E+04 2.11E+05 1.84E+05 1.73E+05 2.89E+04 6.31E+05 1.67E+04 Octadeca-2,9,12,15-tetraen-1-ol 5.94E+06 5.49E+06 4.99E+06 5.36E+06 7.28E+06 7.92E+06 7.21E+06 6.66E+06 8.98E+06 8.89E+06 8.27E+06 5.71E+06 8.62E+06 9.05E+06 7.10E+06 1.38E+07 8.39E+06 8.74E+06 7.20E+06 7.78E+06 8.94E+06 8.19E+06 9.39E+06 6.03E+06 Alnusonol 8.61E+06 1.19E+07 1.00E+07 1.15E+07 1.06E+07 7.75E+06 6.65E+06 8.46E+06 8.33E+06 6.69E+06 8.09E+06 9.82E+06 5.45E+06 5.48E+06 1.60E+07 1.41E+07 1.50E+07 8.14E+06 7.40E+06 6.42E+06 5.81E+06 1.39E+06 5.54E+06 8.77E+06 Ser-HoPhe-OH 2.54E+06 2.35E+06 1.98E+06 2.24E+06 2.43E+06 1.65E+06 2.01E+06 1.98E+06 1.48E+06 1.96E+06 2.03E+06 2.57E+06 2.84E+06 5.44E+06 2.67E+06 4.35E+06 3.31E+06 1.62E+06 4.92E+06 1.69E+06 1.32E+06 1.47E+06 2.38E+06 1.57E+06 N-p-Coumaroyloctopamine 2.66E+05 1.89E+05 1.79E+05 2.09E+05 1.76E+05 1.78E+05 1.55E+05 2.06E+05 2.48E+05 8.47E+04 1.48E+05 2.20E+05 1.19E+05 6.70E+04 2.58E+05 1.00E+05 1.23E+05 1.02E+05 1.65E+05 1.89E+05 1.79E+05 1.25E+05 2.18E+05 1.67E+05 (2S)-2-[(1R)-1-carboxyethoxy]propanoic acid 3.11E+05 3.11E+05 3.05E+05 3.90E+05 4.07E+05 4.69E+05 3.86E+05 3.17E+05 3.00E+05 3.04E+05 3.45E+05 3.89E+05 3.06E+05 2.09E+05 3.19E+05 3.32E+05 4.51E+05 3.09E+05 2.54E+05 3.43E+05 2.26E+05 2.61E+05 2.23E+05 2.63E+05 alpha-Asarone* 1.33E+05 4.42E+04 1.11E+05 1.11E+04 7.90E+04 1.41E+05 1.86E+05 9.86E+04 3.36E+05 1.97E+05 9.01E+05 2.97E+05 1.18E+05 2.16E+05 2.39E+05 1.72E+05 1.92E+05 3.43E+05 2.39E+05 7.54E+06 3.78E+04 2.37E+04 7.57E+04 3.63E+04 saikolignanoside D* 1.63E+06 1.45E+06 1.50E+06 1.79E+06 1.16E+06 1.16E+06 1.27E+06 9.41E+05 2.20E+06 8.02E+05 6.01E+05 9.78E+05 1.48E+06 5.85E+05 2.19E+06 8.09E+05 8.02E+05 2.58E+06 6.72E+05 1.46E+06 9.46E+05 8.42E+05 2.13E+06 2.28E+06 2-Aminododecane-1,3,4-triol 2.21E+06 7.58E+06 7.55E+06 4.40E+06 3.31E+06 3.49E+06 4.31E+06 8.18E+06 3.32E+06 3.53E+06 7.12E+06 7.70E+06 7.82E+06 3.33E+06 3.33E+06 3.82E+06 3.85E+06 7.98E+06 3.79E+06 4.18E+06 3.52E+06 7.81E+06 7.71E+06 3.08E+06 γ-Glutamyltyrosine 1.76E+05 6.13E+05 1.71E+05 3.32E+05 2.16E+05 1.32E+05 5.10E+05 4.68E+05 1.27E+05 2.44E+05 9.14E+04 2.17E+05 3.48E+05 7.13E+04 2.00E+05 2.24E+05 2.85E+05 2.43E+05 2.03E+05 2.30E+05 2.86E+05 1.36E+05 1.91E+05 7.39E+05 Lys-Phe 3.22E+05 5.80E+05 6.00E+05 4.10E+05 9.53E+05 9.37E+05 3.70E+05 2.79E+05 6.61E+05 3.10E+05 6.31E+05 1.08E+06 3.43E+05 1.80E+05 3.28E+05 2.48E+05 3.43E+05 5.75E+05 3.59E+05 7.49E+05 1.99E+05 4.10E+05 8.18E+05 4.07E+05 LysoPC 18:3 5.27E+06 2.64E+06 4.78E+06 5.05E+06 5.53E+06 2.32E+06 7.88E+06 7.66E+06 3.65E+06 7.20E+06 4.93E+06 8.99E+06 1.09E+06 2.40E+06 2.85E+06 3.50E+06 8.48E+06 7.92E+06 3.98E+06 4.65E+06 9.24E+05 1.86E+06 1.52E+06 3.14E+06 Riboprine 1.17E+04 4.03E+04 1.51E+05 1.39E+05 3.17E+05 1.01E+04 7.12E+04 3.58E+04 3.23E+04 2.29E+04 1.09E+05 4.37E+04 7.77E+05 4.42E+04 1.35E+05 1.90E+04 2.91E+04 4.17E+04 1.05E+05 3.04E+05 1.31E+06 1.62E+05 5.15E+04 1.90E+05 N-Methyltryptamine 2.39E+06 1.80E+06 2.76E+06 2.22E+06 1.67E+06 1.25E+06 1.74E+06 1.83E+06 2.05E+06 1.93E+06 1.26E+06 2.03E+06 1.39E+06 6.98E+05 2.09E+06 1.49E+06 1.96E+06 2.30E+06 1.46E+06 1.41E+06 1.15E+06 1.66E+06 1.70E+06 1.49E+06 3-hydroxybenzaldehyde 4.76E+06 6.59E+06 7.83E+06 3.36E+06 6.36E+06 7.29E+06 5.01E+06 6.70E+06 6.63E+06 4.48E+06 7.46E+06 1.18E+07 6.07E+06 1.05E+07 3.35E+06 5.34E+06 7.32E+06 7.33E+06 6.76E+06 2.96E+06 5.58E+06 4.76E+06 3.06E+06 9.11E+06 Chrysosplenoside C-O-glucoside 1.56E+05 9.64E+05 3.11E+05 1.11E+05 1.29E+05 1.80E+05 2.63E+05 2.85E+05 2.88E+05 2.28E+05 1.29E+05 1.08E+05 1.24E+06 1.03E+05 1.20E+05 1.16E+05 4.29E+05 8.99E+04 2.94E+05 2.41E+05 8.58E+05 2.45E+05 4.79E+05 6.58E+05 1-α-Linolenoyl-glycerol* 6.82E+06 5.31E+06 5.95E+06 2.43E+06 7.61E+06 5.98E+06 6.20E+06 1.02E+07 1.26E+07 1.13E+06 9.82E+06 1.30E+07 4.83E+06 1.73E+05 5.52E+06 6.50E+05 5.63E+06 9.11E+06 1.31E+06 5.45E+06 2.35E+06 5.78E+05 5.12E+05 1.97E+07 Allopurinol 7.44E+04 2.17E+05 2.29E+05 1.18E+05 2.80E+05 2.60E+05 1.22E+05 1.70E+05 8.88E+04 1.07E+05 1.63E+05 1.06E+05 4.29E+05 5.66E+04 4.86E+04 6.87E+04 1.54E+05 4.28E+04 2.43E+05 9.06E+04 1.40E+05 3.79E+05 4.80E+05 2.96E+05 Stearidonic acid 2.17E+05 2.45E+05 2.89E+05 2.25E+05 2.82E+05 3.42E+05 2.95E+05 3.24E+05 3.16E+05 3.55E+05 1.93E+05 2.84E+05 2.85E+05 2.79E+05 2.93E+05 4.30E+05 3.13E+05 3.42E+05 2.34E+05 2.38E+05 3.10E+05 3.29E+05 2.63E+05 3.45E+05 Glu-Arg 1.11E+05 1.68E+05 1.86E+05 1.34E+05 1.76E+04 9.73E+04 1.26E+05 1.32E+05 2.30E+05 1.39E+05 1.51E+05 1.70E+05 2.03E+05 1.27E+05 1.60E+05 1.12E+05 1.53E+05 1.57E+05 1.37E+05 1.86E+05 1.65E+05 2.30E+05 1.28E+05 1.38E+05 4-Hydroxymandelonitrile 3.37E+05 5.46E+05 5.56E+05 2.15E+05 4.21E+05 1.28E+05 2.88E+05 2.63E+05 4.56E+05 1.30E+05 9.19E+05 2.79E+05 1.22E+06 7.48E+04 2.29E+05 2.86E+04 3.57E+05 4.77E+05 4.54E+05 3.09E+05 1.20E+06 3.05E+05 1.44E+06 3.51E+05 sanshodiol 4.47E+05 5.06E+05 4.27E+05 3.70E+05 4.46E+05 5.10E+05 6.44E+05 9.35E+05 3.96E+05 5.45E+05 9.14E+05 5.13E+05 6.48E+05 8.40E+05 4.36E+05 6.24E+05 6.90E+05 4.76E+05 6.68E+05 1.12E+06 9.44E+05 3.83E+05 8.34E+05 1.11E+06 dehydroconiferyl alcohol 1.84E+06 3.13E+06 6.81E+06 3.84E+06 3.61E+06 4.08E+06 3.95E+06 1.08E+06 1.13E+06 6.67E+06 3.88E+06 5.41E+06 4.63E+06 2.31E+06 7.76E+06 4.05E+06 3.91E+06 2.97E+06 2.13E+06 4.79E+06 5.15E+06 2.25E+06 4.93E+06 4.89E+06 Pyridoxal 8.91E+04 5.38E+04 1.07E+05 8.66E+04 1.04E+05 1.03E+05 1.05E+05 9.67E+04 1.94E+04 7.51E+04 7.07E+04 1.43E+05 1.43E+05 3.09E+04 6.70E+04 5.23E+04 4.55E+04 3.89E+04 7.27E+04 9.58E+04 1.77E+05 4.82E+04 7.15E+04 8.00E+04 Chrysin 1.36E+05 1.52E+05 1.77E+05 1.40E+05 1.66E+05 2.18E+05 1.58E+05 1.67E+05 1.59E+05 1.63E+05 1.31E+05 1.52E+05 1.46E+05 1.41E+05 1.62E+05 1.52E+05 1.44E+05 1.37E+05 1.28E+05 1.71E+05 1.26E+05 1.30E+05 1.52E+05 1.70E+05 Methyl (6-O-4-hydroxybenzoyl)-α-D-glucoside 1.06E+06 7.12E+05 6.03E+05 1.18E+06 3.44E+05 1.48E+05 3.68E+05 4.70E+05 5.36E+05 4.06E+05 2.58E+05 3.18E+05 4.06E+05 4.51E+05 1.28E+06 3.16E+05 6.94E+05 1.14E+06 3.50E+05 8.77E+05 4.37E+05 4.39E+05 4.55E+05 1.55E+06 Isonicotinic acid 1.45E+07 2.86E+07 1.91E+07 9.17E+06 1.80E+07 2.84E+07 1.69E+07 1.52E+07 2.78E+07 1.89E+07 3.60E+07 3.12E+07 3.99E+07 7.76E+06 1.36E+07 5.39E+06 1.60E+07 3.21E+07 1.86E+07 2.66E+07 2.87E+07 3.23E+07 2.39E+07 1.99E+07 N7-Methylguanosine 4.77E+04 9.35E+04 1.46E+05 5.07E+04 3.16E+04 6.41E+04 9.21E+04 8.75E+04 7.97E+04 1.27E+05 9.02E+04 1.13E+05 1.72E+05 7.32E+04 4.45E+04 8.49E+04 1.59E+05 9.62E+04 9.06E+04 1.49E+05 9.82E+04 4.51E+04 4.12E+04 7.68E+04 Isocytosine 6.79E+04 7.11E+04 6.49E+04 1.11E+05 7.25E+04 6.49E+04 1.02E+05 6.87E+04 6.22E+04 6.89E+04 7.21E+04 7.85E+04 1.02E+05 3.74E+04 9.23E+04 4.71E+04 4.13E+04 8.90E+04 8.48E+04 2.35E+05 1.06E+05 4.64E+05 7.81E+04 7.34E+04 N,N'-Dimethylarginine;SDMA* 1.93E+05 5.26E+05 2.99E+05 3.95E+05 3.86E+05 1.74E+05 2.64E+05 3.04E+05 4.44E+05 2.43E+05 3.23E+05 3.07E+05 5.14E+05 1.50E+05 3.29E+05 9.21E+04 3.22E+05 1.37E+05 3.74E+05 4.86E+05 6.20E+05 9.73E+05 1.00E+06 3.78E+05 Gln-Ser-Tyr 5.59E+06 5.01E+06 3.09E+06 7.46E+06 3.13E+06 2.46E+06 2.33E+06 5.73E+06 5.61E+06 2.22E+06 2.19E+06 2.33E+06 4.72E+06 3.65E+06 8.45E+06 1.12E+06 5.60E+06 5.10E+06 4.10E+06 4.39E+06 3.68E+06 5.03E+06 4.52E+06 6.77E+06 L-Lysine 4.69E+05 5.04E+05 5.20E+05 1.35E+05 6.87E+05 3.34E+05 2.14E+06 8.38E+05 6.17E+05 6.53E+05 6.32E+05 7.04E+05 1.59E+06 9.00E+04 1.10E+05 3.79E+04 3.31E+05 2.48E+06 1.61E+05 2.71E+06 2.35E+06 1.07E+06 1.16E+06 1.84E+06 Isopentenyladenine-7-N-glucoside 6.75E+06 8.66E+06 6.70E+06 8.92E+06 9.22E+06 1.11E+07 4.56E+06 6.37E+06 8.62E+06 5.16E+06 5.35E+06 5.41E+06 6.61E+06 3.09E+06 8.58E+06 1.69E+06 5.53E+06 5.61E+06 8.72E+06 5.27E+06 5.98E+06 5.09E+06 7.92E+06 5.15E+06 Glycyl-L-leucine 1.13E+05 2.27E+05 1.65E+05 1.08E+05 1.21E+05 1.27E+05 1.69E+05 1.47E+05 2.95E+05 1.15E+05 1.48E+05 1.86E+05 3.17E+05 3.44E+04 9.75E+04 2.81E+04 1.82E+05 9.44E+04 3.16E+05 1.90E+05 1.48E+05 1.27E+05 5.54E+05 1.64E+05 Grevilloside E 6.51E+05 7.26E+05 9.43E+05 6.01E+05 7.22E+05 3.73E+05 4.70E+05 4.59E+05 7.69E+05 4.71E+05 5.70E+05 6.82E+05 4.60E+05 3.25E+05 7.08E+05 4.67E+05 4.94E+05 7.35E+05 4.71E+05 6.30E+05 6.21E+05 5.85E+05 8.17E+05 6.32E+05 Lepadin D 5.34E+06 5.63E+06 3.47E+06 4.59E+06 5.83E+06 6.23E+06 4.31E+06 4.63E+06 8.23E+06 6.75E+06 7.05E+06 4.21E+06 7.04E+06 7.72E+06 7.29E+06 1.14E+07 6.85E+06 7.66E+06 4.03E+06 5.69E+06 7.76E+06 6.09E+06 8.06E+06 5.68E+06 3-Hydroxy-23-oxoolean-12-en-28-oic acid (Gypsogenin) 1.75E+05 8.80E+04 1.31E+05 3.64E+04 2.14E+05 6.77E+04 3.18E+05 1.69E+05 2.48E+05 3.89E+05 4.57E+05 5.54E+05 3.20E+05 4.23E+05 1.99E+05 3.67E+05 2.53E+05 2.53E+05 9.45E+05 4.53E+05 1.33E+05 5.08E+04 1.61E+05 2.24E+05 Xanthurenate-8-O-beta-D-glucoside 6.39E+07 4.25E+07 6.44E+07 4.43E+07 4.80E+07 3.96E+07 3.47E+07 4.89E+07 6.31E+07 2.68E+07 3.29E+07 5.16E+07 8.41E+07 1.67E+07 4.43E+07 5.50E+07 4.00E+07 3.64E+07 4.86E+07 4.96E+07 4.29E+07 4.74E+07 3.26E+07 4.43E+07 β-Nicotinamide mononucleotide 5.19E+06 8.04E+06 1.65E+07 6.19E+05 4.82E+06 7.24E+06 7.15E+07 3.89E+06 5.44E+06 2.96E+07 3.39E+07 1.28E+07 4.20E+06 2.04E+06 2.84E+06 9.49E+05 1.04E+07 4.20E+06 1.99E+06 2.20E+07 1.11E+07 1.82E+06 1.80E+06 1.05E+07 Hedyotol C 1.73E+05 1.92E+05 3.61E+06 3.65E+05 3.89E+05 6.47E+05 2.02E+06 3.01E+05 7.54E+05 4.02E+06 2.01E+06 7.87E+05 8.98E+05 1.18E+07 5.32E+05 1.76E+07 1.78E+06 2.32E+06 7.52E+05 8.24E+05 1.44E+06 2.47E+06 3.74E+05 2.10E+05 (R)-Mandelamide 3.42E+05 5.11E+05 1.80E+05 2.44E+05 3.34E+05 2.56E+05 9.74E+04 1.62E+05 2.69E+05 1.08E+05 1.77E+05 3.49E+05 3.36E+05 1.61E+05 1.94E+05 9.96E+04 3.12E+05 2.17E+05 3.71E+05 1.66E+05 2.07E+05 3.47E+05 6.23E+05 4.47E+05 3,4-Methylenedioxy cinnamyl alcohol* 3.36E+06 2.06E+06 3.07E+06 4.11E+06 1.10E+07 6.08E+06 4.45E+06 5.42E+06 3.01E+06 5.43E+06 6.05E+06 4.36E+06 3.99E+06 4.48E+06 4.05E+06 4.41E+06 4.70E+06 4.17E+06 7.12E+06 5.55E+06 1.34E+07 4.96E+06 4.69E+06 5.25E+06 O-benzyl-L-serine 1.77E+05 1.50E+06 8.28E+06 3.33E+05 9.28E+05 2.74E+06 7.30E+06 7.12E+06 3.33E+05 4.50E+06 3.58E+06 2.24E+06 1.01E+06 8.63E+06 3.53E+05 2.22E+07 7.09E+06 1.98E+06 5.05E+06 1.70E+06 7.13E+05 2.47E+06 1.99E+06 2.31E+05 2,4,6-Trihydroxybenzoic acid 4.30E+05 3.28E+05 2.43E+05 2.02E+05 2.26E+05 2.68E+05 3.56E+05 1.62E+05 2.33E+05 3.67E+05 1.27E+05 2.33E+05 1.28E+05 7.44E+04 2.23E+05 2.99E+05 4.07E+05 3.82E+05 2.84E+05 2.26E+05 1.38E+05 9.64E+04 1.45E+05 1.12E+05 Dihydroisopelletierine 4.77E+05 4.52E+05 3.12E+05 5.12E+05 4.15E+05 4.08E+05 6.24E+05 3.30E+05 1.65E+05 4.69E+05 5.58E+05 4.72E+05 5.17E+05 3.02E+05 9.47E+05 3.23E+05 5.42E+05 3.06E+05 2.30E+05 1.06E+06 3.42E+05 3.73E+05 3.60E+05 3.01E+05 7-Hydroxycoumarin;Umbelliferone 1.60E+06 5.36E+06 3.95E+06 5.35E+05 3.48E+06 5.47E+06 1.83E+07 4.15E+06 2.11E+06 1.43E+07 1.24E+07 1.13E+07 1.34E+07 2.63E+06 3.32E+06 2.90E+06 4.88E+06 3.01E+06 1.35E+07 1.26E+07 1.86E+07 6.55E+06 6.31E+06 1.07E+07 1-Methylhistidine 3.93E+04 4.76E+04 3.87E+04 4.17E+04 2.06E+04 4.42E+04 7.05E+04 5.07E+04 2.20E+04 5.52E+04 2.50E+04 4.92E+04 5.12E+04 3.92E+04 6.06E+04 4.07E+04 5.12E+04 5.81E+04 5.73E+04 4.37E+04 3.98E+04 2.67E+04 2.36E+04 4.90E+04 (1-Acetyl-5-methoxyindoline-2-yl)acetonitrile 0.00E+00 0.00E+00 0.00E+00 0.00E+00 1.27E+05 1.10E+05 1.19E+05 1.28E+05 1.66E+05 6.68E+04 1.25E+05 1.11E+05 1.25E+05 5.17E+04 1.38E+05 5.97E+04 1.54E+05 1.95E+05 1.52E+05 1.23E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 Nicotinic acid (Vitamin B3) 1.23E+06 1.58E+06 3.60E+06 1.66E+06 2.39E+06 4.60E+06 3.15E+06 2.28E+06 2.23E+06 2.58E+06 5.39E+06 3.12E+06 5.91E+06 1.60E+06 1.83E+06 1.55E+06 2.74E+06 1.61E+06 5.89E+06 5.67E+06 5.64E+06 3.26E+06 5.56E+06 1.14E+06 Fargesin* 1.25E+07 1.38E+07 1.19E+07 5.79E+06 2.04E+07 9.38E+06 1.11E+07 1.42E+07 1.42E+07 9.00E+06 5.21E+06 9.16E+06 1.20E+07 4.38E+06 1.66E+07 6.13E+06 1.92E+07 1.32E+07 9.80E+06 1.02E+07 4.52E+06 1.08E+07 1.19E+07 1.12E+07 LysoPE 18:2 4.45E+06 2.08E+06 3.18E+06 7.48E+06 3.73E+06 1.36E+06 9.74E+05 1.83E+06 3.30E+06 8.48E+05 1.67E+06 2.15E+06 9.94E+05 2.27E+05 2.51E+06 5.44E+05 5.71E+06 4.99E+06 1.64E+06 2.12E+06 7.61E+05 2.67E+06 1.72E+06 1.34E+06 6-Methylnicotinamide 2.57E+06 1.04E+06 8.71E+05 1.35E+06 1.01E+06 8.79E+05 2.20E+06 5.38E+05 5.92E+05 6.20E+06 8.02E+05 7.37E+05 8.91E+05 3.40E+05 7.45E+05 4.29E+05 1.32E+06 1.53E+06 9.36E+05 1.43E+06 8.44E+05 4.94E+05 4.71E+05 1.88E+06 N,N-Dimethylformamide 1.40E+05 1.84E+05 1.78E+05 1.87E+05 2.02E+05 1.94E+05 1.85E+05 1.76E+05 1.57E+05 1.93E+05 1.41E+05 1.82E+05 1.28E+05 1.46E+05 1.58E+05 1.51E+05 1.83E+05 1.52E+05 1.29E+05 1.61E+05 2.01E+05 1.70E+05 1.53E+05 1.74E+05 Hispanolone 1.18E+05 5.38E+04 3.27E+05 6.89E+04 1.33E+05 3.23E+05 1.95E+05 4.41E+05 1.50E+05 3.27E+05 1.96E+05 1.72E+05 4.51E+05 1.10E+05 9.60E+04 6.99E+05 1.73E+05 1.22E+05 3.88E+05 2.03E+05 9.85E+04 1.10E+05 1.52E+05 1.83E+05 Monolinolenin* 3.66E+06 4.43E+06 3.11E+06 9.34E+05 3.72E+06 5.41E+06 7.80E+06 4.63E+06 6.95E+06 1.88E+06 9.05E+06 6.83E+06 3.99E+06 4.37E+05 2.48E+06 5.80E+05 3.85E+06 3.61E+06 1.48E+06 3.42E+06 2.89E+06 6.95E+05 7.47E+05 1.22E+07 5,8-Dihydroxy-1,4-naphthoquinone 2.44E+06 1.16E+06 1.89E+06 6.17E+05 1.30E+06 2.44E+06 1.19E+06 3.12E+06 1.40E+06 1.26E+06 2.34E+06 2.37E+06 3.11E+06 1.75E+06 1.23E+06 8.37E+05 1.02E+06 3.37E+06 1.07E+06 7.32E+05 1.66E+06 3.40E+05 4.55E+06 8.64E+05 (S)-2-Phenyloxirane 3.45E+06 3.36E+07 1.34E+06 1.34E+07 2.26E+06 3.38E+06 1.01E+06 2.30E+07 3.25E+07 2.26E+06 2.39E+06 8.62E+05 1.78E+06 1.10E+06 7.08E+06 2.57E+05 1.95E+07 3.24E+06 5.86E+06 3.89E+06 3.77E+06 7.24E+06 4.69E+06 3.87E+06 11,12-epoxy-13-hydroxy-3-Oxooleanane-28-oic acid gamma-lactone (Liquidambaric Lactone) 5.15E+03 2.07E+04 7.93E+04 1.14E+04 1.42E+04 7.82E+04 2.04E+05 6.28E+04 4.71E+04 1.32E+05 5.78E+04 1.16E+05 2.97E+04 5.29E+04 1.91E+04 2.45E+04 1.21E+05 8.54E+03 4.02E+05 5.27E+04 1.73E+04 2.93E+04 4.23E+04 8.54E+03 α-Conidendrin 5.09E+07 1.03E+08 6.94E+07 7.94E+07 6.98E+07 5.56E+07 6.97E+07 7.43E+07 1.15E+08 7.94E+07 8.59E+07 1.36E+08 1.33E+08 4.66E+07 1.89E+08 1.98E+07 1.25E+08 1.29E+08 7.95E+07 1.35E+08 1.34E+08 5.90E+07 4.30E+07 2.32E+08 N-Acetylcadaverine 3.50E+05 4.08E+05 3.26E+05 3.06E+05 2.57E+05 2.24E+05 3.28E+05 4.29E+05 2.91E+05 3.10E+05 2.49E+05 2.85E+05 3.65E+05 2.98E+05 4.59E+05 2.66E+05 3.12E+05 3.73E+05 3.74E+05 3.18E+05 2.78E+05 2.80E+05 3.54E+05 3.28E+05 Magnolin 2.38E+07 2.98E+07 3.39E+07 1.78E+07 2.76E+07 5.52E+07 2.98E+07 3.10E+07 3.41E+07 2.07E+07 8.43E+07 2.81E+07 5.70E+07 4.60E+07 2.32E+07 1.10E+08 1.09E+08 4.94E+07 2.44E+07 1.09E+08 3.69E+07 2.59E+07 2.76E+07 1.08E+07 N-Glucosyl-p-coumaroylputrescine 2.50E+04 1.37E+05 5.97E+04 5.51E+04 1.16E+05 1.10E+05 9.58E+04 3.16E+04 2.94E+04 1.05E+05 1.28E+05 1.56E+05 9.37E+04 2.25E+04 1.05E+05 1.16E+05 1.92E+05 4.93E+04 6.42E+04 1.56E+05 6.59E+04 5.36E+04 5.69E+04 2.35E+05 L-Seryl-L-Isoleucine 2.10E+04 3.48E+05 6.79E+04 3.35E+04 3.56E+04 4.85E+04 5.45E+04 1.89E+04 1.51E+05 4.10E+04 1.06E+05 5.08E+04 3.50E+05 1.51E+04 4.61E+04 4.16E+03 1.35E+05 1.26E+04 5.25E+05 1.49E+05 1.36E+05 1.94E+05 2.65E+05 5.89E+04 Putrescine 6.42E+04 1.20E+05 1.22E+05 1.02E+05 1.00E+05 1.32E+05 1.69E+05 4.09E+04 1.26E+05 4.21E+04 2.14E+05 1.41E+05 6.60E+04 6.27E+04 6.23E+04 6.94E+04 1.92E+05 1.42E+05 9.85E+04 1.20E+05 1.11E+05 9.33E+04 1.05E+05 1.22E+05 Methyl 8,9-epoxypimaran-18-oate 2.70E+05 1.17E+05 1.41E+05 8.82E+04 1.62E+05 1.11E+05 3.43E+05 2.34E+05 2.21E+05 4.09E+05 7.66E+05 5.10E+05 4.28E+05 5.60E+05 3.82E+05 3.89E+05 1.51E+05 4.70E+05 6.61E+05 2.57E+05 1.48E+05 1.06E+05 2.26E+05 1.71E+05 2-Phenylethy-1-O-β-D-glucoside 2.17E+05 6.30E+05 7.85E+05 2.02E+05 4.75E+05 1.31E+06 3.59E+05 3.93E+05 6.58E+05 5.64E+05 1.60E+06 1.53E+06 1.20E+06 3.97E+05 4.61E+05 6.51E+05 1.05E+06 1.11E+06 8.68E+05 5.69E+05 6.64E+05 8.12E+05 3.09E+05 1.61E+06 4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid 2.72E+07 1.76E+07 2.82E+07 1.66E+07 2.05E+07 1.46E+07 1.57E+07 2.07E+07 2.30E+07 1.49E+07 1.25E+07 2.15E+07 4.04E+07 7.80E+06 1.97E+07 2.35E+07 1.62E+07 1.72E+07 2.03E+07 2.48E+07 1.75E+07 2.24E+07 1.80E+07 1.50E+07 3-amino-2-naphthoic acid* 1.54E+06 9.17E+05 4.91E+05 8.65E+05 2.13E+06 1.12E+06 1.42E+06 4.74E+05 2.20E+06 8.33E+05 1.73E+06 5.84E+06 2.04E+06 6.22E+04 1.02E+06 3.71E+04 3.13E+05 7.41E+05 1.94E+05 3.58E+06 2.38E+06 1.66E+06 5.19E+05 2.47E+06 Dihydroferuloylputrescine 4.55E+05 1.72E+05 6.46E+05 2.91E+05 5.73E+05 3.13E+05 3.93E+05 5.78E+05 5.03E+05 4.29E+05 4.71E+05 4.66E+05 3.82E+05 1.85E+05 5.89E+05 4.31E+05 2.74E+05 5.11E+05 3.41E+05 2.46E+05 2.53E+05 3.32E+05 1.10E+05 6.04E+04 Dimethyl phthalate 1.20E+06 7.48E+05 7.17E+05 8.38E+05 8.91E+05 8.19E+05 8.95E+05 8.83E+05 9.37E+05 7.78E+05 6.34E+05 8.73E+05 7.08E+05 6.54E+05 1.09E+06 6.52E+05 7.51E+05 9.10E+05 5.08E+05 6.50E+05 7.41E+05 8.06E+05 8.23E+05 8.88E+05 3,7-Dihydroxychromen-4-one 1.73E+06 2.31E+06 2.54E+06 1.82E+06 2.07E+06 9.92E+05 8.83E+05 1.91E+06 2.13E+06 2.58E+06 2.25E+06 2.40E+06 7.67E+05 2.46E+06 2.56E+06 1.48E+06 2.60E+06 2.17E+06 1.86E+06 2.47E+06 2.30E+06 1.16E+06 1.74E+06 3.01E+06 5-Acetonyl-6-glucosyl-7-hydroxy-2,6-methylchromone 8.17E+05 7.36E+05 7.22E+05 8.25E+05 9.20E+05 8.80E+05 5.53E+05 2.39E+05 6.33E+05 6.86E+05 4.19E+05 6.87E+05 3.60E+05 5.61E+05 8.86E+05 5.06E+05 7.44E+05 8.12E+05 7.68E+05 6.76E+05 9.14E+05 8.37E+05 6.97E+05 7.22E+05 3,5-Dimethoxy-4-hydroxybenzaldehyde 5.41E+05 5.28E+05 4.59E+05 4.13E+05 6.54E+05 7.92E+05 1.16E+06 3.19E+05 3.12E+05 8.83E+05 1.05E+06 1.78E+06 6.17E+05 9.83E+06 7.14E+05 1.20E+06 1.06E+06 4.51E+05 5.64E+06 9.62E+05 2.72E+05 3.65E+05 8.56E+05 3.16E+05 2,4,2',4'-tetrahydroxy-3'-prenylchalcone 8.07E+06 3.14E+06 1.75E+07 6.27E+06 4.35E+06 7.55E+06 1.15E+07 1.74E+07 5.98E+06 1.08E+07 9.52E+06 1.06E+07 1.06E+07 1.73E+07 5.22E+06 2.06E+07 2.29E+07 1.15E+07 1.47E+07 3.69E+07 1.38E+07 1.52E+07 1.72E+07 2.49E+07 3,4-Secodammara-4(28),20,24-trien-3,26-dioic acid 1.20E+06 1.20E+05 3.75E+05 8.48E+04 3.76E+05 2.52E+05 2.56E+06 1.15E+06 6.40E+05 2.80E+06 2.76E+06 3.10E+06 1.26E+06 1.39E+06 9.46E+05 2.70E+06 1.90E+06 1.57E+06 1.59E+06 7.86E+05 6.46E+05 1.03E+05 2.02E+05 4.16E+04 2-tert-Butyl-1,4-benzoquinone 1.25E+06 3.80E+05 1.21E+06 4.67E+05 4.11E+05 1.06E+06 1.86E+06 1.19E+06 6.60E+05 1.14E+06 9.83E+05 6.59E+05 1.87E+06 4.63E+05 5.07E+05 2.20E+06 1.12E+06 1.27E+06 4.69E+05 7.32E+05 8.64E+05 8.61E+05 9.70E+05 8.05E+05 Phe-Thr 1.20E+05 8.71E+05 1.96E+05 1.09E+05 2.51E+05 1.77E+05 1.89E+05 8.53E+04 8.33E+05 1.20E+05 5.25E+05 2.33E+05 1.07E+06 4.77E+04 1.89E+05 5.87E+04 4.75E+05 7.79E+04 1.54E+06 4.58E+05 2.79E+05 4.97E+05 1.05E+06 3.09E+04 saffloquinoside A 3.92E+05 1.32E+06 1.05E+06 6.02E+05 8.31E+05 1.42E+06 7.27E+05 1.06E+06 9.25E+05 5.78E+05 9.77E+05 6.58E+05 9.09E+05 3.89E+05 6.78E+05 1.37E+06 9.14E+05 7.94E+05 9.84E+05 7.18E+05 4.22E+05 2.55E+05 4.77E+05 4.54E+05 Citroside A 8.54E+05 4.43E+05 2.45E+06 5.16E+05 9.19E+05 1.35E+06 1.22E+06 5.90E+05 7.88E+05 6.24E+05 1.20E+06 7.13E+05 1.56E+06 3.02E+05 4.22E+05 5.69E+05 1.09E+06 7.80E+05 4.36E+05 3.22E+05 4.86E+05 2.12E+05 5.65E+05 4.72E+05 Thr-Tyr 1.28E+05 9.56E+04 7.35E+04 1.25E+05 7.44E+04 1.14E+05 5.38E+05 1.17E+05 1.77E+05 2.44E+05 1.54E+05 1.95E+05 2.11E+05 1.00E+06 2.45E+05 3.94E+05 2.65E+05 1.45E+05 3.10E+05 4.43E+05 5.54E+04 7.38E+04 1.58E+05 1.15E+05 D-Panthenol 1.91E+04 1.38E+04 2.60E+04 2.30E+04 1.79E+04 2.31E+04 6.00E+04 1.61E+04 8.97E+03 1.47E+04 4.83E+04 2.56E+04 6.52E+03 3.50E+04 6.12E+03 3.33E+04 1.17E+04 3.42E+04 1.23E+04 1.56E+04 9.91E+03 3.83E+04 4.00E+04 1.87E+04 Isosalipurposide-6''-O-p-coumaric acid 9.68E+04 2.36E+05 6.53E+04 5.36E+04 7.49E+04 7.24E+04 1.97E+05 1.62E+05 1.22E+05 1.05E+05 6.99E+04 1.22E+05 1.36E+05 2.04E+04 7.36E+04 6.91E+04 2.85E+05 8.57E+04 5.68E+04 6.35E+04 1.43E+05 8.21E+04 7.93E+04 1.75E+05 osmanthuside F 6.61E+05 8.00E+05 9.99E+05 9.76E+05 1.17E+06 6.65E+05 3.38E+05 9.81E+05 1.25E+06 2.68E+05 6.12E+05 1.23E+06 7.52E+05 3.91E+05 8.63E+05 4.57E+05 8.75E+05 1.32E+06 6.81E+05 6.44E+05 5.78E+05 7.40E+05 4.47E+05 9.12E+05 Nicotinic acid adenine dinucleotide 2.95E+05 2.96E+05 2.42E+05 2.08E+05 5.22E+05 2.76E+04 1.12E+05 3.81E+05 9.70E+05 1.30E+05 2.93E+05 5.71E+05 5.50E+04 9.29E+04 2.08E+05 7.01E+04 3.45E+05 7.70E+05 1.26E+05 1.02E+06 4.45E+04 2.85E+05 2.71E+05 5.65E+05 Scrophuside 2.22E+05 1.66E+05 8.81E+04 1.26E+05 1.05E+05 3.30E+05 6.17E+04 1.80E+05 1.02E+05 9.98E+04 1.19E+05 2.34E+05 3.29E+05 1.05E+05 1.22E+05 1.18E+05 9.11E+04 3.10E+05 1.82E+05 2.22E+05 3.97E+05 1.42E+05 7.94E+04 4.34E+05 5,7-dihydroxy-6-methyl-3-(2',4'-dihydroxybenzyl)-chroman-4-one 1.06E+05 6.94E+04 1.98E+05 3.48E+04 9.48E+04 1.49E+05 8.61E+04 2.91E+05 9.20E+04 6.29E+04 1.01E+05 1.12E+05 1.29E+05 5.06E+05 4.87E+04 1.24E+05 8.58E+04 1.38E+05 4.89E+04 7.04E+04 2.11E+04 5.04E+04 6.93E+04 9.00E+04 8-Hydroxycoumarin 1.58E+06 2.06E+06 9.48E+05 9.38E+05 1.68E+06 2.95E+05 2.83E+06 2.55E+06 1.40E+06 5.00E+06 9.60E+05 4.00E+06 8.12E+05 7.19E+05 1.19E+06 8.24E+05 8.13E+05 1.28E+06 2.43E+06 1.10E+06 5.04E+05 4.87E+05 1.00E+06 3.58E+05 3-Hydroxy-beta-ionol 3-(6''-Malonyl)Glucoside 2.51E+04 3.74E+04 2.70E+04 2.10E+04 1.51E+04 1.03E+04 5.98E+04 2.83E+04 3.18E+04 8.76E+04 4.88E+04 3.69E+04 2.82E+04 6.40E+04 1.32E+04 1.23E+04 3.60E+04 4.00E+04 4.67E+04 4.00E+04 0.00E+00 0.00E+00 0.00E+00 0.00E+00 Ethyl phenylacetate 1.71E+05 1.95E+05 5.41E+05 1.89E+05 1.45E+05 2.18E+05 4.73E+05 3.34E+05 1.45E+05 2.29E+05 3.32E+05 2.01E+05 2.53E+05 5.84E+05 1.65E+05 3.39E+05 2.62E+05 1.54E+05 2.65E+05 3.48E+05 1.52E+05 1.40E+05 1.87E+05 1.62E+05 Piperonal 3.87E+06 8.78E+06 3.68E+06 1.81E+06 2.07E+06 3.22E+06 5.87E+06 5.86E+06 8.69E+06 6.54E+06 3.34E+06 2.69E+06 1.08E+07 3.77E+06 2.05E+06 9.43E+05 4.87E+06 2.72E+06 2.30E+06 2.63E+06 4.61E+06 2.40E+06 7.45E+06 3.90E+06 3,4,5-Trihydroxy-6-[4-(4-methyl-3-oxopentyl)phenoxy]oxane-2-carboxylic acid 2.35E+06 1.06E+06 2.21E+06 8.79E+05 2.67E+06 1.38E+06 2.75E+06 7.71E+05 1.10E+06 1.61E+06 1.25E+06 1.40E+06 5.91E+05 1.02E+06 1.28E+06 1.12E+06 1.03E+06 2.70E+06 8.58E+05 3.17E+05 4.04E+05 7.23E+05 5.04E+05 3.33E+05 5-Acetylsalicylic acid 1.18E+06 8.90E+05 8.26E+05 9.63E+05 1.56E+06 1.33E+06 5.52E+05 5.15E+05 1.02E+06 6.29E+05 8.68E+05 8.30E+05 9.35E+05 1.38E+06 9.48E+05 4.66E+05 5.78E+05 6.90E+05 6.44E+05 4.81E+05 7.22E+05 1.73E+06 8.35E+05 5.60E+05 7-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-6-methoxychromen-2-one 1.80E+04 4.58E+03 5.64E+03 6.50E+03 1.30E+04 1.18E+04 9.40E+03 1.46E+04 3.24E+04 1.52E+04 1.61E+04 1.04E+04 8.25E+04 4.34E+04 2.18E+04 8.75E+03 7.06E+04 4.36E+04 5.31E+06 1.29E+04 2.62E+04 2.05E+04 1.12E+04 6.50E+03 Hordenine 5.48E+05 3.06E+05 3.43E+05 5.68E+05 4.23E+05 3.27E+05 4.55E+05 3.41E+05 3.17E+05 3.55E+05 3.65E+05 4.19E+05 3.39E+05 3.28E+05 3.90E+05 3.16E+05 4.91E+05 4.36E+05 4.31E+05 3.24E+05 4.24E+05 3.01E+05 3.23E+05 4.18E+05 S-(5'-Adenosy)-L-homocysteine 8.37E+04 1.55E+05 1.01E+05 8.21E+04 1.43E+05 7.99E+04 7.04E+04 1.41E+05 1.57E+05 6.68E+04 1.49E+05 1.05E+05 9.72E+04 2.47E+04 7.84E+03 2.31E+04 9.54E+04 1.92E+05 1.28E+05 1.13E+05 3.90E+04 4.75E+04 1.07E+05 1.21E+05 Guanosine 5'-monophosphate 1.09E+05 4.16E+05 3.27E+05 1.04E+05 2.02E+05 1.48E+05 5.43E+05 4.22E+05 5.36E+05 7.21E+05 5.86E+05 3.95E+05 3.33E+05 5.67E+04 1.13E+05 1.55E+05 5.82E+05 1.48E+05 2.42E+05 8.96E+05 1.43E+05 5.93E+04 1.48E+05 4.27E+05 3-Methylxanthine 1.78E+06 1.55E+06 3.28E+06 1.55E+06 2.90E+06 2.58E+06 1.59E+06 8.25E+05 1.11E+06 7.75E+05 2.51E+06 2.95E+06 2.88E+06 3.94E+05 1.89E+06 1.16E+06 1.03E+06 1.26E+06 1.32E+06 1.88E+06 2.26E+06 1.37E+06 2.50E+06 1.12E+06 Grevilloside C 2.95E+06 1.13E+07 1.89E+06 2.25E+06 2.12E+06 2.12E+06 4.02E+06 2.31E+06 2.40E+06 1.38E+06 2.18E+06 1.48E+06 4.72E+06 2.32E+06 2.65E+06 1.47E+06 3.55E+06 1.70E+06 1.86E+06 1.69E+06 1.88E+06 1.72E+06 3.48E+06 3.69E+06 Phellodendroside* 1.66E+07 2.25E+07 1.25E+07 2.68E+07 2.06E+07 1.06E+07 1.37E+07 2.42E+07 2.51E+07 2.01E+07 1.35E+07 3.29E+07 3.26E+07 6.43E+06 2.68E+07 5.68E+06 2.52E+07 3.40E+07 1.37E+07 2.96E+07 2.52E+07 1.23E+07 1.04E+07 5.75E+07 Isosakuranetin-7-O-glucoside (Isosakuranin) 3.96E+05 9.22E+05 4.53E+05 1.21E+05 2.82E+05 3.59E+05 6.22E+05 6.75E+05 7.29E+05 6.88E+05 2.51E+05 3.21E+05 1.42E+06 1.85E+05 3.34E+05 1.61E+04 7.04E+05 3.11E+05 3.05E+05 4.35E+05 6.24E+05 1.35E+05 2.34E+05 2.42E+05 Fragransin B1* 1.51E+05 1.14E+06 5.69E+05 7.29E+05 1.06E+06 4.67E+05 1.72E+06 2.83E+06 2.17E+05 1.40E+06 4.51E+05 3.26E+06 1.10E+06 4.33E+05 1.86E+05 1.95E+05 1.50E+06 1.15E+05 3.17E+06 5.12E+05 2.62E+05 6.01E+04 2.35E+06 1.17E+04 LysoPE 18:3 7.43E+05 3.36E+05 4.92E+05 7.20E+05 6.65E+05 1.71E+05 2.95E+05 5.94E+05 5.01E+05 1.84E+05 2.86E+05 7.49E+05 8.09E+04 1.90E+04 3.98E+05 7.68E+04 6.88E+05 1.04E+06 1.59E+05 1.87E+05 6.38E+04 1.98E+05 9.02E+04 1.79E+05 Met-His 7.38E+05 1.04E+06 9.68E+05 1.12E+06 1.22E+06 9.96E+05 1.99E+06 7.40E+05 6.96E+05 1.63E+06 1.02E+06 1.93E+06 2.35E+06 1.84E+06 1.85E+06 8.81E+05 1.09E+06 8.49E+05 5.55E+06 4.35E+06 1.78E+06 2.47E+06 4.17E+06 2.87E+06 3,4-Dimethoxybenzoic acid; Veratric acid 1.13E+05 9.21E+04 2.64E+05 1.39E+05 1.87E+05 2.40E+05 3.47E+05 3.42E+05 2.25E+05 1.36E+05 3.33E+05 1.18E+05 5.89E+05 2.27E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 4.33E+05 2.17E+05 2.64E+05 3.53E+05 1.90E+05 5.16E+05 Thr-Asn-Tyr 1.62E+05 1.36E+05 9.93E+04 1.54E+05 1.29E+05 1.78E+05 1.56E+05 1.45E+05 1.19E+05 4.75E+05 1.95E+05 2.47E+05 3.65E+05 1.31E+05 2.28E+05 2.16E+05 1.86E+05 2.76E+05 7.52E+05 5.96E+05 2.76E+05 1.70E+05 1.38E+05 2.83E+05 8-Azaguanine 5.52E+04 1.17E+05 7.86E+04 7.98E+04 6.05E+04 8.67E+04 7.69E+04 1.33E+05 6.55E+04 1.19E+05 8.36E+04 1.44E+05 2.99E+05 9.47E+04 5.63E+04 7.94E+04 1.09E+05 5.38E+04 1.96E+05 1.52E+05 1.91E+05 1.53E+05 9.96E+04 2.29E+05 mudanoside A 1.18E+05 4.17E+04 5.32E+04 4.76E+04 5.80E+04 5.60E+04 2.78E+04 8.00E+04 1.72E+05 8.30E+04 8.67E+04 5.18E+04 3.02E+04 1.16E+05 9.92E+04 4.00E+04 6.99E+04 1.52E+05 6.80E+04 3.93E+04 8.19E+04 9.82E+04 4.28E+04 1.02E+05 (R)-Citronellol 4.63E+04 6.77E+04 9.19E+04 2.58E+04 3.88E+04 1.02E+05 4.25E+04 3.96E+04 3.11E+04 1.85E+04 6.85E+04 5.66E+04 6.12E+04 2.48E+04 5.32E+04 7.87E+04 3.36E+04 1.14E+05 7.17E+04 6.31E+04 3.09E+04 5.34E+04 4.48E+04 6.60E+04 L-Alanyl-L-Phenylalanine 7.93E+04 1.38E+05 1.53E+05 1.45E+05 1.02E+05 1.04E+05 1.30E+05 1.04E+05 1.78E+05 7.31E+04 2.18E+05 1.65E+05 3.59E+05 6.30E+04 8.96E+04 1.30E+05 1.28E+05 2.70E+05 3.61E+05 1.49E+05 1.14E+05 1.42E+05 9.27E+04 9.50E+04 Comazaphilone D 1.92E+06 2.77E+06 2.32E+06 2.11E+06 1.73E+06 1.59E+06 1.44E+06 1.78E+06 1.67E+06 1.29E+06 1.29E+06 1.62E+06 2.43E+06 9.51E+05 2.10E+06 9.41E+05 2.54E+06 1.67E+06 1.77E+06 1.75E+06 2.07E+06 2.21E+06 1.18E+06 1.47E+06 Caffeyl fraxin 1.34E+06 1.04E+06 6.63E+05 1.23E+06 6.30E+05 5.48E+05 9.78E+05 9.82E+05 7.32E+05 4.51E+05 5.64E+05 9.08E+05 6.20E+05 5.90E+05 1.13E+06 3.83E+05 5.96E+05 1.05E+06 5.19E+05 1.11E+06 4.04E+05 4.18E+05 1.23E+06 8.71E+05 Isorhamnetin-3-O-arabinoside 6.37E+03 1.27E+04 7.94E+04 4.88E+03 5.77E+03 2.70E+04 2.48E+04 2.24E+04 2.33E+04 3.77E+04 1.01E+05 1.85E+04 7.70E+04 6.28E+04 8.34E+03 4.38E+04 1.14E+05 1.06E+04 4.33E+04 1.75E+04 3.35E+04 8.11E+03 2.33E+04 2.24E+04 Dihydroxy-dimethoxyflavone-7-O-glucoside* 8.53E+05 5.67E+05 8.92E+05 4.49E+05 1.00E+06 7.86E+05 6.06E+05 3.73E+05 4.82E+05 5.27E+05 9.48E+05 7.54E+05 5.56E+05 2.05E+05 4.59E+05 5.67E+05 4.02E+05 6.51E+05 4.31E+05 3.59E+05 3.29E+05 4.11E+05 9.55E+05 3.49E+05 Histidinol 2.11E+07 2.26E+07 3.32E+07 2.35E+07 1.63E+07 1.51E+07 2.19E+07 2.67E+07 2.25E+07 2.16E+07 1.73E+07 2.26E+07 4.38E+07 2.01E+07 2.33E+07 2.44E+07 2.65E+07 3.71E+07 3.51E+07 1.35E+07 2.22E+07 2.11E+07 1.89E+07 2.28E+07 5-Methoxysalicylic acid 1.00E+05 1.53E+05 2.32E+05 1.34E+05 2.21E+05 2.08E+05 1.47E+05 2.24E+05 1.58E+05 2.44E+05 2.32E+05 1.73E+05 1.62E+05 1.03E+06 2.53E+05 2.77E+05 2.21E+05 2.25E+05 1.74E+05 1.35E+05 1.48E+05 1.90E+05 1.98E+05 1.21E+05 Nicotinic Acid Methyl Ester(Methyl Nicotinate) 7.77E+05 1.40E+06 7.09E+05 1.50E+06 7.33E+05 6.57E+05 1.09E+06 1.02E+06 8.21E+05 1.17E+06 8.27E+05 1.03E+06 1.31E+06 1.05E+06 1.08E+06 6.37E+05 1.46E+06 1.17E+06 1.14E+06 4.00E+06 8.40E+05 6.24E+05 1.27E+06 1.19E+06 Spermine 8.09E+05 7.83E+05 7.26E+05 7.72E+05 5.74E+05 4.93E+05 9.97E+05 8.05E+05 6.53E+05 8.75E+05 8.67E+05 9.19E+05 9.02E+05 8.19E+05 1.51E+06 7.75E+05 1.30E+06 1.16E+06 1.19E+06 7.57E+05 7.74E+05 8.98E+05 6.50E+05 7.16E+05 Trigonelline 2.03E+06 1.13E+06 1.30E+06 5.53E+05 4.86E+05 5.08E+05 7.60E+05 6.34E+05 6.31E+05 5.90E+05 5.99E+05 4.96E+05 4.65E+05 5.05E+05 5.38E+05 7.52E+05 3.94E+05 1.09E+06 3.97E+05 3.95E+05 3.31E+05 3.74E+05 4.70E+05 3.57E+05 acetophenone 9.32E+05 1.03E+07 1.22E+06 3.45E+06 5.75E+05 1.25E+06 1.15E+06 4.87E+06 7.96E+06 1.01E+06 1.86E+05 6.29E+05 6.57E+05 1.93E+05 1.71E+06 1.63E+05 4.91E+06 1.15E+06 1.50E+06 1.17E+06 8.92E+05 1.71E+06 1.26E+06 1.28E+06 Inosine 5'-monophosphate 4.26E+05 4.69E+05 8.11E+05 2.56E+05 5.03E+05 2.34E+05 1.05E+06 8.86E+05 9.14E+05 1.08E+06 8.73E+05 7.89E+05 6.22E+04 1.69E+05 3.44E+05 1.89E+05 9.07E+05 5.22E+05 1.06E+05 8.65E+05 1.89E+05 2.31E+05 1.48E+05 4.02E+05 N1,N10-Dihydrocaffeoylspermidine 8.50E+04 1.27E+05 5.76E+04 8.23E+04 1.63E+05 1.51E+05 9.84E+04 6.81E+04 1.09E+05 6.17E+04 2.00E+05 2.46E+05 8.94E+04 4.39E+04 1.63E+05 3.50E+04 1.26E+05 1.12E+05 1.16E+05 1.65E+05 1.51E+05 1.92E+05 3.38E+04 3.01E+05 2-Methyl-3-hydroxyindan-1-one 2.76E+06 2.77E+06 2.61E+06 3.68E+06 1.99E+06 1.98E+06 1.68E+06 2.82E+06 2.27E+06 1.77E+06 1.77E+06 1.51E+06 2.48E+06 1.34E+06 3.12E+06 1.21E+06 3.11E+06 2.39E+06 1.91E+06 2.46E+06 2.43E+06 1.80E+06 7.94E+05 3.79E+06 4-Ethoxyphenol 8.56E+05 8.32E+05 4.29E+05 1.43E+05 1.01E+06 8.67E+05 5.59E+05 1.36E+06 1.09E+06 4.59E+05 1.08E+06 6.75E+05 1.33E+06 3.01E+05 3.19E+05 3.06E+05 6.22E+05 7.40E+05 4.83E+04 4.11E+05 1.27E+05 2.28E+05 5.32E+05 2.77E+05 LysoPE 16:1(2n isomer)* 1.30E+05 4.08E+04 4.29E+04 1.27E+05 1.47E+05 6.23E+04 5.71E+04 1.21E+05 5.01E+04 2.37E+04 1.52E+05 1.21E+05 7.90E+04 2.16E+04 9.91E+04 2.41E+04 8.98E+04 8.76E+04 8.14E+04 2.90E+04 1.53E+04 2.89E+04 5.33E+04 4.47E+04 14-Nor-β-patchoulane-1(5)-ene-2,4-dione 3.49E+05 1.23E+05 1.92E+05 1.81E+05 1.56E+05 1.93E+05 4.22E+05 1.66E+05 3.72E+05 3.56E+05 4.57E+05 4.62E+05 5.55E+05 5.12E+05 4.17E+05 6.80E+05 5.89E+05 5.85E+05 4.51E+05 1.74E+06 1.70E+05 8.88E+04 1.48E+05 5.19E+04 2,4,6-Trihydroxybenzophenone 1.13E+06 3.10E+06 1.60E+06 2.52E+06 1.28E+06 1.33E+06 5.59E+05 2.23E+06 2.07E+06 1.01E+06 1.36E+06 1.36E+06 1.31E+06 7.22E+05 1.40E+06 1.05E+06 1.28E+06 1.89E+06 3.27E+05 1.01E+06 5.48E+05 4.64E+05 1.78E+06 1.46E+06 S-(2-Carboxypropyl)cysteine 2.29E+05 4.07E+05 2.55E+05 1.45E+05 1.63E+05 1.54E+05 1.81E+05 1.75E+05 2.23E+05 1.25E+05 1.26E+05 1.74E+05 5.57E+05 1.35E+05 1.91E+05 1.62E+05 4.08E+05 8.94E+04 2.90E+05 5.71E+05 4.82E+05 3.72E+05 1.36E+05 9.20E+05 L-Homocystine 7.84E+04 4.81E+05 4.65E+04 7.34E+04 3.93E+04 6.14E+04 4.85E+04 9.00E+04 2.74E+05 4.76E+04 5.78E+04 1.02E+05 1.37E+05 4.29E+04 5.60E+04 2.00E+04 4.95E+04 8.67E+04 1.47E+05 7.64E+04 6.74E+04 8.47E+04 3.84E+05 4.65E+04 L-Tyramine 1.45E+05 1.25E+06 1.20E+05 4.50E+05 7.73E+04 2.04E+05 7.29E+04 5.56E+05 1.02E+06 7.63E+04 5.72E+04 3.82E+04 5.95E+04 4.20E+04 2.00E+05 1.05E+05 4.10E+05 1.42E+05 1.13E+05 9.21E+04 7.98E+04 2.03E+05 1.58E+05 1.15E+05 Gardenin A glucoside 5.33E+05 5.83E+05 2.97E+05 3.36E+05 3.38E+05 2.32E+05 5.42E+05 6.21E+05 7.22E+05 2.79E+05 3.27E+05 1.87E+05 2.81E+05 1.37E+05 1.94E+05 1.04E+05 3.53E+05 2.22E+05 2.91E+05 2.49E+05 2.43E+05 3.00E+05 5.56E+05 4.78E+05 Acitretin 1.17E+05 3.33E+03 2.51E+04 1.32E+04 4.84E+04 2.75E+04 6.91E+04 3.17E+04 4.14E+04 4.32E+04 8.42E+04 1.19E+05 1.71E+04 4.13E+04 1.04E+05 6.35E+04 3.65E+04 8.24E+04 3.70E+05 5.64E+04 2.18E+04 3.30E+04 2.65E+04 3.21E+04 coumarin 4.14E+06 6.63E+06 3.17E+06 6.29E+06 3.69E+06 5.78E+06 5.56E+06 8.32E+06 7.91E+06 5.26E+06 5.85E+06 5.73E+06 6.46E+06 5.66E+06 8.39E+06 3.91E+06 7.83E+06 6.58E+06 5.67E+06 6.12E+06 5.99E+06 5.77E+06 7.88E+06 7.93E+06 7-Methoxycoumarin 7.12E+05 1.49E+06 8.24E+05 6.01E+05 4.30E+05 5.52E+05 7.22E+05 8.44E+05 8.71E+05 1.42E+06 1.21E+05 6.74E+05 1.97E+06 1.56E+05 5.41E+05 4.43E+05 1.10E+06 2.87E+05 1.12E+06 1.91E+06 1.18E+06 6.57E+05 4.60E+05 7.58E+05 N-Isobutyl-4,5-epoxy-2E-decaenamide 2.14E+05 4.83E+05 3.68E+05 4.18E+05 4.06E+05 3.06E+05 2.99E+05 4.09E+05 3.64E+05 3.61E+05 3.12E+05 4.27E+05 3.30E+05 4.06E+05 3.61E+05 3.60E+05 4.03E+05 3.11E+05 3.34E+05 2.37E+05 3.15E+05 3.45E+05 3.14E+05 3.45E+05 Hydroxymethyl coumarin glucoside 7.84E+05 1.86E+06 3.40E+06 1.55E+06 2.29E+06 1.87E+06 8.66E+05 1.01E+06 1.89E+06 1.27E+06 1.83E+06 3.90E+06 1.92E+06 9.09E+05 1.82E+06 2.32E+06 1.79E+06 1.36E+06 1.90E+06 1.97E+06 8.71E+05 2.08E+06 9.94E+05 4.24E+06 2'-Deoxyadenosine-5'-monophosphate 1.31E+06 1.13E+06 6.29E+05 3.04E+05 1.32E+06 4.98E+05 5.33E+05 4.70E+05 7.65E+05 8.15E+05 4.08E+05 1.53E+06 1.08E+06 2.91E+05 7.65E+05 1.34E+05 1.90E+06 1.13E+06 1.56E+06 7.37E+05 8.19E+05 6.24E+05 2.64E+05 3.96E+05 6-Hydroxy-lupane-20(29)-en-3-one-28-oic acid 9.33E+03 2.84E+04 1.80E+05 4.10E+04 5.53E+04 1.81E+05 4.18E+05 2.15E+05 2.01E+05 5.38E+05 2.84E+05 3.84E+05 6.56E+04 1.65E+05 9.74E+04 3.05E+05 1.82E+05 1.77E+05 2.07E+05 2.48E+05 4.81E+04 2.97E+04 1.25E+05 1.49E+04 4-Pyridoxic acid-O-glucoside 3.92E+05 4.64E+05 3.06E+05 8.06E+04 2.07E+05 2.52E+05 5.88E+05 2.71E+05 4.35E+05 5.14E+05 2.57E+05 3.38E+05 5.42E+05 1.54E+05 2.59E+05 1.85E+05 4.49E+05 6.13E+05 7.22E+05 4.54E+05 5.00E+05 2.20E+05 1.13E+05 3.64E+05 Jaceosidin-7-O-Glucoside 1.73E+06 3.05E+06 2.29E+06 2.03E+06 1.05E+06 9.22E+05 1.04E+06 1.40E+06 1.84E+06 8.06E+05 8.55E+05 8.04E+05 3.08E+06 1.67E+06 2.07E+06 2.33E+05 2.50E+06 1.48E+06 1.41E+06 2.00E+06 2.03E+06 2.12E+06 2.78E+06 3.61E+06 S-(5'-Adenosyl)-L-methionine 5.07E+05 6.49E+05 5.24E+05 5.90E+05 1.08E+06 1.65E+05 2.03E+05 7.71E+05 1.03E+06 3.16E+05 8.50E+05 5.98E+05 6.69E+05 4.15E+04 9.75E+05 7.13E+05 6.14E+05 1.30E+06 2.48E+05 9.70E+05 3.23E+05 2.44E+05 1.31E+05 3.28E+06 Comazaphilone E 2.55E+07 2.06E+07 2.84E+07 2.63E+07 3.11E+07 2.17E+07 3.49E+07 3.09E+07 3.46E+07 2.14E+07 2.76E+07 3.40E+07 4.10E+07 1.57E+07 1.13E+07 2.57E+07 2.90E+07 2.54E+07 2.74E+07 1.70E+07 1.81E+07 2.95E+07 2.42E+07 8.11E+06 1-phenyl-7-(4-hydroxyphenyl)-4-ene-3-heptanone 1.40E+06 1.26E+06 1.32E+06 9.51E+05 1.55E+06 1.87E+06 2.82E+06 1.92E+06 2.33E+06 2.13E+06 2.47E+06 1.98E+06 1.71E+06 2.77E+06 2.69E+06 2.94E+06 1.43E+06 2.03E+06 1.68E+06 1.83E+06 2.48E+06 1.92E+06 2.40E+06 1.89E+06 Coumarin-3-carboxylic Acid 2.81E+06 9.97E+05 6.89E+05 1.13E+06 1.04E+06 5.75E+05 1.72E+06 9.98E+05 1.85E+06 1.65E+06 9.98E+05 8.73E+05 1.75E+06 2.74E+05 4.24E+05 5.16E+05 5.10E+05 1.03E+06 1.17E+06 1.11E+06 7.35E+05 3.51E+05 1.20E+06 6.15E+05 Cytosine 3.61E+06 3.83E+06 3.66E+06 2.71E+06 8.77E+05 2.30E+06 4.05E+06 7.03E+06 4.00E+06 5.18E+06 9.32E+06 1.27E+06 2.35E+07 1.14E+06 1.88E+06 5.79E+05 8.00E+06 1.64E+06 3.64E+06 1.48E+07 4.70E+06 3.26E+06 4.92E+06 3.72E+07 5,6-Dihydro-5-methyluracil 8.43E+04 2.13E+05 2.00E+05 1.74E+05 3.16E+05 1.79E+05 1.83E+05 9.32E+04 2.23E+05 1.36E+05 1.71E+05 2.19E+05 2.57E+05 4.26E+04 1.92E+05 9.16E+04 1.31E+05 2.56E+05 2.24E+05 2.73E+05 4.49E+05 6.80E+05 2.31E+05 2.75E+05 (2R)-4',7-dihydroxy-5-methoxy-8-methylflavanone 1.96E+06 2.23E+06 1.98E+06 1.83E+06 1.95E+06 2.01E+06 1.35E+06 1.53E+06 2.24E+06 2.01E+06 2.00E+06 2.02E+06 1.53E+06 4.15E+05 2.34E+06 1.17E+06 2.15E+06 1.57E+06 1.49E+06 9.01E+05 1.30E+06 2.29E+06 8.99E+05 7.58E+05 L-Tyrosine methyl ester 3.09E+05 3.77E+05 3.40E+05 4.18E+05 3.58E+05 4.27E+05 2.25E+05 3.55E+05 4.47E+05 3.54E+05 3.20E+05 4.14E+05 3.42E+05 4.28E+05 4.91E+05 3.55E+05 3.90E+05 4.59E+05 4.51E+05 3.22E+05 4.13E+05 4.32E+05 4.13E+05 3.55E+05 2-Palmitoylglycerol* 9.54E+03 2.54E+04 1.08E+04 1.04E+04 1.11E+04 1.67E+04 2.33E+04 2.30E+04 3.09E+04 2.35E+04 2.24E+04 2.65E+04 4.76E+04 8.67E+04 2.99E+04 4.87E+04 3.51E+04 2.84E+04 3.03E+04 2.46E+04 2.60E+04 4.27E+04 2.07E+04 1.52E+04 Monopalmitin* 9.54E+03 2.54E+04 1.08E+04 1.04E+04 1.11E+04 1.67E+04 2.33E+04 2.30E+04 3.09E+04 2.35E+04 2.24E+04 2.65E+04 4.76E+04 8.67E+04 2.99E+04 4.87E+04 3.51E+04 2.84E+04 3.03E+04 2.46E+04 2.60E+04 4.27E+04 2.07E+04 1.52E+04 6-hydroxy-2-[2-(3-hydroxy-4-methoxyphenyl)ethyl]chromone 3.82E+05 4.44E+05 3.54E+05 6.94E+05 9.41E+05 5.25E+05 3.14E+05 4.15E+05 6.48E+05 3.04E+05 5.78E+05 6.69E+05 5.63E+05 2.36E+05 4.57E+05 3.35E+05 2.35E+05 3.70E+05 2.83E+05 2.24E+05 1.89E+05 3.47E+05 9.96E+05 1.46E+05 LysoPC 19:2(2n isomer) 4.98E+04 2.36E+04 3.97E+04 6.82E+04 3.38E+04 3.00E+04 8.77E+04 1.94E+05 2.45E+04 6.58E+04 2.57E+04 4.69E+04 2.97E+04 2.01E+05 8.06E+03 1.42E+05 6.27E+04 9.99E+03 1.26E+05 1.03E+04 1.16E+04 4.98E+04 5.46E+04 4.63E+04 δ-Tocotrienol 3.14E+04 2.85E+04 4.06E+04 4.82E+04 1.30E+05 1.17E+05 8.48E+04 2.34E+04 1.32E+05 1.06E+05 3.07E+05 2.58E+05 2.03E+05 1.56E+05 2.48E+05 2.05E+05 1.49E+05 2.99E+05 1.77E+05 2.34E+05 2.01E+05 5.46E+04 4.09E+04 5.16E+04 Coniferaldehyde* 1.19E+06 1.22E+06 3.40E+06 2.42E+06 3.43E+06 2.56E+06 3.90E+06 2.07E+06 2.79E+06 2.18E+06 5.87E+06 1.25E+06 2.23E+06 2.51E+06 2.84E+06 2.26E+06 2.41E+06 1.85E+06 4.03E+06 4.15E+06 5.30E+06 3.64E+06 2.24E+06 2.72E+06 Nopaline 1.11E+05 9.56E+04 9.92E+04 4.07E+04 5.22E+04 7.18E+04 1.06E+05 1.25E+05 2.00E+04 1.24E+05 5.35E+04 7.63E+04 8.44E+04 5.36E+04 6.72E+04 9.46E+03 5.37E+04 5.25E+04 6.98E+04 1.56E+05 8.88E+04 1.03E+05 7.12E+04 7.00E+04 Mequinol 4.21E+05 4.79E+05 6.11E+05 2.80E+05 3.12E+05 2.00E+05 3.79E+05 1.50E+05 2.85E+05 2.18E+05 3.42E+05 4.94E+05 4.11E+05 3.67E+05 3.04E+05 4.19E+05 4.42E+05 1.83E+05 2.18E+05 1.06E+05 3.39E+05 5.07E+05 1.34E+05 2.42E+05 1-beta-D-Arabinofuranosyluracil 3.23E+05 8.48E+05 8.15E+05 3.45E+05 2.59E+05 7.99E+05 1.10E+06 4.18E+05 6.63E+05 8.30E+05 8.81E+05 3.46E+05 2.76E+06 4.44E+05 3.40E+05 3.93E+05 7.32E+05 3.22E+05 1.08E+06 1.54E+06 1.44E+06 7.85E+05 8.67E+05 1.48E+06 6-O-methylguanine 9.40E+03 1.72E+04 2.91E+04 3.03E+04 1.00E+04 4.51E+04 4.77E+04 7.23E+04 2.73E+04 4.70E+04 5.87E+04 3.40E+04 3.79E+04 1.23E+05 2.61E+04 7.12E+04 2.07E+04 2.20E+04 1.18E+05 4.93E+04 1.44E+05 2.18E+04 8.47E+04 7.03E+04 1-(2,4,5-Trimethoxyphenyl)propan-1-one 4.83E+05 3.25E+05 3.20E+05 4.07E+05 2.93E+05 3.94E+05 2.35E+05 5.98E+05 9.35E+05 4.04E+05 6.98E+05 3.55E+05 4.62E+05 3.01E+05 2.72E+05 5.44E+05 2.94E+05 5.23E+05 2.66E+05 5.33E+05 3.27E+05 3.55E+05 4.09E+05 3.67E+05 3,12-Dihydroxyoleanan-28,13-olide (Oleanderolide) 9.88E+04 5.99E+04 1.05E+04 3.52E+04 2.03E+05 1.22E+05 1.99E+05 1.30E+05 1.06E+05 3.51E+05 6.94E+05 6.28E+05 2.11E+05 3.44E+05 1.32E+05 8.06E+05 3.89E+05 3.32E+05 6.50E+05 7.67E+05 6.42E+04 6.64E+04 9.94E+04 1.32E+04 Tectochrysin 1.76E+05 7.95E+03 9.87E+03 7.41E+03 4.20E+03 2.80E+04 2.00E+05 3.08E+04 4.71E+04 5.51E+04 5.36E+04 1.37E+05 9.54E+04 8.22E+04 3.48E+04 8.19E+03 4.38E+04 4.34E+04 7.26E+05 4.61E+04 3.58E+04 3.31E+04 1.10E+05 3.37E+03 Olean-12-ene-3,16-dione (Maniladione) 5.77E+03 4.81E+05 1.00E+05 9.26E+03 3.30E+05 9.58E+05 1.70E+05 3.68E+04 9.12E+05 2.32E+05 4.09E+06 1.07E+06 1.12E+06 4.83E+05 1.09E+06 2.18E+06 1.70E+06 1.55E+06 1.05E+06 8.82E+05 2.37E+04 3.98E+04 4.61E+04 5.05E+03 N-(2-Hydroxy-4-methoxyphenyl)acetamide 9.80E+06 1.53E+07 6.90E+06 1.57E+07 1.79E+07 3.08E+06 8.49E+06 1.35E+07 1.01E+07 2.96E+06 5.66E+06 1.61E+07 1.81E+07 7.43E+05 1.11E+07 8.19E+05 5.13E+06 1.21E+07 6.03E+06 1.57E+07 2.80E+07 1.77E+07 1.01E+07 4.58E+07 3α,20β,21β-trihydroxy-16-oxo-serrat-14-en-24-oic acid 7.09E+04 4.65E+04 2.39E+05 3.34E+04 1.15E+05 6.19E+04 3.65E+05 8.20E+04 6.63E+04 3.53E+05 3.18E+05 1.62E+05 3.44E+05 1.25E+06 2.22E+05 1.03E+06 3.76E+05 2.81E+05 5.41E+05 2.99E+05 3.05E+05 1.10E+05 8.30E+04 1.08E+05 L-Isoleucyl-L-Aspartate 1.73E+05 4.03E+05 1.22E+05 1.14E+05 5.50E+04 1.02E+05 1.69E+05 1.75E+05 1.87E+05 9.15E+04 2.66E+05 1.02E+05 6.03E+05 6.17E+04 9.87E+04 4.05E+04 2.83E+05 8.84E+04 4.83E+05 2.20E+05 2.21E+05 1.47E+05 4.90E+05 2.48E+05 Anthranilic Acid 4.83E+06 3.01E+06 1.36E+06 1.30E+06 6.07E+06 3.86E+06 2.07E+06 3.20E+06 4.38E+06 2.86E+06 6.79E+06 8.49E+06 3.53E+06 2.04E+06 1.01E+06 4.55E+05 1.60E+06 5.40E+06 2.27E+06 7.62E+06 5.82E+06 1.35E+06 3.89E+06 3.93E+06 19-Hydroxy-3-oxo-24-norolean-12-en-28-oic acid 8.47E+04 1.74E+04 3.47E+04 8.02E+04 1.34E+05 3.72E+04 2.79E+05 1.66E+05 3.74E+05 3.62E+05 4.05E+05 5.09E+05 5.53E+05 4.02E+05 1.33E+05 4.52E+05 4.13E+05 8.82E+04 2.32E+05 3.92E+05 1.31E+05 2.87E+04 1.67E+05 8.20E+04 L-Allo-isoleucine 2.72E+06 1.88E+06 5.38E+06 2.90E+06 1.10E+07 2.35E+06 1.45E+07 8.86E+05 7.30E+06 4.19E+06 1.84E+07 1.97E+06 3.70E+07 1.70E+06 3.44E+06 6.85E+05 1.07E+06 3.27E+06 2.58E+06 2.60E+07 1.55E+07 2.30E+06 8.06E+06 2.66E+07 (5-Methoxy-1,3-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetonitrile 1.81E+05 1.26E+05 1.53E+05 1.27E+05 9.05E+04 1.07E+05 9.00E+04 1.47E+05 1.46E+05 6.66E+04 1.26E+05 1.13E+05 1.41E+05 7.84E+04 2.00E+05 6.66E+04 1.32E+05 1.89E+05 1.07E+05 1.34E+05 1.37E+05 1.31E+05 9.39E+04 1.78E+05 3-Hydroxy-1-methoxy-9,10-anthraquinone 2.19E+06 1.80E+06 1.41E+06 5.80E+05 1.78E+06 1.70E+06 3.52E+06 1.10E+06 1.57E+06 1.45E+06 2.41E+06 1.31E+06 2.59E+06 9.58E+05 2.36E+05 9.62E+05 3.46E+06 2.23E+06 1.05E+06 4.18E+05 1.88E+06 5.57E+05 1.72E+06 1.35E+06 3,4'-Dihydroxypropiophenone glucoside 1.35E+06 1.61E+06 7.17E+05 7.20E+05 8.16E+05 7.05E+05 9.05E+05 1.12E+06 1.10E+06 4.71E+05 7.86E+05 9.74E+05 7.57E+05 2.55E+05 1.28E+06 9.60E+05 8.51E+05 8.47E+05 8.35E+05 1.18E+06 9.93E+05 2.31E+06 1.27E+06 8.50E+05 N',N''-Diferuloylspermidine 1.62E+05 1.14E+05 1.20E+05 1.99E+05 5.14E+04 8.69E+04 1.01E+05 1.20E+05 9.33E+04 8.60E+04 7.71E+04 5.46E+04 1.13E+05 3.02E+05 2.11E+05 7.92E+04 1.80E+05 1.61E+05 9.68E+04 2.23E+05 1.76E+05 1.19E+05 8.11E+04 9.54E+04 davidioside B 8.57E+06 1.01E+07 1.05E+07 4.97E+06 1.27E+07 7.61E+06 3.20E+06 5.40E+06 1.11E+07 3.72E+06 7.65E+06 9.29E+06 4.43E+06 6.97E+05 7.56E+06 2.60E+06 2.99E+06 1.65E+07 1.90E+06 1.13E+06 1.05E+07 2.54E+06 6.33E+06 1.91E+06 5-Hydroxy-DL-tryptophan(5-HTP) 5.43E+04 4.15E+04 1.49E+05 1.29E+05 1.30E+04 1.73E+04 3.02E+04 8.88E+04 5.38E+04 2.68E+04 6.08E+04 2.95E+04 4.12E+04 4.67E+04 5.64E+04 2.46E+04 1.54E+05 4.96E+04 2.79E+04 5.16E+04 4.66E+04 3.79E+04 4.01E+04 3.61E+04 Hovenic acid 2.72E+05 1.16E+04 1.14E+05 1.64E+04 2.91E+04 6.75E+04 2.52E+05 1.13E+05 2.08E+05 9.30E+05 3.61E+05 1.32E+05 6.97E+04 1.96E+05 2.13E+05 6.58E+05 3.77E+05 9.54E+04 9.18E+04 1.48E+05 4.82E+04 7.79E+03 2.96E+04 6.33E+03 4-((6S)-6-(furan-3-yl)-3-(hydroxymethyl)piperidin-2-yl)-2-methylbutan-2-ol 5.98E+04 5.61E+04 6.72E+04 4.83E+04 8.88E+04 1.29E+05 9.50E+04 4.99E+04 5.27E+04 1.03E+05 1.16E+05 7.87E+04 3.01E+05 1.03E+05 1.21E+05 5.00E+04 6.17E+04 1.05E+05 6.86E+04 1.96E+05 4.26E+05 9.61E+04 1.20E+05 1.48E+05 4-hydroxyphenyl acrylaldehyde 5.88E+05 8.29E+05 1.48E+06 8.63E+05 7.58E+05 1.74E+06 1.00E+06 8.34E+05 6.60E+05 7.27E+05 5.50E+05 7.59E+05 1.14E+06 1.05E+06 6.72E+05 1.21E+06 8.56E+05 6.55E+05 1.13E+06 7.93E+05 1.13E+06 9.35E+05 1.30E+06 9.43E+05 Scopoletin-7-O-glucoside (Scopolin) 1.30E+06 7.65E+05 4.05E+06 1.59E+06 3.20E+06 4.96E+06 2.17E+06 2.00E+06 2.96E+06 2.38E+06 5.54E+06 6.08E+06 4.19E+06 2.13E+06 2.57E+06 2.70E+06 3.37E+06 4.27E+06 3.76E+06 2.96E+06 3.99E+06 3.28E+06 3.07E+06 7.84E+06 Tutin diacetate 5.33E+05 3.56E+05 1.58E+06 5.53E+05 1.48E+06 1.30E+06 6.42E+05 6.58E+05 7.34E+05 5.92E+05 1.08E+06 1.85E+06 1.06E+06 4.95E+05 4.22E+05 1.22E+06 7.18E+05 1.20E+06 7.75E+05 4.58E+05 8.09E+05 4.97E+05 4.74E+05 1.58E+05 Helicide 4.33E+05 7.06E+04 2.32E+05 1.17E+05 1.74E+05 3.79E+05 3.00E+05 9.86E+04 1.05E+05 1.88E+05 2.43E+05 1.05E+05 5.04E+05 2.05E+05 7.12E+04 2.74E+05 9.05E+04 1.54E+05 1.78E+05 2.75E+05 1.23E+05 7.88E+04 2.85E+05 2.26E+05 Isorhamnetin-3,7-O-diglucoside 3.17E+06 1.11E+06 1.38E+06 6.53E+05 5.09E+05 1.10E+06 6.57E+05 8.40E+05 5.17E+05 4.39E+05 1.31E+06 5.38E+05 5.04E+05 3.38E+05 1.03E+06 4.81E+05 6.18E+05 5.73E+05 6.32E+05 4.25E+05 5.59E+05 1.18E+06 1.39E+06 5.69E+05 Bakuchicin 3.84E+06 4.31E+06 3.85E+06 5.20E+06 4.47E+06 3.07E+06 2.51E+06 4.13E+06 4.43E+06 2.57E+06 3.40E+06 4.48E+06 3.44E+06 1.92E+06 5.17E+06 1.60E+06 4.52E+06 4.13E+06 3.32E+06 3.77E+06 2.86E+06 3.33E+06 3.19E+06 4.48E+06 1-O-Caffeoylglycerol 2.50E+06 1.10E+06 3.04E+06 1.75E+05 1.06E+06 2.09E+06 1.49E+06 9.16E+05 1.04E+06 8.37E+05 3.23E+06 1.25E+06 1.25E+06 1.35E+05 8.17E+05 2.43E+05 5.91E+05 1.45E+06 5.16E+05 4.71E+05 1.05E+06 2.89E+05 3.04E+06 4.30E+05 N,N-cinnamoylbutanediamine* 4.14E+06 6.02E+06 5.79E+06 2.92E+06 3.19E+06 2.32E+06 3.41E+06 4.31E+06 4.40E+06 3.16E+06 1.42E+06 1.35E+06 1.20E+06 5.97E+05 2.47E+06 8.81E+06 5.37E+06 4.99E+06 6.91E+05 2.56E+06 2.60E+06 8.49E+05 1.38E+06 1.97E+06 LysoPC 20:2(2n isomer) 1.91E+04 9.78E+03 3.32E+04 2.56E+04 3.18E+04 3.09E+04 2.96E+04 2.53E+04 1.80E+04 1.24E+04 1.16E+04 1.43E+04 1.38E+04 1.22E+04 1.47E+04 3.40E+04 1.68E+04 1.46E+04 1.42E+04 5.64E+03 1.02E+04 3.28E+04 1.50E+04 1.07E+04 N-Trans-Cinnamoylputrescine 7.14E+06 5.60E+06 4.26E+06 4.95E+06 3.84E+06 1.82E+06 3.28E+06 2.90E+06 3.59E+06 3.34E+06 1.77E+06 2.41E+06 2.64E+06 2.73E+06 4.12E+06 7.15E+06 4.40E+06 3.63E+06 2.04E+06 2.59E+06 2.19E+06 1.31E+06 2.15E+06 3.81E+06 Pyridoxine 1.48E+05 7.41E+05 6.41E+05 2.55E+05 7.81E+05 2.46E+05 2.83E+05 8.08E+04 3.43E+05 5.69E+05 5.27E+05 9.59E+05 5.30E+05 4.36E+05 4.33E+05 3.14E+05 8.25E+05 5.89E+05 9.00E+05 2.24E+06 3.20E+05 3.88E+05 2.91E+05 1.32E+05 6-C-MethylKaempferol-3-glucoside* 1.29E+06 3.95E+05 4.48E+05 9.90E+05 4.71E+05 3.64E+05 6.21E+05 4.83E+05 5.62E+05 5.62E+05 3.12E+05 5.20E+05 4.38E+05 4.55E+05 9.79E+05 7.42E+05 5.54E+05 1.01E+06 3.47E+05 9.90E+05 2.80E+05 5.40E+05 1.31E+06 4.04E+05 Secoisolariciresinol 2.45E+05 2.03E+05 1.95E+05 1.56E+05 1.89E+05 1.37E+05 1.80E+05 1.96E+05 1.42E+05 1.39E+05 1.46E+05 1.05E+05 1.13E+05 1.38E+05 1.42E+05 1.61E+05 1.32E+05 9.67E+04 9.26E+04 1.03E+05 1.20E+05 1.09E+05 2.32E+05 1.37E+05 Cimifugin 5.51E+05 2.41E+06 2.29E+06 2.44E+06 1.30E+06 1.66E+06 1.65E+06 1.66E+06 2.47E+06 1.42E+06 2.10E+06 2.14E+06 2.55E+06 1.01E+06 1.55E+06 1.69E+06 2.69E+06 2.51E+06 2.43E+06 1.62E+06 2.72E+06 3.73E+06 2.10E+06 1.63E+06 Malonyl oleuropein 1.63E+05 1.64E+05 6.70E+04 1.17E+05 2.78E+05 2.52E+05 4.61E+05 1.04E+05 1.64E+05 1.21E+05 3.51E+05 3.84E+05 1.10E+05 1.76E+05 1.71E+05 1.31E+05 1.50E+05 4.44E+05 6.66E+04 1.06E+05 5.29E+05 1.05E+05 7.75E+04 2.88E+05 Ovafolinin E 2.17E+07 1.58E+07 2.27E+07 2.27E+06 2.71E+07 4.60E+07 1.78E+07 1.63E+07 1.90E+07 1.27E+07 5.30E+07 3.38E+07 3.30E+07 6.70E+07 2.49E+07 8.42E+07 6.58E+07 8.96E+07 2.53E+07 3.88E+07 1.25E+07 1.67E+07 2.90E+06 5.62E+06 Methyl Syringate 8.13E+04 8.30E+04 3.61E+05 7.53E+04 1.22E+05 1.38E+05 1.05E+05 8.29E+04 1.77E+05 1.38E+05 1.19E+05 1.05E+05 1.59E+05 2.27E+05 9.88E+04 3.22E+05 3.52E+05 9.55E+04 1.09E+05 1.49E+05 1.30E+05 9.17E+04 7.48E+04 2.57E+05 Pyridoxine-5'-O-diglucoside 2.70E+05 1.14E+05 2.84E+05 2.84E+05 3.74E+05 1.20E+05 2.02E+05 1.55E+05 2.38E+05 1.57E+05 1.74E+05 1.56E+05 3.62E+05 3.77E+04 1.96E+05 9.50E+04 1.21E+05 9.63E+04 1.78E+05 2.86E+05 1.61E+05 2.66E+05 1.92E+05 4.58E+05 Pectolinarigenin-7-O-glucoside 9.13E+05 4.61E+05 4.45E+05 5.59E+05 7.01E+05 5.36E+05 4.49E+05 3.62E+05 4.83E+05 4.01E+05 2.16E+05 3.08E+05 3.51E+05 4.57E+05 7.89E+05 2.74E+05 3.40E+05 6.10E+05 1.85E+05 5.48E+05 1.14E+05 2.62E+05 7.34E+05 3.30E+05 5-Aminolevulinic Acid* 5.95E+06 1.91E+07 2.11E+07 1.56E+07 3.07E+07 1.29E+07 6.72E+07 9.45E+06 4.69E+07 1.04E+07 5.67E+07 1.77E+07 1.11E+08 5.50E+06 2.35E+07 1.53E+06 9.47E+06 1.51E+07 2.10E+07 4.77E+07 8.19E+07 9.06E+06 4.92E+07 1.06E+08 Cytarabine 6.81E+05 1.30E+06 3.36E+06 1.06E+06 4.56E+05 9.02E+05 2.05E+06 1.18E+06 1.57E+06 1.06E+06 1.68E+06 1.04E+06 5.24E+06 1.05E+06 1.58E+06 4.63E+05 2.39E+06 5.16E+05 1.57E+06 2.61E+06 1.78E+06 1.36E+06 1.21E+06 2.53E+06 (4R)-4,5-dihydroxy-alpha-tetralone 1.54E+06 1.33E+06 2.08E+06 4.96E+05 7.15E+05 1.37E+06 8.92E+05 2.65E+05 3.47E+05 6.63E+05 1.42E+06 1.74E+06 8.83E+05 4.96E+05 5.19E+05 7.64E+05 1.02E+06 7.79E+05 7.20E+05 8.81E+05 3.03E+05 5.68E+05 1.38E+06 5.23E+05 Phloroglucinol; 1,3,5-Benzenetriol 1.09E+06 1.14E+06 1.47E+06 1.14E+06 1.33E+06 2.88E+06 1.65E+06 1.59E+06 1.40E+06 1.87E+06 1.09E+06 1.04E+06 1.16E+06 7.33E+05 1.35E+06 1.22E+06 1.19E+06 1.40E+06 1.25E+06 1.10E+06 9.77E+05 9.15E+05 1.37E+06 1.46E+06 Guanine 5.05E+05 2.56E+05 5.77E+05 6.09E+05 3.43E+05 9.60E+05 9.28E+05 1.13E+06 6.45E+05 9.48E+05 8.52E+05 8.47E+05 2.88E+06 6.96E+05 4.38E+05 3.80E+05 3.62E+05 4.98E+05 2.86E+06 1.50E+06 1.74E+06 4.96E+05 7.08E+05 8.66E+05 N-Acetyl-D-mannosamine 1.11E+05 1.27E+05 2.01E+05 1.03E+05 1.67E+05 2.41E+05 1.54E+05 2.37E+05 1.49E+05 9.60E+04 2.01E+05 1.86E+05 3.28E+05 1.13E+05 2.08E+05 1.88E+05 1.38E+05 1.41E+05 1.44E+05 1.65E+05 1.40E+05 1.35E+05 1.20E+05 1.65E+05 Sakuraresinol 7.35E+04 3.84E+04 8.85E+04 4.95E+04 7.24E+04 6.01E+04 4.23E+04 8.28E+04 1.06E+05 6.41E+04 8.49E+04 9.34E+04 5.17E+04 8.80E+04 7.96E+04 1.48E+05 7.18E+04 8.80E+04 7.96E+04 4.73E+04 9.52E+04 1.41E+05 2.23E+04 1.32E+05 Glu-Ser 2.49E+04 2.90E+05 7.17E+05 4.83E+04 2.03E+05 2.76E+06 5.53E+06 2.54E+04 9.84E+04 2.63E+06 1.21E+07 1.92E+06 5.93E+06 5.24E+06 5.62E+04 1.65E+06 8.12E+05 4.36E+05 1.27E+07 3.64E+05 3.03E+06 9.35E+05 6.36E+05 3.85E+04 D-Glucosamine 2.33E+05 2.11E+05 2.06E+05 2.02E+05 4.18E+05 3.74E+05 1.76E+05 1.85E+05 2.68E+05 3.16E+05 2.89E+05 1.76E+05 2.04E+05 8.84E+04 8.78E+04 3.18E+05 2.01E+05 1.67E+05 8.77E+04 1.83E+05 1.68E+05 1.22E+05 1.56E+05 1.20E+05 Planteose 6.79E+04 1.44E+05 2.39E+04 7.58E+04 1.07E+05 4.25E+04 3.43E+04 6.88E+04 3.60E+04 3.36E+04 5.01E+04 4.57E+04 1.67E+04 3.64E+04 5.12E+04 3.76E+04 5.62E+04 3.86E+04 5.45E+04 1.05E+05 3.65E+04 1.44E+05 8.54E+04 5.62E+04 Cytidine 7.41E+06 3.80E+06 8.55E+06 5.27E+06 3.11E+06 3.99E+06 5.64E+06 9.32E+06 9.28E+06 7.94E+06 1.51E+07 9.61E+05 2.04E+07 1.51E+06 2.77E+06 3.09E+06 1.18E+07 1.00E+06 5.75E+06 2.14E+07 6.45E+06 4.68E+06 8.83E+06 7.16E+07 Ser-Val-Leu 7.38E+04 1.70E+05 3.57E+04 3.51E+04 9.47E+04 1.14E+05 5.84E+04 3.33E+04 5.29E+04 3.33E+04 8.44E+04 4.06E+04 2.19E+05 1.85E+04 0.00E+00 0.00E+00 0.00E+00 0.00E+00 1.96E+05 8.30E+04 1.38E+05 6.40E+04 2.82E+05 6.00E+04 S-Methyl-L-cysteine 1.04E+07 1.29E+07 5.85E+06 1.55E+07 1.61E+07 2.37E+06 7.59E+06 1.64E+07 9.44E+06 2.66E+06 5.63E+06 1.48E+07 1.58E+07 6.52E+05 1.14E+07 4.02E+05 5.50E+06 1.35E+07 6.10E+06 1.32E+07 2.37E+07 1.69E+07 1.05E+07 4.04E+07 Olivil Monoacetate 3.25E+05 8.19E+05 6.62E+05 2.25E+05 1.87E+06 1.10E+06 2.54E+05 5.65E+05 7.47E+05 4.96E+05 9.38E+05 1.47E+06 8.01E+05 1.49E+05 7.57E+05 5.39E+05 3.74E+05 1.13E+06 9.23E+05 3.97E+05 5.83E+05 4.37E+05 1.31E+05 3.96E+05 5,6,3',4'-Tetrahydroxy-3,7-dimethoxyflavone-6-O-glucoside 6.39E+05 3.54E+05 1.34E+06 6.36E+05 7.05E+05 8.12E+05 4.51E+05 3.79E+05 4.22E+05 5.19E+05 9.53E+05 4.49E+05 3.75E+05 4.32E+05 5.02E+05 6.20E+05 2.33E+05 8.09E+05 7.64E+05 2.98E+05 2.14E+05 4.71E+05 6.17E+05 4.01E+05 Isoguanine 1.07E+06 9.94E+06 3.57E+06 3.59E+06 1.28E+06 6.87E+06 3.11E+06 3.30E+06 7.16E+06 6.86E+06 4.24E+06 1.55E+06 7.53E+06 2.42E+06 1.26E+06 6.21E+05 2.29E+06 1.31E+06 4.49E+06 3.39E+06 4.97E+06 3.61E+06 9.08E+06 6.37E+06 1-Oleoyl-Sn-Glycerol 4.98E+05 1.47E+05 9.85E+04 2.78E+04 5.05E+04 1.65E+05 1.39E+05 1.68E+05 3.60E+05 1.71E+05 1.04E+05 8.28E+04 4.53E+05 1.11E+05 6.21E+04 1.54E+05 8.46E+04 3.37E+04 4.93E+05 6.66E+04 2.95E+05 3.33E+05 6.06E+05 1.25E+05 5,2'-Dihydroxy-7,8-dimethoxyflavone glycoside* 1.92E+05 1.84E+05 1.50E+05 1.62E+05 2.10E+05 1.52E+05 1.21E+05 1.04E+05 9.63E+04 1.32E+05 2.19E+05 1.33E+05 7.33E+04 5.64E+04 1.00E+05 1.19E+05 1.78E+05 2.00E+05 8.48E+04 6.70E+04 6.37E+04 9.04E+04 9.86E+04 7.67E+04 1-Cis-5-cis-germacrone 3.87E+05 4.43E+04 2.01E+05 1.07E+05 1.72E+05 2.19E+05 5.88E+05 3.85E+05 3.48E+05 7.82E+05 6.80E+05 1.06E+06 3.37E+05 4.52E+05 3.48E+05 8.19E+05 6.63E+05 4.21E+05 5.30E+05 3.27E+06 1.48E+05 1.24E+05 1.58E+05 2.82E+04 trachelosiaside 1.52E+07 1.32E+07 5.83E+06 1.86E+07 5.54E+06 5.72E+06 6.08E+06 1.08E+07 1.11E+07 5.50E+06 3.98E+06 4.05E+06 7.07E+06 3.54E+06 1.44E+07 4.71E+05 1.13E+07 8.85E+06 3.05E+06 4.62E+06 6.53E+06 4.07E+06 6.79E+06 9.36E+06 2,5-Dimethoxybenzoquinone* 1.18E+07 5.35E+06 1.86E+06 3.69E+06 4.79E+06 2.53E+06 1.21E+06 2.66E+06 2.87E+06 1.11E+06 2.01E+06 1.59E+06 1.90E+06 5.07E+05 3.88E+06 6.21E+05 2.78E+06 4.37E+06 4.66E+06 1.24E+06 2.48E+06 3.80E+06 1.04E+06 3.28E+06 α-D-glucosyl-(1→1')-3'-amino-3'-deoxy-β-D-glucoside 6.62E+04 5.07E+04 1.00E+05 5.78E+04 4.71E+04 7.22E+04 1.35E+05 1.46E+05 7.16E+04 1.09E+05 8.95E+04 7.87E+04 1.09E+05 1.28E+05 6.14E+04 2.60E+05 1.03E+05 1.02E+05 9.79E+04 1.24E+05 6.56E+04 3.34E+04 2.80E+05 8.35E+04 1-Methylxanthine 1.14E+05 1.03E+05 1.58E+05 1.19E+05 1.75E+05 1.41E+05 8.58E+04 7.58E+04 5.60E+04 6.13E+04 1.38E+05 1.54E+05 1.38E+05 6.00E+04 1.00E+05 6.20E+04 1.03E+05 5.36E+04 5.43E+04 9.61E+04 1.99E+05 5.52E+04 1.15E+05 7.29E+04 Galangin-7-O-glucoside 2.62E+05 2.42E+05 1.69E+05 1.32E+05 2.75E+05 1.13E+05 1.56E+05 3.17E+05 2.65E+05 1.43E+05 3.28E+05 4.41E+05 3.15E+05 1.22E+05 2.19E+05 1.17E+05 3.12E+05 1.89E+05 3.62E+05 2.48E+05 1.88E+05 4.12E+05 2.72E+05 3.53E+05 Dhurrin-6'-O-Glucoside 3.63E+05 2.59E+05 8.85E+05 1.15E+06 2.19E+05 1.91E+05 3.58E+05 2.35E+05 2.12E+05 2.46E+05 2.31E+05 1.35E+05 1.91E+05 6.09E+05 1.18E+06 3.91E+05 2.45E+05 3.14E+05 2.65E+05 6.10E+05 2.30E+05 5.90E+05 1.83E+06 3.41E+05 Lys-Leu 7.86E+04 7.47E+04 2.96E+04 2.97E+04 5.58E+04 5.20E+04 1.48E+05 7.56E+04 5.68E+04 1.52E+05 3.81E+04 7.16E+04 1.47E+05 2.51E+04 6.49E+04 5.38E+04 5.83E+04 5.52E+04 1.91E+05 1.14E+05 1.01E+05 1.19E+05 1.79E+05 5.93E+04 N-Propionyl nornicotine 1.30E+05 2.74E+05 1.79E+05 1.05E+05 2.29E+05 3.81E+05 2.60E+05 1.35E+05 2.39E+05 1.66E+05 1.81E+05 2.04E+05 2.68E+05 2.66E+05 1.74E+05 1.63E+05 2.39E+05 3.92E+05 2.51E+05 4.59E+05 2.66E+05 1.30E+05 1.59E+05 4.00E+05 5-Methylcytosine 1.41E+04 1.33E+04 3.58E+04 2.17E+04 1.42E+04 3.87E+04 1.93E+04 1.13E+04 3.72E+04 1.43E+04 2.17E+04 3.67E+04 4.97E+04 1.91E+04 1.35E+04 4.57E+04 2.36E+04 1.29E+04 3.90E+04 2.56E+04 2.01E+04 5.15E+03 1.92E+04 1.14E+04 Adenine 1.75E+05 2.52E+05 1.19E+05 2.03E+05 2.29E+05 3.28E+05 4.54E+05 3.93E+05 3.05E+05 2.92E+05 2.49E+05 3.86E+05 1.11E+06 1.60E+05 9.78E+04 4.91E+04 2.09E+05 1.92E+05 8.50E+05 8.36E+05 8.42E+05 8.12E+05 1.17E+06 1.60E+06 3,5-Dimethyl-2,3-dihydrobenzofuran 2.27E+06 8.20E+05 1.21E+06 2.68E+06 1.46E+06 1.64E+06 1.43E+06 3.29E+06 1.79E+06 2.44E+06 2.59E+06 9.99E+05 1.93E+06 3.71E+06 1.04E+06 3.19E+06 1.90E+06 3.25E+06 1.40E+06 4.64E+06 2.36E+06 3.18E+06 1.38E+06 2.35E+06 trans-Aconitic acid 1.50E+05 2.54E+05 1.97E+05 1.87E+05 2.30E+05 2.93E+05 1.19E+05 1.30E+05 1.42E+05 1.26E+05 2.59E+05 1.63E+05 1.68E+05 2.83E+05 1.42E+05 3.92E+05 2.14E+05 2.06E+05 1.04E+05 1.79E+05 2.21E+05 2.27E+05 1.79E+05 2.13E+05 4,8-Dihydroxy Naphthol-1-O-glucoside 1.00E+07 1.75E+07 2.95E+07 1.48E+07 2.12E+07 2.80E+06 5.27E+06 1.76E+07 2.12E+07 1.48E+07 1.68E+07 2.03E+07 1.66E+07 2.66E+07 1.62E+07 2.35E+07 1.68E+07 1.24E+07 3.56E+07 1.71E+07 1.87E+07 3.68E+07 2.67E+07 7.45E+06 3,4-O-Dicaffeoylquinic Acid Methyl Ester* 8.05E+04 8.59E+04 1.82E+05 9.58E+04 1.91E+05 1.29E+05 1.43E+05 7.31E+04 7.64E+04 1.66E+05 1.99E+05 1.41E+05 2.12E+05 1.39E+05 7.11E+04 2.47E+05 1.24E+05 1.08E+05 1.31E+05 3.41E+04 2.14E+05 1.68E+05 1.30E+05 8.34E+04 3,5-O-Dicaffeoylquinic Acid Methyl Ester* 8.05E+04 8.59E+04 1.82E+05 9.58E+04 1.91E+05 1.29E+05 1.43E+05 7.31E+04 7.64E+04 1.66E+05 1.99E+05 1.41E+05 2.12E+05 1.39E+05 7.11E+04 2.47E+05 1.24E+05 1.08E+05 1.31E+05 3.41E+04 2.14E+05 1.68E+05 1.30E+05 8.34E+04 p-Coumaric acid 7.64E+05 5.85E+05 2.42E+05 3.26E+05 5.43E+05 3.69E+05 3.25E+06 1.48E+06 5.09E+05 2.03E+06 4.42E+05 1.83E+06 7.32E+05 8.66E+05 8.79E+05 5.37E+05 9.18E+05 9.36E+05 1.38E+06 8.34E+05 2.39E+05 6.45E+05 8.36E+05 5.43E+05 Thr-Asn-Asp 9.06E+05 1.99E+06 2.19E+06 8.06E+05 5.27E+06 3.98E+06 2.75E+06 1.54E+06 1.86E+06 2.41E+06 3.26E+06 5.03E+06 8.67E+05 5.35E+05 7.54E+05 2.06E+06 2.38E+06 8.54E+05 1.29E+06 6.02E+05 9.20E+05 1.76E+06 2.06E+06 5.58E+05 Balanophonin D glucoside 7.16E+06 5.64E+06 9.28E+06 5.91E+06 8.08E+06 7.09E+06 4.69E+06 8.11E+06 9.22E+06 3.91E+06 6.63E+06 7.13E+06 7.99E+06 8.16E+05 6.49E+06 4.99E+06 6.05E+06 6.84E+06 5.14E+06 3.09E+06 8.24E+06 5.17E+06 4.00E+06 1.92E+06 LysoPE 18:3(2n isomer) 4.82E+05 3.50E+05 3.34E+05 3.02E+05 8.79E+05 1.33E+05 1.07E+06 8.89E+05 1.24E+06 1.45E+06 5.49E+05 1.01E+06 2.60E+05 3.33E+04 4.14E+05 1.20E+05 8.96E+05 7.14E+05 3.54E+05 2.77E+05 1.00E+05 2.37E+05 1.05E+05 3.78E+05 Senkyunolide A 2.72E+05 4.25E+05 4.69E+05 3.15E+05 4.05E+05 2.86E+05 6.61E+05 1.55E+06 3.41E+05 8.29E+05 4.99E+05 1.16E+06 5.03E+05 2.59E+05 1.66E+05 4.00E+05 5.64E+05 3.31E+05 1.01E+06 6.48E+05 2.86E+05 1.45E+05 7.97E+05 2.21E+05 Isorhamnetin-3-O-rhamnoside 3.37E+04 4.87E+04 5.05E+04 6.56E+04 4.14E+04 5.73E+04 2.78E+04 5.10E+04 3.55E+04 9.55E+03 3.05E+04 1.17E+05 4.05E+04 4.78E+04 4.55E+04 1.82E+04 3.14E+04 3.23E+04 5.32E+04 2.87E+04 3.64E+04 1.71E+04 6.73E+04 3.57E+04 Octadeca-11E,13E,15Z-trienoic acid 7.09E+05 4.42E+05 9.20E+05 7.34E+05 7.91E+05 9.55E+05 1.24E+06 7.98E+05 8.31E+05 7.03E+05 6.52E+05 5.23E+05 1.02E+06 7.27E+05 7.47E+05 5.11E+05 8.09E+05 1.03E+06 1.16E+06 8.17E+05 1.04E+06 7.04E+05 9.86E+05 5.81E+05 3-(4-hydroxyphenyl)-3-oxopropyl beta-D-glucopyranoside 1.95E+06 2.31E+06 1.40E+06 1.11E+06 1.25E+06 1.16E+06 6.78E+05 1.09E+06 1.61E+06 6.27E+05 8.34E+05 1.13E+06 1.05E+06 2.57E+05 8.96E+05 6.57E+05 1.29E+06 1.48E+06 1.01E+06 1.06E+06 1.54E+06 1.72E+06 1.79E+06 1.36E+06 Chrysoeriol-5,7-di-O-glucoside 2.03E+05 1.71E+05 1.63E+05 1.46E+05 3.68E+04 6.34E+04 2.32E+05 7.00E+04 7.93E+04 9.83E+04 2.85E+04 1.00E+05 9.00E+04 8.17E+04 1.70E+05 7.21E+04 1.00E+05 6.77E+04 6.00E+04 1.18E+05 5.67E+04 1.71E+05 1.00E+05 9.50E+04 Elaeocarpucin F 1.92E+05 8.84E+03 3.78E+04 1.17E+04 5.75E+04 3.25E+04 4.48E+05 1.11E+05 4.12E+04 3.56E+05 2.58E+05 5.06E+05 1.50E+05 2.21E+05 1.18E+05 4.37E+05 3.94E+05 2.39E+05 1.65E+05 7.54E+04 5.28E+04 1.74E+04 1.78E+04 1.46E+04 2,6-Dimethyl-6-hydroxy-2,7-octadienyl-β-D-glucoside (Betulalbuside A; Betulabuside A) 1.58E+06 1.12E+06 7.15E+05 7.53E+05 6.16E+05 9.77E+05 5.09E+05 6.83E+05 8.27E+05 3.54E+05 4.22E+05 2.80E+05 7.69E+05 6.85E+05 1.06E+06 3.09E+05 9.40E+05 9.93E+05 2.68E+05 3.32E+05 6.52E+05 7.75E+05 9.98E+05 6.88E+05 4-Aminoindole 1.98E+06 7.13E+05 2.03E+06 4.84E+05 1.99E+06 2.31E+06 9.07E+05 1.33E+06 1.06E+06 1.36E+06 2.04E+06 2.01E+06 4.73E+05 2.15E+05 3.17E+05 1.14E+06 4.70E+05 1.61E+06 3.79E+05 5.36E+05 4.41E+05 2.48E+05 3.82E+05 4.73E+05 L-Aspartyl-L-Phenylalanine 5.00E+04 1.34E+05 3.42E+04 1.32E+05 6.50E+04 9.50E+04 9.34E+04 2.37E+04 2.24E+05 7.17E+04 8.12E+04 1.18E+05 1.70E+05 3.66E+04 3.89E+04 4.33E+04 5.29E+04 7.50E+04 1.03E+05 1.21E+05 2.22E+05 1.70E+05 3.77E+05 8.97E+04 Ditartaroyl-hydroxycoumarin 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 7.67E+04 6.79E+05 3.17E+05 7.90E+05 0.00E+00 0.00E+00 6.61E+05 6.72E+05 5.22E+05 7.54E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 3,5,7,4'-Tetrahydroxy-Coumaronochromone 2.33E+05 1.69E+05 6.15E+04 1.47E+05 1.12E+05 2.21E+05 2.82E+05 2.24E+05 1.35E+05 1.68E+05 1.51E+05 1.22E+05 1.20E+05 4.12E+05 9.17E+04 3.19E+05 1.28E+05 1.95E+05 2.53E+05 1.48E+05 2.06E+05 1.72E+05 1.55E+05 6.40E+04 Centaurein 1.63E+06 1.43E+06 2.16E+06 1.29E+06 1.86E+06 1.63E+06 1.72E+06 2.65E+06 2.28E+06 1.89E+06 1.40E+06 9.99E+05 1.75E+06 1.25E+06 1.34E+06 1.75E+06 1.90E+06 1.03E+06 1.55E+06 6.74E+05 9.71E+05 1.70E+06 1.68E+06 9.00E+05 6-Hydroxy-7-methoxycoumarin* 6.26E+05 4.69E+05 1.28E+06 1.30E+06 8.32E+05 8.24E+05 9.78E+05 9.50E+05 1.10E+06 9.73E+05 8.84E+05 8.24E+05 9.57E+05 1.18E+06 2.06E+06 1.66E+06 1.05E+06 8.16E+05 5.65E+05 6.26E+05 8.54E+05 5.52E+05 9.37E+05 5.52E+05 (14-Ethyl-4,6,19-trimethoxy-9,11-dioxa-14-azaheptacyclo[10.7.2.12,5.01,13.03,8.08,12.016,20]docosan-21-yl)acetate 1.83E+06 2.54E+06 2.21E+06 2.00E+06 3.19E+06 1.24E+06 1.52E+06 2.53E+06 3.44E+06 2.00E+06 1.45E+06 3.16E+06 1.62E+06 2.69E+05 2.92E+06 3.35E+05 4.13E+06 4.84E+06 2.19E+06 2.07E+06 1.28E+06 2.32E+06 2.38E+06 1.90E+06 N-Monomethyl-L-arginine* 9.08E+04 1.47E+05 7.17E+04 1.54E+05 6.53E+04 9.62E+04 1.86E+05 1.36E+05 1.46E+05 9.51E+04 1.56E+05 1.60E+05 2.89E+05 6.92E+04 9.29E+04 4.14E+04 1.13E+05 6.20E+04 1.04E+05 8.31E+05 4.87E+05 2.60E+06 1.19E+05 3.81E+05 Asp-Glu 1.82E+05 1.83E+05 9.98E+04 1.05E+05 8.51E+04 8.57E+04 4.82E+05 1.39E+05 1.76E+05 1.56E+05 1.82E+05 1.61E+05 2.37E+05 4.61E+04 1.34E+05 4.07E+04 1.50E+05 1.47E+05 1.09E+05 2.52E+05 3.96E+05 1.98E+05 1.68E+05 2.89E+05 Wogonin-7-O-Glucuronide (Wogonoside) 8.21E+04 4.94E+04 1.67E+05 2.09E+05 3.37E+04 7.47E+04 1.46E+05 9.05E+04 8.58E+04 1.11E+05 1.12E+05 4.25E+04 2.23E+05 7.24E+05 1.82E+05 3.70E+05 1.83E+05 4.08E+05 7.21E+04 2.83E+05 4.78E+05 3.70E+05 1.23E+05 3.04E+05 Guaiacol 1.27E+06 1.24E+06 1.52E+06 2.67E+06 1.47E+06 5.96E+05 6.94E+05 1.13E+06 9.44E+05 7.78E+05 1.37E+06 1.14E+06 1.85E+06 1.05E+06 1.27E+06 5.38E+05 1.10E+06 1.09E+06 8.78E+05 1.07E+06 2.40E+06 8.30E+05 1.92E+06 1.81E+06 L-α-Glutamyl-L-Glutamic Acid 3.04E+05 3.54E+05 1.83E+05 2.13E+05 2.25E+05 6.73E+04 2.70E+05 2.86E+05 2.84E+05 1.61E+05 1.60E+05 4.23E+05 1.59E+05 3.60E+04 2.56E+05 2.57E+04 2.39E+05 2.46E+05 1.72E+05 2.70E+05 1.73E+05 2.14E+05 2.17E+05 2.44E+05 Antiarol; 3,4,5-Trimethoxyphenol 2.55E+05 1.31E+05 4.14E+05 2.02E+05 1.89E+05 1.73E+05 2.61E+05 2.88E+05 3.18E+05 2.42E+05 2.22E+05 2.23E+05 1.35E+05 2.63E+05 1.48E+05 1.97E+05 1.73E+05 1.62E+05 5.69E+05 8.84E+04 7.30E+04 5.07E+05 3.04E+05 1.03E+05 Isoamericanin A 2.66E+05 3.80E+05 2.55E+05 1.48E+05 1.23E+05 2.40E+05 1.65E+05 2.63E+05 1.51E+05 2.10E+05 1.78E+05 1.84E+05 2.49E+05 3.42E+05 1.78E+05 3.00E+05 3.28E+05 1.66E+05 8.59E+04 3.17E+05 1.19E+05 1.74E+05 1.77E+05 4.39E+05 Ethylsalicylate 2.61E+06 2.59E+06 1.95E+06 2.27E+06 3.02E+06 2.38E+06 1.75E+06 3.33E+06 2.89E+06 1.31E+06 3.53E+06 3.74E+06 2.92E+06 2.23E+06 2.16E+06 6.88E+05 2.39E+06 1.87E+06 2.44E+06 3.36E+06 3.27E+06 2.23E+06 3.01E+06 3.75E+06 3-Indoleacrylic acid* 1.63E+06 9.94E+05 4.48E+05 7.75E+05 2.09E+06 1.17E+06 4.94E+05 4.48E+05 2.62E+06 8.35E+05 1.77E+06 6.53E+06 2.34E+06 7.10E+04 9.39E+05 4.99E+04 3.55E+05 8.75E+05 1.96E+05 3.52E+06 2.39E+06 1.77E+06 6.28E+05 2.03E+06 Mudanpinoic acid A 2.76E+05 1.68E+05 2.54E+05 2.22E+04 7.50E+05 1.04E+06 2.69E+05 6.77E+04 1.08E+06 5.62E+05 1.42E+06 8.02E+05 9.73E+05 7.34E+05 9.87E+05 1.58E+06 1.04E+06 1.45E+06 1.95E+06 9.02E+05 3.68E+05 6.90E+04 4.67E+04 2.30E+04 Gln-Cys-Gln 6.72E+05 2.77E+05 3.57E+05 3.20E+05 6.29E+05 1.36E+05 5.04E+05 2.93E+05 4.68E+05 1.90E+05 1.49E+05 1.49E+05 1.13E+05 3.39E+04 2.64E+05 9.07E+03 1.63E+05 2.62E+05 3.78E+05 7.35E+04 5.84E+04 1.11E+05 4.32E+05 1.33E+04 Isovanillin 1.72E+06 2.14E+06 2.02E+06 2.90E+06 2.43E+06 5.27E+06 4.58E+06 7.39E+06 2.35E+06 3.94E+06 1.90E+06 3.23E+06 6.11E+06 5.12E+06 4.92E+06 3.84E+06 4.14E+06 2.91E+06 1.71E+07 4.56E+06 9.41E+06 5.25E+06 9.99E+06 1.09E+07 Inosine 7.50E+04 9.66E+04 1.03E+05 8.25E+04 1.04E+05 1.52E+05 1.10E+05 9.36E+04 1.43E+05 9.36E+04 1.01E+05 7.10E+04 1.13E+05 1.02E+05 5.72E+04 9.18E+04 1.95E+05 5.53E+04 1.18E+05 5.90E+04 7.82E+04 2.47E+05 1.15E+05 1.45E+05 Avicennin 7.44E+05 6.27E+05 4.26E+05 6.69E+05 1.14E+06 5.16E+05 5.70E+05 4.76E+05 1.02E+06 4.31E+05 9.52E+05 6.82E+05 7.00E+05 3.53E+05 5.76E+05 2.61E+05 6.72E+05 5.19E+05 5.36E+05 8.63E+05 6.53E+05 7.37E+05 7.79E+05 9.40E+05 Anacardic acid 1.24E+04 1.26E+04 6.21E+04 1.14E+04 1.75E+04 3.09E+04 2.12E+04 2.78E+04 6.95E+04 1.06E+04 8.07E+04 2.80E+04 2.58E+05 2.55E+04 1.21E+04 2.07E+04 9.31E+03 2.49E+04 8.08E+04 1.29E+05 5.75E+04 1.08E+04 5.91E+04 1.77E+05 Horsfieldin glucose* 1.24E+07 2.46E+07 1.54E+07 2.28E+07 1.53E+07 8.50E+06 9.20E+06 1.82E+07 2.81E+07 1.35E+07 3.28E+06 2.66E+07 2.00E+07 9.33E+06 2.32E+07 1.74E+06 2.09E+07 3.05E+07 1.49E+07 9.15E+06 1.97E+07 8.61E+06 8.93E+06 2.21E+07 2'-Deoxyadenosine* 3.89E+04 3.39E+04 3.55E+04 1.17E+05 4.68E+04 2.49E+04 8.43E+04 3.84E+04 5.86E+04 6.83E+04 9.83E+04 1.11E+05 2.05E+05 1.11E+05 1.56E+05 6.37E+04 9.21E+04 6.97E+04 1.24E+05 1.75E+05 1.52E+05 6.51E+04 1.12E+05 6.76E+04 Butyl isobutyl phthalate* 1.24E+07 6.39E+06 5.06E+06 1.50E+07 3.65E+06 1.48E+07 6.95E+06 1.20E+07 1.21E+07 1.36E+07 1.49E+07 7.62E+06 1.28E+07 1.37E+07 1.80E+07 1.45E+07 1.10E+07 1.65E+07 7.46E+06 1.27E+07 1.32E+07 8.92E+06 1.42E+07 1.34E+07 Diosmetin-7-O-galactoside* 7.16E+05 5.78E+05 2.24E+05 4.27E+05 3.45E+05 4.77E+05 3.18E+05 5.41E+05 7.01E+05 3.18E+05 4.38E+05 4.23E+05 9.76E+05 5.07E+05 3.95E+05 1.40E+05 4.29E+05 6.31E+05 1.85E+05 6.40E+05 8.93E+05 7.16E+05 5.11E+05 1.18E+06 Vitexdoin C 4.07E+06 3.50E+06 8.80E+06 2.79E+06 5.83E+06 1.48E+06 8.08E+06 4.60E+06 5.81E+06 5.84E+06 2.84E+06 2.68E+06 3.90E+06 6.03E+06 5.29E+06 6.62E+06 5.51E+06 5.54E+06 6.31E+06 4.25E+06 1.48E+06 5.74E+06 8.40E+06 2.54E+06 N-(p-Coumaroyl)serotonin Glucoside 5.79E+07 5.36E+07 4.83E+07 4.63E+07 3.98E+07 3.29E+07 1.75E+07 5.83E+07 4.06E+07 2.61E+07 3.36E+07 5.61E+07 4.20E+07 3.16E+07 7.01E+07 1.55E+07 4.28E+07 6.51E+07 4.35E+07 4.21E+07 5.46E+07 1.74E+07 5.28E+07 4.77E+07 Senkyunolide M 1.01E+06 1.01E+06 1.70E+06 1.02E+06 1.46E+06 2.14E+06 1.80E+06 1.55E+06 1.33E+06 1.63E+06 1.26E+06 9.64E+05 1.55E+06 2.17E+06 1.30E+06 2.51E+06 1.84E+06 1.29E+06 2.12E+05 1.78E+06 1.36E+06 2.57E+06 1.72E+06 1.77E+06 Urinatetralin 4.02E+06 3.90E+06 5.87E+06 3.13E+06 3.28E+06 3.15E+06 2.50E+06 2.50E+06 2.76E+06 2.62E+06 2.87E+06 3.28E+06 5.35E+06 1.89E+06 3.27E+06 5.06E+06 2.68E+06 2.75E+06 3.33E+06 2.49E+06 3.12E+06 2.94E+06 9.06E+06 9.79E+05 Secoxyloganin 8.14E+05 4.59E+05 8.37E+05 4.96E+05 6.28E+05 4.33E+05 3.96E+05 3.90E+05 3.74E+05 2.72E+05 4.27E+05 1.12E+06 9.35E+05 2.12E+05 5.41E+05 1.92E+05 4.48E+05 5.86E+05 4.03E+05 3.25E+05 6.11E+05 4.45E+05 3.53E+05 4.82E+05 Anisic acid-O-feruloyl glucoside 3.46E+05 2.48E+05 3.15E+05 2.79E+05 2.45E+05 8.84E+04 4.32E+05 2.25E+05 2.11E+05 4.27E+05 2.20E+05 2.05E+05 1.04E+05 1.03E+05 3.50E+05 1.97E+05 8.03E+04 3.07E+05 2.77E+05 7.85E+04 1.93E+05 1.64E+05 3.24E+05 3.53E+05 3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-ol 2.00E+07 2.23E+07 2.48E+07 6.91E+06 3.44E+07 1.47E+07 1.88E+07 2.25E+07 2.63E+07 1.49E+07 3.80E+07 3.24E+07 2.69E+07 5.23E+06 1.85E+07 1.52E+07 2.23E+07 3.14E+07 2.25E+07 1.14E+07 4.34E+06 1.61E+07 1.59E+07 8.40E+06 7-Methylguanine 5.00E+04 3.80E+04 1.28E+05 5.30E+04 5.56E+04 6.77E+04 5.70E+04 6.42E+04 8.09E+04 6.19E+04 9.22E+04 6.05E+04 1.57E+05 2.34E+04 5.71E+04 8.16E+04 3.37E+04 4.06E+04 1.39E+05 5.69E+04 9.65E+04 3.58E+04 1.10E+05 8.49E+04 Cinnamoylglycine 1.74E+05 1.74E+05 1.69E+05 1.36E+05 2.53E+05 1.97E+05 1.03E+05 3.72E+05 2.12E+05 9.99E+04 2.55E+05 3.06E+05 1.99E+05 1.38E+05 1.16E+05 7.10E+04 2.30E+05 2.20E+05 3.37E+05 1.06E+05 1.28E+05 3.76E+05 8.02E+04 1.64E+05 Isorhamnetin-7-O-glucoside (Brassicin) 4.89E+05 4.65E+05 4.64E+05 2.38E+05 4.23E+05 5.42E+05 7.75E+05 4.92E+05 3.27E+05 8.10E+05 6.94E+05 2.65E+05 8.02E+05 6.26E+05 2.31E+05 2.81E+05 5.74E+05 3.25E+05 6.66E+05 5.01E+05 3.38E+05 5.37E+05 8.36E+05 3.38E+05 1-Methyladenine 4.77E+04 7.46E+04 1.17E+05 3.07E+04 4.61E+04 1.00E+05 8.29E+04 4.55E+04 1.53E+05 5.79E+04 9.22E+04 3.70E+04 1.12E+05 3.54E+04 5.19E+04 1.74E+04 5.29E+04 1.93E+05 4.18E+04 6.71E+04 1.29E+05 2.15E+04 8.42E+04 5.31E+04 N-Monocinnamoylputrescine* 4.60E+07 3.07E+07 3.41E+07 6.39E+07 2.35E+07 3.42E+07 2.56E+07 2.34E+07 1.02E+07 2.45E+07 3.17E+07 2.65E+07 1.65E+07 1.19E+07 2.46E+07 5.11E+06 1.74E+07 3.52E+07 2.34E+07 1.94E+07 2.53E+07 1.92E+07 5.71E+07 1.54E+07 Ladanetin-6-O-β-D-glucosid* 1.47E+06 7.31E+05 5.36E+05 1.31E+06 4.74E+05 4.53E+05 9.27E+05 5.84E+05 6.70E+05 5.53E+05 1.86E+05 6.20E+05 2.22E+05 7.55E+05 8.87E+05 4.54E+05 3.40E+05 9.96E+05 1.65E+05 9.76E+05 1.90E+05 7.11E+05 1.25E+06 7.29E+05 5'-Methoxylariciresinol 1.18E+05 1.08E+05 1.46E+05 7.78E+04 1.22E+05 1.22E+05 6.46E+04 6.82E+04 8.75E+04 8.91E+04 1.33E+05 1.50E+05 1.23E+05 9.51E+04 9.00E+04 1.31E+05 1.22E+05 1.22E+05 5.55E+04 9.95E+04 9.18E+04 7.62E+04 9.54E+04 1.19E+05 Indole 1.14E+07 6.71E+06 5.40E+06 8.02E+06 1.27E+07 5.72E+06 3.14E+06 1.60E+07 1.37E+07 4.85E+06 1.09E+07 2.25E+07 1.10E+07 4.41E+06 1.11E+07 4.03E+06 5.59E+06 4.02E+06 6.23E+06 1.39E+07 1.45E+07 1.32E+07 8.78E+06 1.34E+07 N6-Acetyl-L-lysine 4.53E+04 1.37E+05 6.34E+04 1.22E+05 2.08E+05 9.84E+04 1.23E+05 1.19E+05 9.03E+04 1.73E+05 1.29E+05 1.25E+05 1.38E+05 6.84E+04 1.54E+05 7.07E+04 1.21E+05 1.09E+05 1.57E+05 2.10E+05 3.38E+04 6.37E+04 1.03E+05 2.48E+05 L-Tyrosine* 1.15E+07 1.69E+07 1.04E+07 2.37E+07 2.38E+07 4.79E+06 1.53E+07 2.65E+07 1.98E+07 4.61E+06 8.55E+06 2.78E+07 2.42E+07 1.15E+06 1.97E+07 6.72E+05 9.48E+06 2.22E+07 8.49E+06 2.63E+07 4.69E+07 3.23E+07 1.31E+07 4.88E+07 Sinapoylagmatine 1.69E+05 1.91E+05 1.12E+05 1.52E+05 1.27E+05 1.56E+05 9.49E+04 1.86E+05 1.28E+05 1.55E+05 8.87E+04 1.63E+05 1.17E+05 4.27E+04 1.38E+05 5.47E+04 1.19E+05 1.15E+05 1.50E+05 1.64E+05 9.63E+04 1.11E+05 1.81E+05 2.15E+05 1β-hydroxy-β-cyperone 2.83E+04 6.63E+04 3.46E+04 2.11E+04 2.65E+04 7.72E+04 1.69E+05 6.95E+04 6.67E+04 7.53E+05 1.08E+05 7.20E+05 6.38E+04 1.65E+05 6.71E+04 7.49E+04 5.92E+05 6.93E+04 3.28E+05 3.10E+06 1.07E+05 4.93E+04 1.17E+05 6.88E+04 LysoPE 18:2(2n isomer) 4.65E+06 4.75E+06 4.64E+06 4.40E+06 3.65E+06 1.69E+06 1.33E+06 1.41E+06 5.21E+06 3.47E+06 2.81E+06 4.96E+06 2.25E+06 2.66E+05 3.70E+06 6.59E+05 3.42E+06 6.63E+06 4.47E+06 4.03E+06 1.90E+06 3.41E+06 2.35E+06 1.32E+06 19-Hydroxy-2-(hydroxymethyl)-A(1)-norursa-2,12-dien-28-oic acid (Coleonolic acid) 2.20E+06 1.45E+05 3.37E+05 6.18E+04 5.29E+05 3.15E+05 1.86E+06 7.23E+05 1.17E+06 2.95E+06 2.90E+06 4.18E+06 1.58E+06 1.08E+06 1.08E+06 3.03E+06 1.61E+06 2.80E+06 2.31E+06 2.68E+05 5.77E+05 9.31E+04 1.93E+05 6.47E+04 Reseoside* 1.15E+07 1.24E+07 9.57E+06 7.54E+06 1.71E+07 1.30E+07 7.73E+06 1.14E+07 1.27E+07 5.85E+06 6.52E+06 9.01E+06 1.23E+07 6.92E+06 1.15E+07 7.38E+06 1.39E+07 1.17E+07 1.00E+07 9.90E+06 5.81E+06 1.69E+07 1.24E+07 1.12E+07 Tyrosylleucine 2.66E+04 3.72E+05 7.27E+04 6.01E+04 4.24E+04 5.75E+04 3.09E+04 6.16E+04 1.88E+05 4.81E+04 1.18E+05 8.94E+04 4.50E+05 1.04E+04 8.54E+04 1.22E+04 1.35E+05 3.08E+04 6.63E+05 2.08E+05 2.27E+05 1.51E+05 3.82E+05 4.12E+04 Crenatoside 2.34E+05 2.22E+05 7.62E+05 1.70E+05 1.69E+05 1.47E+05 2.91E+05 2.27E+05 1.57E+05 6.78E+05 1.63E+05 2.55E+05 3.96E+05 1.22E+05 1.39E+05 2.24E+05 2.00E+05 2.13E+05 4.27E+05 3.00E+05 2.35E+05 1.48E+05 2.64E+05 2.77E+05 3-Hydroxyurs-5(6),12,18(19)-trien-28-oic acid (Uncargenin B) 5.72E+05 2.29E+04 2.05E+05 3.10E+04 7.23E+05 3.47E+05 1.43E+06 1.46E+05 3.41E+05 1.12E+06 2.41E+06 1.51E+06 5.34E+05 1.48E+06 1.36E+06 1.82E+06 4.26E+05 1.32E+06 1.31E+06 1.39E+06 1.63E+05 3.41E+04 5.74E+04 3.56E+04 Asn-Arg 2.67E+05 3.38E+05 2.39E+05 2.40E+05 2.85E+05 3.91E+05 2.22E+05 2.31E+05 2.94E+05 2.55E+05 3.25E+05 2.30E+05 2.22E+05 1.98E+05 1.32E+05 2.29E+05 2.50E+05 2.25E+05 1.70E+05 4.26E+05 1.88E+05 2.23E+05 3.02E+05 2.23E+05 Methylpicraquassioside A 6.89E+05 2.92E+06 7.32E+05 6.56E+05 6.29E+05 9.69E+05 1.10E+06 2.53E+06 2.66E+06 1.07E+06 8.23E+05 1.35E+06 2.96E+06 1.69E+05 7.94E+05 3.99E+05 7.71E+05 1.88E+06 9.94E+05 1.59E+06 1.58E+06 1.34E+06 7.10E+05 2.04E+06 L-Tyrosinamide 1.20E+05 2.87E+05 2.46E+05 1.75E+05 1.02E+05 1.22E+05 1.94E+05 1.04E+05 1.60E+05 9.10E+04 7.66E+04 8.48E+04 9.63E+04 6.11E+04 3.51E+05 9.77E+04 1.13E+05 2.98E+05 7.50E+04 9.51E+04 8.47E+04 7.54E+04 9.94E+04 1.37E+05 Suspenolic acid 1.97E+05 6.67E+04 1.75E+05 7.50E+04 1.42E+05 2.45E+05 1.68E+05 1.30E+05 2.49E+05 1.27E+05 1.59E+05 1.16E+05 1.98E+05 1.53E+05 9.42E+04 8.84E+04 1.22E+05 1.48E+05 4.77E+05 2.84E+05 3.16E+05 1.63E+05 2.70E+05 2.64E+05 2,19-Dihydroxy-3-oxo-24-norolean-12-en-28-oic acid* 3.89E+05 7.17E+03 2.53E+04 1.30E+04 3.98E+05 5.25E+04 7.06E+05 2.35E+05 1.99E+05 4.82E+05 5.07E+05 7.31E+05 3.46E+05 3.65E+05 2.59E+05 3.49E+05 3.24E+05 4.66E+05 5.77E+05 1.50E+05 9.17E+04 6.36E+03 2.09E+04 4.13E+03 LysoPC 19:2 2.37E+04 4.35E+04 1.05E+05 1.11E+05 1.17E+05 3.46E+04 1.10E+05 3.07E+05 2.78E+04 9.42E+04 4.76E+04 3.87E+04 5.16E+04 2.77E+05 3.51E+04 1.49E+05 4.69E+04 2.80E+04 2.34E+05 3.43E+04 2.57E+04 6.78E+04 9.26E+04 2.11E+04 30-Hydroxyfraxinellone 5.93E+06 3.25E+06 7.02E+06 2.60E+06 1.23E+07 5.89E+06 2.92E+06 3.85E+06 3.84E+06 2.72E+06 4.83E+06 5.83E+06 8.01E+05 6.88E+05 3.93E+06 1.69E+06 6.24E+06 4.70E+06 2.38E+06 1.43E+06 6.80E+05 3.18E+06 1.33E+07 3.14E+05 Ethyl maltol 6.19E+04 1.19E+05 3.03E+05 1.88E+05 1.13E+05 4.13E+05 8.67E+04 1.12E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 Symplocosin* 1.42E+06 2.33E+06 1.95E+06 1.44E+06 8.80E+05 8.55E+05 1.38E+06 1.17E+06 1.72E+06 1.14E+06 6.39E+05 1.35E+06 1.36E+06 7.30E+05 2.02E+06 6.67E+05 1.48E+06 2.19E+06 5.24E+05 1.69E+06 1.59E+06 1.52E+06 1.88E+06 1.77E+06 Dehydrodiconiferyl alcohol-gamma'-O-glucoside* 1.42E+06 2.33E+06 1.95E+06 1.44E+06 8.80E+05 8.55E+05 1.38E+06 1.17E+06 1.72E+06 1.14E+06 6.39E+05 1.35E+06 1.36E+06 7.30E+05 2.02E+06 6.67E+05 1.48E+06 2.19E+06 5.24E+05 1.69E+06 1.59E+06 1.52E+06 1.88E+06 1.77E+06 2,5-Dimethyl-7-hydroxychromone 1.98E+06 1.51E+06 7.84E+05 1.67E+06 1.34E+06 1.29E+06 9.69E+05 1.41E+06 1.37E+06 1.26E+06 1.23E+06 7.15E+05 2.10E+06 1.06E+06 1.67E+06 1.04E+06 1.04E+06 1.66E+06 5.65E+05 1.19E+06 1.18E+06 9.33E+05 2.17E+06 5.63E+05 Aquilegiolide 7.03E+05 9.41E+05 1.85E+06 1.21E+06 3.35E+06 5.34E+06 3.88E+06 1.17E+06 8.40E+05 2.01E+06 4.83E+06 2.61E+06 4.03E+06 3.52E+06 1.68E+06 6.76E+06 2.20E+06 1.07E+06 6.13E+06 4.61E+06 2.61E+06 2.97E+06 3.76E+06 3.66E+06 3-Indolepropionic acid 0.00E+00 0.00E+00 0.00E+00 0.00E+00 2.76E+05 1.33E+05 1.13E+05 1.14E+05 3.61E+05 8.06E+04 2.58E+05 7.24E+05 2.90E+05 3.50E+04 1.62E+05 6.44E+04 1.15E+05 1.08E+05 7.50E+04 4.85E+05 3.29E+05 2.31E+05 1.06E+05 3.56E+05 N-p-Coumaroylhydroxyputrescine 3.56E+05 1.39E+05 2.30E+05 1.50E+05 1.68E+05 1.06E+05 5.01E+05 1.99E+05 2.32E+05 2.42E+05 1.24E+05 1.33E+05 1.44E+05 2.69E+05 2.38E+05 2.14E+05 1.48E+05 2.70E+05 1.72E+05 1.86E+05 1.42E+05 2.75E+05 2.12E+05 1.44E+05 D-Allo-Isoleucine* 5.70E+06 2.03E+07 2.09E+07 8.34E+06 2.86E+07 1.47E+07 6.87E+07 7.69E+06 4.84E+07 9.69E+06 5.60E+07 1.58E+07 1.10E+08 5.80E+06 2.29E+07 1.41E+06 9.46E+06 1.57E+07 2.26E+07 4.52E+07 8.03E+07 9.55E+06 4.82E+07 1.05E+08 8-Hydroxy-5,5-dimethylpeltogynan 9.55E+04 3.00E+04 8.84E+04 1.52E+04 1.82E+04 2.46E+04 3.48E+04 1.04E+05 3.00E+04 4.29E+04 1.69E+04 3.75E+04 4.99E+04 8.51E+04 2.92E+04 4.59E+04 6.72E+04 7.84E+04 1.39E+06 2.26E+04 4.50E+04 2.19E+04 5.91E+04 2.57E+04 Ethyl cinnamate 1.77E+05 3.29E+04 5.70E+04 1.05E+05 7.40E+04 1.53E+05 2.25E+05 6.25E+04 4.31E+04 1.41E+05 5.22E+05 2.95E+05 1.02E+05 8.28E+04 1.17E+05 2.10E+05 3.25E+05 2.96E+05 7.05E+04 1.20E+06 3.38E+04 4.96E+04 4.19E+04 6.38E+04 p-menth-3-ene-1,2-diol 5.51E+04 9.85E+04 2.69E+05 1.23E+05 1.41E+05 1.52E+05 2.05E+05 2.05E+05 6.01E+04 2.35E+05 1.78E+05 2.80E+05 2.14E+05 2.07E+06 1.35E+05 2.91E+05 1.83E+05 6.80E+04 2.87E+05 1.28E+05 9.37E+04 1.70E+05 1.57E+05 1.05E+05 2'-Deoxycytidine 3.51E+05 4.23E+05 3.30E+05 1.95E+05 1.38E+05 3.17E+05 3.38E+05 1.65E+05 1.60E+05 3.84E+05 2.73E+05 2.96E+04 3.22E+05 1.52E+05 1.87E+05 2.45E+05 6.62E+05 3.87E+05 1.12E+05 2.18E+05 4.60E+05 1.56E+05 5.28E+04 2.65E+05 6-Methoxyquercetin-3-O-Xyloside 2.33E+04 1.67E+04 1.97E+04 2.00E+04 1.64E+04 1.88E+04 4.67E+04 4.72E+04 4.83E+04 8.34E+04 2.04E+05 8.50E+04 2.60E+05 7.84E+04 2.83E+04 1.49E+04 1.16E+05 3.33E+04 3.69E+05 1.18E+05 3.50E+04 1.80E+04 1.73E+05 4.11E+04 flavanthrinin 1.87E+05 5.06E+04 1.05E+05 4.30E+04 3.05E+05 2.69E+05 2.01E+05 1.60E+05 8.75E+04 2.13E+05 3.15E+05 3.21E+05 0.00E+00 0.00E+00 4.49E+04 3.79E+05 6.29E+04 4.65E+05 0.00E+00 0.00E+00 9.98E+04 8.84E+04 1.12E+05 6.84E+04 Byzantionoside A* 5.78E+05 8.18E+05 7.11E+05 6.28E+05 8.52E+05 5.54E+05 3.30E+05 1.29E+06 8.36E+05 3.72E+05 5.48E+05 6.68E+05 7.49E+05 2.30E+05 6.03E+05 4.86E+05 5.89E+05 9.48E+05 6.31E+05 5.65E+05 3.75E+05 9.15E+05 4.87E+05 6.40E+05 Fisetin 1.29E+06 1.14E+06 4.58E+05 5.14E+05 3.63E+05 4.55E+05 3.39E+05 9.59E+05 1.10E+06 3.04E+05 9.25E+05 3.98E+05 1.03E+06 6.51E+05 1.38E+06 2.30E+05 1.11E+06 1.14E+06 7.46E+05 8.77E+05 1.10E+06 8.07E+05 4.23E+05 1.10E+06 Ligstral 4.88E+06 3.45E+06 2.99E+06 2.53E+06 2.48E+06 2.13E+06 1.76E+06 3.74E+06 4.17E+06 1.34E+06 1.87E+06 4.22E+06 4.11E+06 3.80E+06 4.27E+06 1.82E+05 3.34E+06 3.53E+06 4.15E+06 3.22E+06 2.00E+06 4.24E+06 4.82E+06 4.62E+06 Citicoline 1.34E+05 1.21E+05 3.80E+05 8.49E+04 1.74E+05 2.98E+04 1.22E+05 1.39E+05 6.07E+04 6.34E+04 7.70E+04 1.11E+05 4.15E+04 4.16E+04 1.19E+05 1.01E+05 1.51E+05 4.68E+04 2.26E+04 3.51E+05 6.17E+04 5.32E+04 1.73E+05 8.31E+04 Myrisfragransin 5.45E+04 7.68E+04 1.07E+05 7.50E+04 2.79E+05 1.84E+05 2.91E+06 4.64E+06 1.71E+05 1.56E+06 8.60E+04 5.74E+05 3.57E+04 1.04E+05 1.95E+04 2.30E+04 2.26E+05 8.41E+03 3.00E+05 1.58E+05 2.17E+04 1.53E+04 6.61E+05 1.53E+04 Ciwujiatone 2.58E+06 4.93E+06 6.39E+06 1.29E+06 3.16E+06 3.10E+06 4.18E+06 7.85E+06 6.75E+06 3.22E+06 3.56E+06 3.58E+06 1.02E+07 1.21E+06 1.85E+06 2.76E+06 5.73E+06 2.42E+06 2.21E+06 1.63E+06 1.30E+07 2.73E+06 1.09E+07 2.28E+06 Ser-Leu-Leu 3.50E+04 3.45E+05 5.14E+04 5.51E+04 5.33E+04 5.94E+04 8.21E+04 4.48E+04 1.35E+05 4.01E+04 5.53E+04 3.27E+04 5.78E+05 4.19E+04 9.90E+04 2.79E+04 1.83E+05 1.50E+04 6.96E+05 2.33E+05 1.78E+05 1.39E+05 4.93E+05 1.01E+05 Leu-Arg 7.34E+04 6.23E+05 2.84E+05 1.70E+05 1.70E+05 1.57E+05 2.60E+05 2.16E+05 7.96E+05 2.67E+05 6.01E+05 1.58E+05 4.94E+05 8.06E+04 2.55E+05 1.32E+05 5.70E+05 6.57E+04 4.87E+05 8.94E+05 2.00E+05 3.96E+05 7.62E+05 2.71E+05 5,7-dihydroxy-3-(4'-hydroxybenzyl)-chroman-4-one 2.39E+05 4.85E+04 4.78E+05 4.04E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 6.07E+04 3.33E+05 7.13E+04 2.95E+05 6.81E+04 5.48E+05 5.56E+05 7.59E+05 3.86E+05 1.07E+05 2.04E+05 5.83E+05 1.87E+04 1.57E+05 5.86E+05 8.70E+05 Kingiside 3.19E+05 2.12E+05 2.75E+05 9.00E+04 2.70E+05 3.22E+05 2.62E+05 3.49E+05 3.16E+05 2.21E+05 2.19E+05 2.53E+05 3.37E+05 1.91E+05 2.60E+05 1.25E+05 2.41E+05 3.11E+05 1.12E+05 2.49E+05 2.23E+05 2.57E+05 2.17E+05 2.30E+05 Vitexin-2''-O-galactoside 8.17E+05 1.36E+06 9.21E+05 4.83E+05 5.74E+05 2.08E+06 1.67E+06 2.12E+06 1.32E+06 6.82E+05 6.86E+05 9.97E+05 4.16E+06 4.24E+05 4.51E+05 6.57E+05 6.92E+05 7.61E+05 1.98E+06 1.16E+06 2.72E+06 3.97E+05 1.12E+06 2.24E+06 1,1'-(6-hydroxy-2,3-dihydro-1H-indene-2,5-diyl)bis(ethan-1-one) 4.31E+07 4.88E+07 1.46E+07 4.49E+07 1.59E+07 4.33E+07 6.75E+06 1.97E+07 1.45E+07 1.03E+07 4.10E+07 1.27E+07 1.78E+07 3.66E+06 4.67E+07 6.41E+06 3.28E+07 2.57E+07 2.91E+07 2.40E+07 1.26E+07 2.21E+07 4.27E+07 1.93E+07 Tranexamic Acid 1.94E+04 1.49E+04 6.67E+04 2.35E+05 1.55E+04 6.20E+04 3.83E+04 1.73E+04 1.97E+04 3.41E+04 5.00E+04 6.34E+04 3.16E+04 1.37E+04 8.94E+03 5.84E+04 3.24E+04 2.84E+04 3.42E+04 5.67E+04 1.67E+04 2.09E+04 2.50E+04 8.35E+03 N-Acetyl-D-glucosamine 2.88E+05 2.78E+05 3.72E+05 2.55E+05 3.58E+05 6.02E+05 2.66E+05 2.67E+05 5.13E+05 2.94E+05 3.51E+05 4.42E+05 8.99E+05 3.21E+05 3.76E+05 3.81E+05 3.00E+05 3.64E+05 4.20E+05 3.15E+05 4.14E+05 3.53E+05 2.77E+05 3.82E+05 5-Methoxy-DL-tryptophan 2.44E+05 1.52E+05 1.78E+05 2.47E+05 6.11E+04 1.12E+05 1.81E+05 3.79E+05 1.28E+05 1.82E+05 1.15E+05 1.19E+05 1.56E+05 1.95E+05 2.74E+05 1.06E+05 1.86E+05 1.82E+05 1.13E+05 1.87E+05 1.30E+05 1.15E+05 6.15E+04 2.05E+05 Dihydropyrocurzerenone 2.69E+05 1.09E+06 1.57E+05 4.42E+04 4.65E+05 1.99E+05 1.07E+06 2.42E+05 3.90E+05 1.67E+06 3.35E+06 1.25E+06 9.48E+05 5.32E+05 3.03E+05 4.45E+05 6.08E+05 1.73E+06 7.65E+05 6.04E+05 1.43E+05 4.75E+04 5.39E+04 1.61E+04 Arginine methyl ester* 7.79E+04 1.39E+05 1.05E+05 1.37E+05 1.26E+05 1.08E+05 1.66E+05 8.96E+04 5.36E+04 9.51E+04 7.67E+04 1.74E+05 1.14E+05 9.46E+04 1.27E+05 3.76E+04 1.73E+05 1.60E+05 1.38E+05 9.03E+05 4.67E+05 2.35E+06 7.72E+04 3.31E+05 Robinetin 4.07E+05 3.30E+05 4.62E+05 1.68E+05 5.06E+05 3.60E+05 5.28E+05 6.48E+05 4.24E+05 3.58E+05 2.38E+05 2.21E+05 1.90E+05 2.75E+05 1.55E+05 4.97E+05 6.43E+05 3.62E+05 3.34E+05 2.87E+05 2.15E+05 3.41E+05 2.67E+05 2.13E+05 6-hydroxycoumarin 1.66E+06 1.00E+06 2.67E+06 9.31E+05 1.54E+06 5.28E+05 2.08E+06 1.74E+06 1.97E+06 1.66E+06 7.67E+05 7.87E+05 9.95E+05 2.36E+06 1.79E+06 2.09E+06 1.57E+06 1.80E+06 2.12E+06 1.44E+06 6.10E+05 2.50E+06 2.77E+06 6.77E+05 Calceolarioside B* 2.51E+06 1.44E+06 2.14E+06 1.96E+06 2.23E+06 4.50E+05 1.11E+06 3.15E+06 1.05E+06 3.29E+06 8.83E+05 1.58E+06 3.29E+06 3.44E+06 1.54E+06 5.47E+06 7.25E+06 3.90E+06 3.99E+06 3.82E+06 2.14E+06 5.34E+06 8.01E+06 9.62E+05 2,3-Dihydroxyurs-12-en-29-oic acid (Maslinic acid) 6.02E+04 6.09E+03 7.88E+03 2.76E+03 9.05E+04 3.70E+04 1.18E+05 1.50E+04 1.86E+05 4.39E+04 2.54E+05 3.45E+05 1.58E+05 8.13E+04 1.26E+05 5.00E+05 6.05E+04 2.61E+05 1.67E+05 1.83E+05 6.07E+04 2.09E+04 1.80E+04 2.56E+03 Biotin 6.62E+05 6.82E+05 3.14E+05 6.26E+05 8.41E+05 4.52E+05 7.10E+05 5.19E+05 4.42E+05 1.96E+06 3.64E+05 8.39E+05 2.64E+05 4.28E+05 2.39E+05 4.82E+05 5.17E+05 6.87E+05 3.52E+06 5.58E+05 5.24E+05 8.70E+05 8.44E+05 7.10E+05 2-Phenylaminoadenosine 1.67E+06 3.37E+06 7.29E+06 1.28E+06 1.66E+06 4.36E+06 2.89E+06 2.88E+06 1.67E+06 1.91E+06 3.33E+06 2.03E+06 3.09E+06 7.84E+06 1.70E+06 1.05E+07 8.18E+06 4.88E+06 2.61E+06 5.01E+06 3.38E+06 1.52E+06 2.75E+06 3.02E+06 Methyl dioxindole-3-acetate 5.03E+04 4.52E+04 4.15E+04 5.94E+04 4.68E+04 4.78E+04 3.58E+04 4.27E+04 8.67E+04 2.14E+04 3.20E+04 5.84E+04 5.80E+04 1.83E+04 3.53E+04 1.01E+04 3.90E+04 7.92E+04 6.66E+04 6.28E+04 5.68E+04 5.64E+04 4.38E+04 5.19E+04 Gardnerol A 4.77E+06 8.40E+06 8.15E+06 3.43E+06 7.00E+06 7.84E+06 8.95E+06 7.91E+06 7.78E+06 7.44E+06 1.57E+07 1.28E+07 1.40E+07 1.48E+07 1.27E+07 6.87E+06 1.61E+07 9.45E+06 1.26E+07 2.40E+07 1.65E+07 6.62E+06 1.13E+07 3.76E+07 Dopamine 2.15E+04 1.18E+05 9.63E+04 1.79E+04 4.67E+04 3.10E+04 3.22E+04 4.11E+04 1.02E+05 7.00E+04 4.97E+04 2.51E+04 8.17E+04 7.28E+04 4.67E+04 7.14E+04 1.62E+05 6.58E+04 3.88E+04 1.38E+05 1.30E+05 2.44E+04 6.17E+04 7.02E+04 (R)-3-ethyl-7-hydroxy-6-methoxyphthalide 4.47E+07 2.18E+07 3.99E+07 1.99E+07 2.54E+07 1.60E+07 1.34E+07 2.70E+07 1.80E+07 1.41E+07 9.16E+06 1.29E+07 2.83E+07 1.41E+07 4.45E+07 9.00E+06 4.35E+07 3.45E+07 2.72E+07 2.42E+07 1.56E+07 1.55E+07 4.02E+07 3.60E+07 Fraxetin (7,8-Dihydroxy-6-methoxycoumarin) 5.49E+06 8.20E+06 5.35E+06 6.24E+06 7.44E+06 5.79E+06 9.38E+06 5.02E+06 5.12E+06 4.20E+06 4.22E+06 5.21E+06 8.14E+06 1.04E+07 5.99E+06 4.71E+06 7.49E+06 5.86E+06 6.15E+06 3.99E+06 7.65E+06 4.68E+06 6.06E+06 5.89E+06 Phe-Ile 2.77E+04 2.90E+05 1.15E+05 3.40E+04 5.50E+04 4.25E+04 3.73E+04 2.62E+04 6.76E+04 2.07E+04 7.56E+04 4.35E+04 1.93E+05 2.33E+04 7.34E+04 6.48E+03 8.00E+04 1.02E+04 2.06E+05 8.48E+04 1.04E+05 3.08E+05 3.88E+05 3.09E+04 Hyp-Val 8.33E+04 7.74E+04 7.60E+04 7.31E+04 1.24E+05 1.89E+05 1.32E+05 3.73E+04 1.06E+05 9.77E+04 1.10E+05 8.52E+04 6.76E+04 1.64E+05 8.53E+04 2.38E+05 9.50E+04 1.20E+05 1.16E+05 3.00E+04 1.22E+05 5.94E+04 8.45E+04 2.62E+04 Maohuoside A 9.10E+06 2.70E+07 1.67E+07 1.61E+07 1.04E+07 9.59E+06 4.10E+06 1.65E+07 2.01E+07 5.59E+06 8.66E+06 1.49E+07 1.08E+07 2.37E+06 1.30E+07 2.12E+06 1.29E+07 1.01E+07 7.54E+06 1.19E+07 1.29E+07 9.48E+06 5.83E+06 6.74E+06 Syringetin-3-O-(6''-Acetyl)glucoside 6.99E+04 5.62E+04 1.15E+05 6.38E+04 1.13E+05 1.02E+05 1.20E+05 1.20E+05 8.11E+04 8.62E+04 2.83E+04 5.25E+04 5.04E+04 5.94E+04 7.87E+04 1.51E+05 5.75E+04 7.48E+04 6.50E+04 8.32E+04 5.22E+04 5.00E+04 1.00E+05 7.62E+04 Strictamine 2.83E+06 3.91E+06 3.20E+06 5.37E+06 5.13E+06 3.45E+06 2.45E+06 2.66E+06 3.10E+06 4.61E+06 3.85E+06 4.63E+06 5.94E+06 2.90E+06 4.51E+06 2.96E+06 4.48E+06 2.99E+06 5.21E+06 7.95E+06 4.73E+06 3.14E+06 7.53E+06 7.88E+06 9-Oxo-10,12-Octadecadienoic Acid 1.50E+05 1.50E+05 4.97E+05 7.66E+04 2.40E+05 5.28E+05 2.04E+05 6.28E+05 1.72E+05 2.97E+05 2.14E+05 2.44E+05 4.30E+05 6.94E+04 1.01E+05 1.26E+06 1.42E+05 9.87E+04 1.25E+05 1.16E+05 8.24E+04 4.14E+04 1.30E+05 2.22E+05 7-Hydroxy-4-chromone 1.68E+07 1.52E+07 6.90E+06 5.40E+06 1.23E+07 2.12E+06 2.81E+07 2.21E+07 1.22E+07 3.66E+07 8.29E+06 2.57E+07 1.04E+07 1.18E+07 1.78E+07 9.06E+06 1.48E+07 2.20E+07 1.79E+07 1.30E+07 2.78E+06 7.37E+06 1.14E+07 5.05E+06 Triethylamine 1.33E+05 2.34E+05 1.12E+05 9.76E+04 1.24E+05 1.21E+05 1.72E+05 1.09E+05 8.25E+04 2.04E+05 1.50E+05 7.99E+04 1.29E+05 2.00E+05 6.33E+04 2.05E+05 9.53E+04 1.01E+05 9.48E+04 1.83E+05 1.48E+05 8.84E+04 9.00E+04 1.05E+05 Val-Trp 1.83E+04 1.10E+05 5.96E+04 5.64E+04 2.47E+04 8.20E+04 2.79E+04 3.35E+04 1.00E+05 1.96E+04 5.41E+04 6.00E+04 1.96E+05 3.33E+04 2.33E+04 3.33E+04 9.00E+04 1.84E+04 2.78E+05 6.69E+04 7.59E+04 1.25E+05 5.23E+05 4.84E+04 2,3,4-Trihydroxybutyl 6-O-(E)-caffeoyl-β-D-glucopyranoside 6.75E+04 1.93E+05 1.57E+05 1.72E+05 1.45E+05 2.30E+05 2.00E+05 1.57E+05 1.28E+05 1.11E+05 1.12E+05 1.19E+05 8.26E+04 9.94E+04 1.05E+05 1.30E+05 1.36E+05 1.13E+05 8.52E+04 1.14E+05 1.50E+05 1.30E+05 1.46E+05 2.08E+05 Lys-Ala 2.84E+04 1.28E+05 3.67E+04 4.22E+04 4.34E+04 3.26E+04 1.14E+05 6.20E+04 9.85E+04 3.23E+04 3.76E+04 3.39E+04 8.47E+04 3.57E+04 5.84E+04 2.49E+04 3.55E+04 2.68E+04 4.22E+04 8.10E+04 1.08E+05 2.17E+05 7.36E+05 5.30E+04 Cyclo(L-Phe-trans-4-hydroxy-L-Pro) 4.00E+04 2.81E+04 5.40E+04 2.50E+04 3.48E+04 1.28E+04 3.17E+04 1.00E+04 6.04E+03 2.12E+04 1.33E+04 2.17E+04 3.17E+04 2.17E+04 2.69E+04 1.68E+04 7.85E+03 2.55E+04 3.76E+04 8.34E+03 2.35E+04 5.00E+04 1.15E+05 3.50E+04 2-(Acetylamino)-3-phenyl-2-propenoic acid 1.69E+06 2.92E+06 1.07E+06 1.02E+06 4.76E+06 5.20E+06 7.28E+05 3.78E+06 4.63E+06 1.23E+06 4.60E+06 4.36E+06 3.50E+06 9.32E+05 1.41E+06 1.25E+06 1.69E+06 4.18E+06 2.62E+06 1.83E+06 2.32E+06 2.50E+06 1.22E+06 1.13E+06 Bursehernin* 1.70E+07 1.17E+07 9.65E+06 6.72E+06 1.74E+07 1.47E+07 1.07E+07 1.43E+07 1.67E+07 8.10E+06 8.92E+06 9.28E+06 1.51E+07 4.62E+06 1.89E+07 6.52E+06 2.29E+07 1.76E+07 1.02E+07 1.10E+07 6.45E+06 1.48E+07 1.43E+07 1.13E+07 L-Cystathionine 7.60E+04 3.00E+04 7.36E+04 8.84E+04 7.84E+04 5.44E+04 8.59E+04 5.32E+04 6.50E+04 5.81E+04 6.58E+04 7.54E+04 0.00E+00 0.00E+00 8.12E+04 2.15E+04 5.72E+04 5.67E+04 0.00E+00 0.00E+00 4.23E+04 5.63E+04 3.83E+04 4.04E+04 (3R,4S,6R)-p-Menth-1-ene-3,6-diol-3-O-β-D-glucoside* 0.00E+00 0.00E+00 0.00E+00 0.00E+00 5.08E+04 9.77E+04 1.20E+05 6.06E+04 5.34E+04 1.32E+05 9.87E+04 1.93E+05 3.84E+05 1.34E+05 1.04E+05 9.91E+04 5.31E+04 1.17E+05 1.18E+05 5.64E+04 1.20E+05 8.95E+04 1.37E+05 8.52E+04 Met-Met 1.49E+04 8.04E+04 9.60E+03 7.17E+03 3.15E+04 1.60E+04 9.59E+03 5.45E+03 3.90E+04 9.88E+03 3.14E+04 2.54E+04 3.41E+04 3.84E+03 1.97E+04 1.97E+04 5.84E+04 1.79E+03 6.45E+04 5.72E+04 1.29E+04 3.36E+04 4.30E+04 1.41E+04 Gln-Asp-Val 8.57E+07 1.17E+08 9.12E+07 5.63E+07 1.14E+08 9.51E+07 5.76E+07 9.00E+07 8.77E+07 5.15E+07 6.61E+07 6.09E+07 4.89E+07 2.08E+07 7.62E+07 3.21E+07 1.10E+08 7.31E+07 3.21E+07 9.65E+06 2.21E+07 5.68E+07 6.87E+07 6.46E+06 3-(4-hydroxybenzene)-5,7-dihydroxy-6-methoxychroman-4-one malonyl glucoside 8.62E+05 7.95E+05 1.02E+06 4.84E+05 8.14E+05 6.71E+05 6.79E+05 3.96E+05 6.76E+05 4.31E+05 8.17E+05 4.77E+05 7.13E+05 1.77E+05 7.86E+05 8.40E+05 7.14E+05 6.83E+05 4.92E+05 3.23E+05 3.85E+05 5.44E+05 6.63E+05 1.93E+05 N6-Isopentenyladenine 7.97E+03 3.22E+04 1.17E+04 1.05E+05 1.58E+05 1.60E+04 3.19E+04 3.50E+04 3.53E+04 5.41E+04 2.87E+04 2.99E+04 3.00E+04 2.00E+04 1.22E+05 5.59E+03 5.84E+04 4.39E+04 1.82E+04 1.75E+05 1.59E+05 1.91E+04 8.34E+03 2.17E+04 1,3-O-Dicaffeoylglycerol 2.65E+06 3.43E+06 2.45E+06 1.56E+06 5.94E+06 2.94E+06 1.70E+06 3.02E+06 3.62E+06 1.43E+06 4.48E+06 5.41E+06 3.95E+06 5.60E+05 2.12E+06 5.44E+05 2.94E+06 2.61E+06 2.27E+06 1.51E+06 2.14E+06 2.48E+06 2.29E+06 7.20E+05 6-Hydroxy-3-oxooleana-11,13(18)-dien-28-oic acid 1.42E+05 6.42E+03 5.37E+04 1.08E+04 3.64E+04 5.34E+04 6.35E+05 1.09E+05 1.68E+05 7.93E+05 3.64E+05 4.89E+05 3.99E+05 2.46E+05 7.22E+05 2.26E+05 3.69E+05 3.46E+05 2.30E+05 1.84E+05 3.18E+05 1.28E+04 2.70E+04 1.15E+04 3-O-caffeoyl quininyl arabinoside 3.48E+07 3.52E+07 3.58E+07 3.19E+07 2.48E+07 3.01E+07 2.07E+07 2.38E+07 3.51E+07 4.37E+07 3.42E+07 2.39E+07 2.67E+07 2.56E+07 3.05E+07 3.72E+07 2.91E+07 2.98E+07 2.09E+07 3.09E+07 3.58E+07 2.42E+07 2.90E+07 3.14E+07 Malonyltryptophan 2.30E+05 1.79E+05 2.24E+05 2.45E+05 2.10E+05 1.20E+05 1.95E+05 2.16E+05 2.05E+05 1.37E+05 1.41E+05 1.90E+05 1.88E+05 2.34E+05 2.59E+05 3.30E+05 1.99E+05 2.26E+05 1.98E+05 2.39E+05 2.39E+05 1.49E+05 2.89E+05 2.23E+05 Fraxetin glucuronide 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 2.17E+04 3.37E+04 3.94E+04 4.94E+04 6.44E+04 1.70E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 4.53E+04 4.17E+04 4.67E+04 5.00E+04 6.67E+04 4.56E+04 Glycidyl Linoleate 7.14E+04 8.14E+04 4.90E+04 2.89E+04 4.60E+04 7.41E+04 5.76E+04 2.84E+04 1.08E+05 2.91E+04 1.15E+05 1.40E+05 1.07E+05 3.00E+04 8.03E+04 3.33E+04 7.12E+04 3.45E+04 4.40E+04 9.46E+04 7.05E+04 4.01E+04 3.96E+04 1.16E+05 Isorhamnetin-3-O-sophoroside-7-O-rhamnoside* 2.67E+04 2.53E+04 1.27E+04 4.00E+04 4.67E+04 1.00E+04 6.67E+03 2.00E+04 1.31E+04 1.24E+04 3.41E+04 4.05E+04 8.34E+03 1.83E+04 1.51E+04 3.17E+04 2.00E+04 3.21E+04 3.33E+04 1.24E+04 1.83E+04 3.34E+03 1.10E+04 1.38E+03 Rhodionidin 1.44E+04 1.17E+04 9.55E+04 2.61E+05 3.80E+04 6.53E+04 3.37E+04 2.46E+04 2.66E+04 4.64E+04 3.90E+04 3.17E+04 6.60E+04 2.12E+05 5.01E+05 6.94E+04 2.20E+04 2.13E+04 1.95E+05 2.82E+05 8.25E+04 1.65E+05 1.06E+05 8.46E+04 Scopoletin-7-O-xylosyl(1→6)glucoside 1.64E+06 7.30E+05 1.24E+06 1.53E+06 1.41E+06 9.53E+05 1.23E+06 8.93E+05 7.31E+05 1.36E+06 1.27E+06 1.23E+06 8.96E+05 1.14E+06 1.40E+06 1.09E+06 1.28E+06 1.47E+06 1.12E+06 1.02E+06 1.15E+06 8.55E+05 1.41E+06 7.25E+05 Quercetin-3-O-glucoside-7-O-rhamnoside* 1.17E+04 3.67E+04 3.05E+04 4.00E+04 3.67E+04 6.16E+03 4.67E+04 2.67E+04 1.55E+04 1.71E+04 3.33E+04 2.17E+04 1.83E+04 1.62E+04 6.67E+03 5.17E+04 2.33E+04 1.17E+04 2.29E+04 2.00E+04 3.19E+04 1.00E+04 1.50E+04 1.67E+04 3-hydroxylup-12(13),20(29)-diene 3.13E+04 8.81E+03 1.26E+04 5.46E+03 2.14E+04 3.06E+04 9.57E+04 5.87E+04 4.42E+04 1.13E+05 1.69E+05 2.17E+05 9.02E+04 1.20E+05 8.36E+04 1.19E+05 7.21E+04 1.75E+05 2.14E+05 1.00E+05 2.96E+04 3.06E+04 1.00E+04 9.10E+03 Forsythoside H* 1.07E+06 1.85E+06 1.17E+06 3.79E+05 1.17E+06 1.20E+05 2.46E+06 2.07E+06 1.49E+06 4.23E+06 7.65E+05 3.58E+06 1.68E+06 7.64E+05 3.26E+06 1.05E+06 1.73E+06 2.81E+06 2.23E+06 1.42E+06 3.15E+05 1.55E+06 1.11E+06 1.03E+06 Met-Asp 2.62E+06 2.68E+06 2.21E+06 2.54E+06 1.95E+06 1.37E+06 1.33E+06 3.57E+06 1.65E+06 1.73E+06 1.61E+06 1.05E+06 1.58E+06 5.70E+05 2.16E+06 9.64E+05 2.49E+06 2.31E+06 1.94E+06 2.54E+06 1.44E+06 2.56E+06 2.10E+06 2.52E+06 5,7-Dihydroxy-4-methylcoumarin 2.37E+06 2.85E+06 5.29E+06 2.45E+06 3.81E+06 3.56E+06 1.41E+06 3.41E+06 3.39E+06 1.59E+06 4.27E+06 5.42E+06 3.96E+06 1.68E+06 3.05E+06 9.36E+05 2.27E+06 2.56E+06 3.94E+06 3.53E+06 2.34E+06 3.68E+06 3.82E+06 4.97E+06 Medioresinol B 3.47E+05 2.51E+05 4.22E+05 4.42E+05 3.42E+05 2.45E+05 2.63E+05 4.69E+05 3.57E+05 3.96E+05 2.26E+05 2.24E+05 2.33E+05 2.26E+05 3.37E+05 8.31E+05 4.58E+05 3.87E+05 1.18E+05 8.38E+04 2.38E+05 5.21E+05 1.70E+05 7.50E+04 2-amino-3-(1H-pyrazol-1-yl)propanoic acid 1.28E+05 8.24E+05 4.90E+05 2.00E+06 3.76E+06 7.24E+04 1.72E+05 7.45E+05 9.50E+05 2.20E+05 2.66E+06 3.00E+05 2.68E+06 9.17E+04 1.37E+06 6.17E+04 2.69E+05 3.02E+05 1.07E+05 8.20E+05 3.38E+06 2.18E+06 3.05E+06 2.20E+06 Methoxyindoleacetic acid 3.97E+05 1.40E+05 4.91E+05 2.53E+05 2.91E+05 1.31E+05 2.32E+05 3.57E+05 2.53E+05 1.46E+05 2.67E+05 4.64E+05 3.79E+05 1.23E+05 1.91E+05 2.05E+05 3.72E+05 2.00E+05 3.56E+05 1.23E+05 4.06E+05 1.26E+05 1.38E+05 1.30E+05 (2E)-3-(1-Hydroxy-2,6,6-trimethyl-4-oxo-2-cyclohexen-1-yl)-2-propenoic acid 1.44E+06 5.21E+05 6.28E+05 1.32E+06 8.77E+05 7.32E+05 7.55E+05 2.98E+06 3.12E+06 7.05E+05 9.69E+05 1.17E+06 7.14E+05 1.37E+06 1.25E+06 1.04E+06 5.39E+05 2.39E+06 1.05E+06 7.86E+05 1.38E+06 6.61E+05 4.80E+05 4.78E+05 Elaeocarpucin A* 6.64E+05 2.48E+04 8.68E+04 1.74E+04 3.34E+05 9.62E+04 5.44E+05 4.27E+05 1.05E+05 5.02E+05 3.35E+06 1.34E+06 3.14E+06 1.16E+06 5.84E+05 1.79E+06 6.23E+05 1.23E+06 1.36E+06 5.13E+05 2.06E+05 1.99E+04 7.81E+04 8.18E+03 (S)-Peucedanol 5.37E+05 8.53E+05 6.23E+05 8.42E+05 4.56E+05 2.73E+05 7.08E+05 5.57E+05 5.45E+05 4.69E+05 5.42E+05 5.52E+05 6.86E+05 4.07E+05 8.38E+05 1.08E+05 3.11E+05 2.77E+05 7.46E+05 5.50E+05 2.37E+05 5.56E+05 6.46E+05 7.85E+05 Epimedoside A 4.45E+05 2.64E+05 1.98E+05 3.14E+05 1.76E+05 2.92E+05 4.79E+05 1.71E+05 2.98E+05 3.39E+05 3.58E+05 5.24E+05 5.67E+05 2.12E+05 2.15E+05 3.07E+05 2.84E+05 3.00E+05 2.14E+05 4.95E+05 2.52E+05 2.00E+05 5.59E+05 1.92E+05 Anisic acid; 4-Methoxybenzoic acid 2.00E+05 1.58E+05 1.56E+05 7.83E+04 8.42E+04 3.86E+05 2.73E+05 1.06E+05 6.87E+04 1.71E+05 1.48E+05 2.35E+05 2.90E+05 1.53E+05 1.46E+05 2.95E+05 1.39E+05 1.03E+05 1.92E+05 2.59E+05 1.83E+05 1.83E+05 1.04E+05 1.88E+05 Tryptamine 2.56E+04 5.50E+04 2.09E+04 3.31E+04 2.77E+04 4.33E+04 4.13E+04 1.45E+04 2.77E+04 4.33E+04 3.26E+04 1.02E+05 4.94E+04 2.88E+04 4.06E+04 2.77E+04 1.10E+04 3.67E+04 5.84E+04 3.39E+04 1.45E+05 7.61E+04 4.39E+04 2.01E+04 Met-Thr 5.43E+04 7.52E+04 6.02E+04 6.36E+04 6.57E+04 6.36E+04 1.12E+05 9.17E+04 5.43E+04 1.17E+05 1.68E+05 9.34E+04 9.17E+04 1.49E+04 1.32E+05 5.67E+04 8.34E+04 1.08E+05 6.17E+04 1.35E+05 5.16E+04 8.47E+04 6.55E+04 7.84E+04 Tyr-Ala 4.76E+04 1.20E+05 9.03E+04 5.19E+04 7.00E+04 5.64E+04 2.80E+05 3.09E+05 9.95E+04 9.16E+04 5.67E+04 6.98E+04 1.60E+05 1.11E+05 7.57E+04 4.29E+04 4.32E+04 7.82E+04 1.54E+05 2.03E+05 8.11E+04 1.43E+05 4.49E+05 7.31E+04 3-Hydroxyanthranilic acid 5.12E+05 7.67E+05 5.71E+05 4.04E+05 3.59E+05 4.64E+05 3.13E+05 3.65E+05 7.09E+05 4.39E+05 5.35E+05 5.94E+05 5.38E+05 3.40E+05 5.80E+05 4.74E+05 6.27E+05 6.21E+05 4.44E+05 7.36E+05 3.52E+05 5.47E+05 7.00E+05 5.16E+05 6β-Hydroxy-8α-methoxyeremophila-1(10),7(11)-dien-12,8β-olide* 6.78E+06 5.23E+06 8.88E+06 2.10E+06 4.52E+06 7.95E+06 7.35E+06 7.13E+06 6.48E+06 9.54E+06 8.53E+06 9.84E+06 6.48E+06 5.42E+06 4.78E+06 9.34E+06 7.81E+06 7.38E+06 4.69E+06 8.12E+06 6.27E+06 4.29E+06 7.50E+06 7.29E+06 Sinapyl fraxin 7.24E+04 8.42E+04 1.05E+05 5.82E+04 1.73E+05 8.00E+04 2.90E+04 6.03E+04 3.86E+04 4.46E+04 1.08E+05 4.33E+04 3.33E+04 6.65E+04 5.80E+04 4.92E+04 5.38E+04 6.16E+04 8.77E+04 4.17E+04 4.50E+04 9.60E+04 6.23E+04 3.25E+04 Dehydrodiconiferyl alcohol-4-O-glucoside* 9.91E+05 1.50E+06 1.29E+06 1.49E+06 1.55E+06 8.41E+05 1.11E+06 9.38E+05 1.37E+06 9.58E+05 8.11E+05 1.10E+06 1.88E+06 1.28E+06 1.71E+06 7.60E+05 2.82E+06 1.80E+06 1.07E+06 2.14E+06 1.25E+06 6.38E+05 1.27E+06 1.59E+06 Dihydrokaempferol-3-O-glucoside* 3.05E+05 3.55E+05 2.80E+05 3.25E+05 2.90E+05 4.39E+05 3.04E+05 7.52E+05 3.91E+05 1.63E+06 1.06E+06 9.01E+05 2.34E+05 1.00E+05 2.24E+05 2.05E+05 3.97E+05 2.64E+05 7.25E+05 2.60E+05 5.54E+05 1.40E+05 4.07E+05 2.24E+05 Met-Ser 1.13E+04 3.28E+04 2.00E+04 7.16E+03 7.16E+03 1.49E+04 1.49E+04 5.37E+03 1.27E+05 8.95E+03 1.43E+04 1.55E+04 1.53E+05 1.65E+04 2.17E+04 6.67E+03 1.85E+04 1.31E+04 6.68E+04 6.17E+04 7.67E+04 1.27E+05 5.55E+04 3.83E+04 2,4-Dihydroxy-6-methoxyacetophenone 2.65E+06 2.90E+06 5.83E+06 1.96E+06 2.57E+06 2.43E+06 1.90E+06 5.29E+06 4.48E+06 3.60E+06 2.89E+06 3.23E+06 2.18E+06 2.68E+06 1.89E+06 1.75E+06 2.58E+06 2.42E+06 3.34E+06 3.36E+06 1.08E+06 3.68E+06 1.25E+06 4.24E+06 Bartsioside 1.38E+07 1.44E+07 1.36E+07 1.91E+07 1.84E+07 7.91E+06 6.24E+06 8.50E+06 1.07E+07 5.02E+06 4.51E+06 5.84E+06 1.09E+07 2.36E+07 1.63E+07 8.37E+06 1.70E+07 6.40E+06 4.74E+06 3.83E+06 4.93E+06 1.12E+07 8.21E+06 4.94E+06 Multifidol Glucoside 2.93E+06 3.38E+05 5.41E+05 4.26E+05 6.02E+05 1.86E+06 8.61E+05 5.44E+05 3.18E+05 3.38E+05 9.06E+05 6.73E+05 2.08E+07 7.73E+05 6.15E+05 1.11E+06 9.30E+05 8.72E+05 1.26E+06 1.23E+06 1.40E+06 6.87E+05 1.83E+06 8.07E+05 Plantarenaloside 7.43E+07 1.08E+08 7.87E+07 5.54E+07 9.95E+07 7.42E+07 4.04E+07 8.03E+07 7.78E+07 4.29E+07 6.28E+07 5.72E+07 4.30E+07 1.74E+07 7.02E+07 3.39E+07 8.21E+07 6.29E+07 3.03E+07 8.30E+06 2.24E+07 4.01E+07 6.05E+07 6.89E+06 Rhodiolgin 1.17E+05 9.52E+05 1.52E+05 8.57E+04 2.77E+05 5.11E+05 1.53E+05 4.99E+05 5.69E+05 1.13E+05 2.67E+05 1.73E+05 4.27E+05 5.54E+05 2.12E+05 1.46E+05 1.50E+06 1.02E+05 3.15E+05 2.59E+05 4.36E+05 2.00E+05 4.51E+05 1.83E+05 Stellarin 2.15E+06 2.89E+05 2.98E+06 5.19E+05 2.02E+06 8.22E+05 7.65E+05 4.65E+05 1.68E+06 2.45E+05 5.09E+05 6.62E+05 8.27E+05 3.51E+05 1.93E+06 1.44E+06 3.64E+05 1.82E+06 2.53E+06 1.72E+05 6.85E+05 1.58E+06 1.41E+06 1.02E+05 L-Lysine-Butanoic Acid 1.37E+04 8.63E+04 1.08E+05 1.96E+04 7.08E+04 3.92E+05 7.31E+05 1.08E+04 2.70E+04 3.69E+05 1.69E+06 1.20E+05 1.87E+06 1.62E+06 2.09E+04 5.24E+06 1.86E+05 1.83E+05 3.89E+06 5.18E+04 9.98E+05 2.09E+05 7.60E+04 6.57E+03 Caffeic aldehyde 2.16E+06 6.93E+06 4.05E+06 4.19E+06 7.25E+06 6.48E+06 4.15E+06 6.67E+06 3.99E+06 3.38E+06 1.15E+07 1.98E+07 4.64E+06 4.98E+06 3.24E+06 3.49E+06 4.65E+06 5.74E+06 6.27E+06 3.43E+06 5.87E+06 1.09E+07 6.96E+06 6.38E+06 Byzantionoside B 1.40E+05 8.36E+05 3.87E+05 1.10E+05 4.92E+05 5.68E+05 1.28E+06 2.88E+05 8.01E+05 4.37E+05 2.14E+06 6.77E+05 4.88E+05 3.27E+05 1.47E+05 7.69E+05 5.26E+05 1.42E+05 4.96E+05 9.13E+05 1.91E+05 2.52E+05 2.21E+05 7.44E+05 Met-Pro-Gln 6.87E+05 8.67E+05 8.02E+05 2.47E+06 1.04E+06 4.50E+06 1.10E+06 1.11E+06 2.49E+06 1.49E+06 4.61E+06 8.11E+05 1.24E+06 4.21E+05 2.80E+06 1.57E+06 1.11E+06 8.02E+05 7.94E+05 4.48E+05 1.51E+06 1.01E+06 1.22E+06 5.25E+05 Machilin H 6.87E+05 8.67E+05 8.02E+05 2.47E+06 1.04E+06 4.50E+06 1.10E+06 1.11E+06 2.49E+06 1.49E+06 4.61E+06 8.11E+05 1.24E+06 4.21E+05 2.80E+06 1.57E+06 1.11E+06 8.02E+05 7.94E+05 4.48E+05 1.51E+06 1.01E+06 1.22E+06 5.25E+05 (2R)-3-(3',4',5'-trimethoxyphenyl)-1,2-propanediol 7.50E+04 3.79E+04 4.17E+04 9.54E+04 4.72E+04 2.75E+05 1.00E+06 1.05E+05 1.24E+05 5.67E+04 4.81E+05 1.96E+05 7.06E+04 5.63E+04 6.92E+04 5.60E+04 6.77E+06 2.57E+05 9.34E+04 6.00E+04 0.00E+00 0.00E+00 0.00E+00 0.00E+00 Fraxidin-8-O-glucoside* 6.98E+05 1.84E+05 1.22E+06 6.44E+05 1.22E+06 5.26E+05 7.78E+05 3.36E+05 2.87E+05 6.21E+05 8.73E+05 6.68E+05 2.56E+05 1.40E+05 9.16E+05 5.92E+05 1.71E+05 7.71E+05 5.24E+05 2.14E+05 2.20E+05 1.01E+06 7.05E+05 2.99E+05 Rosmarinic acid 7.80E+05 6.58E+05 6.10E+05 9.93E+05 6.58E+05 6.62E+05 5.15E+05 6.88E+05 5.76E+05 5.41E+05 6.00E+05 5.45E+05 7.02E+05 2.49E+05 8.44E+05 4.04E+05 6.86E+05 8.86E+05 9.67E+05 9.03E+05 3.11E+05 5.16E+05 7.02E+05 4.10E+05 Luteolin-4'-O-glucoside 2.15E+05 2.22E+05 9.91E+04 1.34E+05 1.29E+05 1.45E+05 1.72E+05 2.59E+05 2.45E+05 3.52E+05 1.14E+05 2.56E+05 1.76E+05 7.36E+04 1.58E+05 8.50E+04 1.78E+05 2.12E+05 2.95E+05 5.38E+05 1.79E+05 2.02E+05 2.84E+05 3.94E+05 Gardenin C glucoside 4.44E+05 3.91E+05 2.54E+05 3.36E+05 2.07E+05 3.04E+05 3.33E+05 2.55E+05 2.21E+05 3.24E+05 2.09E+05 2.27E+05 2.65E+06 3.02E+05 3.32E+05 1.84E+05 3.45E+05 1.66E+05 5.53E+05 3.50E+05 8.50E+05 7.45E+05 8.41E+05 1.65E+05 LysoPE 18:1(2n isomer)* 1.39E+05 3.02E+05 2.73E+05 5.25E+05 6.22E+05 1.30E+05 3.78E+05 8.31E+05 6.84E+05 3.10E+05 2.02E+05 5.14E+05 6.28E+05 8.49E+04 4.01E+05 7.94E+04 2.70E+05 6.94E+04 1.02E+06 2.16E+05 3.01E+05 4.99E+05 5.47E+05 7.78E+05 Isofraxidin 3.39E+05 2.65E+05 2.84E+05 2.05E+05 2.18E+05 2.20E+05 5.74E+05 2.51E+05 1.65E+05 9.34E+04 1.48E+05 1.18E+05 1.97E+05 9.16E+04 3.49E+05 1.89E+05 2.50E+05 2.95E+05 1.53E+05 2.55E+05 2.03E+05 1.42E+05 3.60E+05 3.10E+05 5,7-Dihydroxychromone glucoside 1.46E+06 1.48E+06 1.39E+06 1.01E+06 9.31E+05 8.24E+05 1.20E+06 1.22E+06 1.39E+06 1.07E+06 7.30E+05 8.58E+05 9.69E+05 3.60E+05 6.79E+05 9.98E+05 9.24E+05 1.51E+06 4.00E+05 5.69E+05 7.01E+05 5.36E+05 9.57E+05 8.31E+05 Ligustroflavone(Nuezhenoside) 6.23E+04 7.67E+04 1.88E+05 4.00E+04 1.72E+05 6.02E+04 9.16E+04 1.23E+05 5.84E+04 8.67E+04 1.15E+05 8.43E+04 3.54E+04 1.63E+05 9.34E+04 7.61E+04 2.07E+05 1.00E+05 1.35E+05 7.93E+04 4.25E+04 2.17E+05 1.23E+05 4.62E+04 Cuneataside E* 5.41E+04 1.16E+06 2.85E+05 5.67E+04 6.97E+05 7.17E+05 4.67E+05 3.79E+05 7.84E+05 4.27E+05 1.20E+06 5.07E+05 4.67E+04 1.20E+05 1.23E+05 1.43E+05 3.11E+05 1.20E+05 5.73E+05 1.89E+05 3.61E+04 1.34E+05 9.84E+04 1.13E+05 γ-glutamylmethionine 4.62E+05 2.02E+05 2.15E+05 5.11E+05 1.05E+05 8.63E+04 1.34E+05 1.89E+05 1.33E+05 1.07E+05 3.72E+04 1.08E+05 3.06E+05 2.80E+05 5.13E+05 1.96E+05 3.51E+05 5.46E+05 6.25E+04 3.77E+05 1.37E+05 9.22E+04 1.79E+05 4.19E+05 13,28-Epoxyolean-11-en-3-one 5.16E+03 5.96E+03 1.53E+04 5.51E+03 1.39E+04 5.13E+04 6.15E+04 9.81E+04 2.39E+04 5.09E+04 7.62E+04 3.36E+04 1.52E+04 5.23E+03 2.06E+04 4.80E+03 7.07E+04 2.85E+03 1.53E+04 1.27E+04 4.44E+03 1.13E+04 2.28E+04 2.27E+03 2-Feruloyl-sn-glycerol 1.84E+05 5.87E+04 1.47E+05 6.54E+04 6.55E+04 1.09E+05 1.48E+05 1.43E+05 3.87E+04 3.20E+05 1.42E+05 1.25E+05 1.78E+05 1.22E+06 7.17E+04 4.84E+05 7.70E+04 5.67E+04 1.18E+06 9.67E+04 1.58E+05 3.37E+04 1.37E+05 8.67E+04 (1R,2R)-2-hydroxy-1-methyl-2,3-dihydro-1H-indene-5-carboxylic acid 5.31E+07 8.57E+07 1.53E+08 9.69E+07 1.29E+08 1.26E+08 7.03E+07 7.32E+07 9.03E+07 1.07E+08 1.39E+08 1.42E+08 1.38E+08 1.38E+08 9.54E+07 1.38E+08 5.08E+07 5.31E+07 1.34E+08 5.04E+07 1.19E+08 1.21E+08 1.53E+08 4.18E+07 Quinidine 3.34E+06 4.37E+06 5.60E+06 3.16E+06 3.69E+06 1.20E+06 2.54E+06 3.96E+06 3.48E+06 3.33E+06 2.12E+06 3.56E+06 2.03E+06 4.63E+06 3.59E+06 4.02E+06 1.58E+06 3.36E+06 3.91E+06 2.82E+06 1.46E+06 1.96E+06 3.05E+06 1.44E+06 Euoniside* 5.37E+05 3.58E+05 8.52E+05 4.77E+05 7.40E+05 8.65E+05 3.72E+05 1.52E+05 2.37E+05 3.67E+05 4.52E+05 9.53E+05 4.56E+05 2.17E+05 7.73E+05 6.29E+05 2.48E+05 4.69E+05 1.21E+06 3.49E+05 3.24E+05 9.41E+05 1.31E+06 1.88E+05 Eleutheroside B1* 5.37E+05 3.58E+05 8.52E+05 4.77E+05 7.40E+05 8.65E+05 3.72E+05 1.52E+05 2.37E+05 3.67E+05 4.52E+05 9.53E+05 4.56E+05 2.17E+05 7.73E+05 6.29E+05 2.48E+05 4.69E+05 1.21E+06 3.49E+05 3.24E+05 9.41E+05 1.31E+06 1.88E+05 Scopoletin (7-Hydroxy-6-methoxycoumarin)* 1.40E+06 1.46E+06 3.34E+06 1.22E+06 2.78E+06 2.24E+06 1.41E+06 2.28E+06 2.24E+06 9.22E+05 2.67E+06 3.23E+06 2.15E+06 5.24E+05 1.66E+06 5.22E+05 2.06E+06 1.54E+06 2.12E+06 1.84E+06 1.44E+06 1.71E+06 2.04E+06 3.42E+06 Oleoside* 3.45E+05 2.00E+05 3.06E+05 2.33E+05 1.50E+05 9.33E+04 1.27E+06 2.84E+05 2.71E+05 2.61E+05 3.05E+05 6.30E+05 7.57E+04 1.90E+05 1.27E+05 4.89E+05 3.86E+05 2.89E+05 2.77E+05 1.21E+06 1.18E+05 1.93E+06 1.07E+06 8.81E+05 Taxiresinol 1.82E+06 8.27E+05 5.08E+06 5.73E+05 6.28E+05 5.57E+05 4.50E+06 5.82E+05 8.11E+05 2.54E+06 3.28E+06 1.92E+06 2.92E+06 8.40E+05 6.31E+05 3.48E+05 6.76E+05 9.80E+05 3.30E+06 2.60E+06 6.18E+05 2.38E+06 3.21E+06 4.23E+06 Hispidulin-8-C-glucoside 1.36E+05 1.68E+05 1.78E+05 1.51E+05 1.60E+05 1.72E+05 1.62E+05 2.52E+05 1.21E+05 9.77E+04 2.39E+05 1.79E+05 1.99E+05 1.22E+05 1.30E+05 8.30E+04 1.40E+05 2.10E+05 1.38E+05 2.50E+05 1.96E+05 1.77E+05 1.98E+05 3.50E+05 2-Aminophenol 6.96E+04 4.47E+04 2.78E+04 3.82E+04 7.72E+04 4.94E+04 4.23E+04 6.89E+04 2.89E+04 2.05E+04 4.73E+04 5.59E+04 5.30E+04 2.19E+04 3.87E+04 3.38E+04 6.23E+04 4.85E+04 8.41E+04 5.64E+04 2.77E+04 2.53E+04 7.53E+04 5.70E+04 Isofraxetin 3.98E+05 4.81E+05 6.62E+05 2.90E+05 4.55E+05 1.02E+06 4.31E+05 5.04E+05 3.67E+05 4.30E+05 1.26E+06 5.53E+05 9.03E+05 7.27E+05 2.02E+05 7.63E+05 4.38E+05 4.62E+05 1.10E+06 8.13E+05 5.32E+05 6.26E+05 4.99E+05 9.98E+05 11-O-Syringoylbergenin 2.00E+06 3.21E+06 1.00E+06 4.10E+05 4.28E+06 2.55E+06 1.73E+06 1.50E+06 2.92E+06 1.52E+06 2.39E+06 1.58E+06 3.60E+06 4.82E+05 8.16E+05 1.92E+06 1.50E+06 2.00E+06 4.45E+05 1.05E+06 0.00E+00 0.00E+00 0.00E+00 0.00E+00 Leu-Asp 9.80E+04 1.33E+06 2.68E+05 1.50E+05 1.35E+05 1.94E+05 3.30E+05 4.62E+05 8.38E+05 1.76E+05 8.37E+05 3.41E+05 1.98E+06 7.31E+04 2.29E+05 3.03E+04 5.42E+05 2.39E+05 2.06E+06 1.05E+06 2.93E+05 5.64E+05 6.12E+06 4.26E+05 N1,N8-Bis(sinapoyl)spermidine 7.66E+04 6.80E+04 3.33E+04 3.67E+04 7.13E+04 3.32E+04 2.08E+04 7.50E+04 2.82E+04 8.34E+04 7.70E+04 9.34E+04 2.17E+04 2.33E+04 1.20E+05 3.00E+04 1.20E+05 7.17E+04 8.66E+03 8.34E+03 3.28E+04 1.37E+05 1.92E+04 1.35E+04 1,7-Dimethylxanthine 1.70E+05 1.07E+05 9.38E+04 1.02E+05 2.00E+05 1.58E+05 2.34E+05 1.50E+05 2.20E+05 7.26E+04 2.52E+05 2.56E+05 2.64E+05 1.16E+05 7.49E+04 3.73E+04 5.25E+04 1.79E+05 1.11E+05 1.37E+05 1.82E+05 1.60E+05 2.58E+05 1.31E+05 Foliasalacioside B1* 4.77E+04 1.20E+06 2.02E+05 1.60E+05 6.40E+05 1.71E+06 6.67E+05 3.29E+05 2.04E+05 6.65E+05 3.25E+06 7.55E+05 7.17E+04 5.38E+05 1.01E+05 2.45E+05 3.93E+05 8.50E+04 1.77E+05 3.32E+05 4.00E+04 3.79E+05 8.34E+04 1.60E+05 3-Oxo-α-ionol-β-D-glucoside* 1.08E+07 1.06E+07 6.95E+06 9.43E+06 1.29E+07 1.26E+07 9.95E+06 8.42E+06 1.04E+07 4.39E+06 8.41E+06 1.07E+07 1.27E+07 6.28E+06 1.37E+07 5.63E+06 1.97E+07 8.56E+06 6.47E+06 1.12E+07 8.73E+06 1.82E+07 1.17E+07 1.16E+07 2-Hydroxymethyl-A(1)-nor-19,24-dihydroxyurs-2,12-dien-28-oic acid (Rosamultic acid)* 5.52E+05 6.11E+04 3.30E+04 3.01E+04 2.20E+05 2.13E+05 1.40E+06 3.78E+05 1.36E+06 6.69E+05 1.63E+06 2.86E+06 1.54E+06 4.75E+05 7.96E+05 1.05E+06 1.98E+05 1.50E+06 2.84E+06 5.82E+05 4.21E+05 1.25E+04 6.11E+04 2.18E+04 Liriodendrin 6.05E+04 9.42E+04 1.42E+05 1.63E+05 1.10E+05 1.08E+05 5.67E+04 7.06E+04 7.54E+04 1.51E+04 6.61E+04 1.73E+05 3.42E+04 4.67E+04 1.71E+04 6.67E+03 8.90E+04 3.88E+04 3.49E+04 4.43E+04 6.52E+04 2.75E+05 2.07E+05 1.02E+05 Gallic acid 2.08E+05 2.17E+05 1.11E+05 1.91E+05 4.65E+04 5.10E+04 9.17E+04 1.92E+05 3.30E+05 8.09E+04 1.96E+05 9.33E+04 0.00E+00 0.00E+00 1.52E+05 1.20E+05 1.48E+05 1.18E+05 0.00E+00 0.00E+00 3.59E+04 6.30E+04 7.33E+04 6.55E+04 Maltopentaose 1.13E+05 6.86E+04 8.66E+03 8.78E+04 1.32E+05 2.53E+04 8.34E+03 8.09E+04 0.00E+00 0.00E+00 0.00E+00 0.00E+00 1.05E+04 8.34E+03 2.87E+04 1.54E+04 1.38E+05 2.43E+04 1.54E+04 1.39E+04 1.97E+04 1.57E+05 1.65E+05 8.47E+04 3-Oxooleana-11,13(18)-dien-28-oic acid 1.94E+06 1.94E+05 6.13E+05 1.39E+05 5.19E+05 3.00E+05 2.11E+06 4.72E+05 1.05E+06 1.42E+06 3.68E+06 1.81E+06 3.29E+06 2.97E+06 2.45E+06 3.92E+06 3.07E+06 2.12E+06 2.11E+06 1.08E+06 8.60E+05 1.00E+05 1.34E+05 6.25E+04 (2s)-2-[(5s)-5-hydroxyhexa-1,3-dien-1-yl]-5-methoxy-4-[(3r)-3-methoxybutanoyl]-2-methylfuran-3-one 8.63E+06 4.03E+06 1.51E+06 6.92E+06 4.56E+06 2.21E+06 1.24E+07 1.45E+07 1.77E+07 8.78E+06 3.02E+06 2.99E+06 3.52E+07 7.44E+06 9.57E+06 2.65E+06 1.79E+06 5.65E+06 2.03E+07 2.12E+07 2.01E+07 1.09E+07 2.14E+07 2.17E+07 Isoquinoline 1.26E+05 2.25E+05 1.44E+05 1.56E+05 2.14E+05 6.50E+04 1.52E+05 1.65E+05 2.19E+05 1.25E+05 3.61E+05 2.85E+05 1.40E+05 2.96E+04 2.03E+05 7.17E+04 2.32E+05 8.12E+04 2.18E+05 1.99E+05 1.00E+05 8.48E+04 1.45E+05 2.46E+05 Suberylglycine 4.63E+04 3.69E+04 8.21E+04 4.17E+04 6.50E+04 5.73E+04 9.89E+04 7.63E+04 6.00E+04 2.52E+04 5.17E+04 8.24E+04 2.78E+04 1.33E+05 9.01E+04 8.46E+04 1.11E+05 6.96E+04 9.54E+04 4.17E+04 1.51E+05 1.21E+05 5.64E+04 2.67E+04 N'-p-Coumaroylagmatine-glucoside 2.62E+05 2.43E+05 1.57E+05 2.44E+05 4.66E+05 3.15E+05 4.11E+05 3.12E+05 2.96E+05 2.08E+05 1.92E+05 2.11E+05 1.74E+05 1.34E+05 2.54E+05 1.94E+05 3.55E+05 2.49E+05 2.62E+05 2.49E+05 2.25E+05 2.46E+05 4.26E+05 4.22E+05 Phthalic anhydride 3.20E+06 5.46E+06 3.60E+06 4.25E+06 5.43E+06 3.59E+06 5.27E+06 6.03E+06 5.96E+06 4.38E+06 4.69E+06 4.44E+06 3.99E+06 5.57E+06 4.95E+06 1.24E+06 7.12E+06 5.69E+06 3.04E+06 4.24E+06 3.67E+06 7.90E+06 6.84E+06 5.10E+06 4-O-Sinapoylquinic acid 3.39E+04 7.00E+04 6.51E+04 5.06E+04 6.27E+04 8.00E+04 4.93E+04 1.18E+05 6.34E+04 1.51E+05 9.34E+04 9.23E+04 2.34E+05 3.03E+05 5.31E+04 1.23E+05 9.84E+04 8.00E+04 6.00E+05 3.84E+04 3.09E+05 1.73E+05 3.83E+04 4.00E+04 Tricin-5-O-Glucoside 5.47E+06 3.79E+06 3.75E+06 3.75E+06 3.38E+06 4.26E+06 4.31E+06 2.97E+06 3.63E+06 2.47E+06 2.21E+06 4.51E+06 2.40E+06 4.77E+05 4.70E+06 1.89E+06 4.68E+06 5.14E+06 1.03E+06 7.49E+05 4.03E+06 2.53E+06 3.14E+06 2.00E+06 Evofolin B glucoside 1.57E+06 2.88E+06 2.26E+06 5.79E+05 5.81E+06 1.40E+06 3.86E+06 7.21E+06 3.29E+06 3.07E+06 1.29E+07 3.04E+06 1.46E+06 2.48E+06 2.35E+06 1.16E+06 1.88E+06 8.40E+06 4.52E+06 1.11E+06 6.13E+06 1.88E+07 1.17E+07 5.83E+06 10-Acetoxyligustroside 2.03E+06 5.86E+05 3.66E+05 3.22E+05 9.81E+05 7.74E+05 4.18E+05 1.89E+06 1.16E+06 3.14E+05 7.31E+05 8.49E+05 7.02E+05 3.37E+05 5.22E+05 1.39E+05 4.84E+05 1.45E+06 4.14E+05 1.46E+06 8.73E+05 3.22E+05 2.09E+06 9.70E+05 γ-L-Glutamyl-L-[S-(4-hydroxyphenylbenzyl)]cysteine glycine 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 1.33E+04 1.78E+04 2.57E+04 2.86E+04 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 LysoPE 17:1 1.36E+05 6.58E+04 1.12E+05 6.68E+04 1.41E+05 7.29E+04 1.84E+04 6.30E+04 8.77E+04 1.75E+04 2.01E+05 9.95E+04 2.86E+04 9.98E+02 7.18E+04 2.32E+04 6.10E+04 6.27E+04 6.06E+04 3.76E+04 1.34E+04 1.39E+05 3.90E+04 4.10E+04 LysoPC 15:0* 9.37E+03 1.42E+04 1.81E+04 6.55E+03 1.18E+04 8.39E+03 2.27E+04 1.11E+04 2.37E+03 1.00E+04 2.63E+03 1.13E+04 7.08E+03 5.50E+03 5.24E+03 2.49E+04 1.25E+04 7.11E+03 1.26E+04 1.26E+04 1.31E+04 1.52E+04 1.48E+04 7.94E+03 LysoPC 15:0(2n isomer)* 9.37E+03 1.42E+04 1.81E+04 6.55E+03 1.18E+04 8.39E+03 2.27E+04 1.11E+04 2.37E+03 1.00E+04 2.63E+03 1.13E+04 7.08E+03 5.50E+03 5.24E+03 2.49E+04 1.25E+04 7.11E+03 1.26E+04 1.26E+04 1.31E+04 1.52E+04 1.48E+04 7.94E+03 Met-Asn 3.63E+04 2.87E+04 9.48E+04 1.89E+04 4.00E+04 3.73E+04 6.20E+04 3.73E+04 1.60E+04 1.09E+05 2.67E+04 5.75E+04 2.66E+04 9.85E+04 1.24E+04 2.84E+05 3.14E+04 2.94E+04 7.85E+04 8.84E+04 3.17E+04 1.67E+04 3.50E+04 1.33E+04 Isorhamnetin-3-O-glucuronide-7-O-rhamnoside 6.15E+05 8.74E+05 1.13E+05 3.84E+05 3.47E+05 4.16E+04 2.93E+05 6.58E+05 4.91E+05 5.98E+05 2.37E+05 8.29E+05 1.12E+05 1.03E+05 1.16E+05 1.00E+05 1.06E+05 1.14E+06 1.20E+05 7.23E+04 1.20E+05 1.25E+05 8.34E+04 8.05E+04 3,3'-Bis(3,4-dihydro-4-hydroxy-6,8-dimethoxy-2H-1-benzopyran) 8.25E+05 1.22E+06 1.07E+06 9.57E+05 3.07E+06 5.09E+06 7.29E+05 3.02E+06 2.03E+06 5.34E+05 5.36E+06 3.90E+06 2.51E+06 9.30E+05 2.34E+06 3.14E+05 2.85E+06 1.56E+06 1.72E+06 6.86E+05 2.39E+06 5.22E+06 9.63E+05 2.36E+05 2-Aminoadenosine 1.27E+06 1.95E+06 1.58E+06 1.10E+06 1.27E+06 9.63E+05 1.17E+06 1.57E+06 7.39E+05 5.45E+05 1.44E+06 9.21E+05 9.63E+05 7.47E+05 2.25E+06 4.54E+05 2.19E+06 8.85E+05 1.04E+06 8.23E+05 7.73E+05 1.33E+06 1.36E+06 6.62E+05 Ile-Trp 2.82E+04 2.74E+05 5.10E+04 5.17E+04 6.84E+04 9.34E+04 4.77E+04 1.18E+05 1.33E+05 2.35E+04 5.07E+04 4.51E+04 1.81E+05 1.88E+04 3.36E+04 2.08E+04 5.37E+04 5.64E+04 2.01E+05 1.62E+05 5.64E+04 7.18E+04 2.20E+05 5.10E+04 N1-Dihydrocaffeoyl-N10-coumaroylspermidine 1.08E+05 5.00E+04 1.05E+05 5.34E+04 5.41E+04 4.74E+04 5.00E+04 1.08E+05 6.34E+04 4.74E+04 6.85E+04 1.04E+05 2.27E+04 4.33E+04 3.14E+04 6.40E+04 5.34E+04 8.58E+04 4.00E+04 4.03E+04 1.83E+04 1.55E+04 3.33E+04 1.88E+04 N(6),N(6)-Dimethyl-L-lysine 7.89E+05 6.39E+05 5.36E+05 6.79E+05 7.16E+05 2.22E+05 2.93E+05 6.64E+05 6.11E+05 2.14E+05 2.63E+05 6.55E+05 2.68E+06 2.25E+04 9.46E+05 2.61E+04 1.29E+05 1.94E+05 1.17E+06 1.44E+07 1.48E+06 6.70E+07 3.04E+06 3.01E+06 N1-Caffeoyl-N10-dihydrocaffeoylspermidine 4.57E+04 8.04E+04 5.38E+04 5.47E+04 1.15E+05 1.23E+05 5.40E+04 6.19E+04 7.12E+04 7.31E+04 9.34E+04 5.85E+04 4.38E+04 5.26E+04 4.96E+04 8.20E+04 5.30E+04 9.79E+04 4.25E+04 7.69E+04 7.41E+04 4.70E+04 8.68E+04 7.85E+04 2,6-Dimethoxypydroquinone-1-O-glucoside 2.76E+06 1.39E+06 1.97E+06 1.35E+06 2.24E+06 1.33E+06 4.53E+05 1.17E+06 1.63E+06 6.00E+05 1.32E+06 9.56E+05 7.08E+05 3.59E+05 1.13E+06 2.46E+06 1.70E+06 1.73E+06 1.79E+06 1.03E+06 6.56E+05 1.52E+06 1.64E+06 5.37E+05 secologanoside* 3.29E+05 1.34E+05 2.71E+05 1.86E+05 8.13E+04 2.57E+05 3.05E+05 2.07E+05 1.51E+05 3.05E+05 3.70E+05 1.71E+05 2.62E+05 2.36E+05 5.09E+05 6.15E+05 3.17E+05 2.03E+05 3.16E+05 4.73E+05 1.57E+05 2.14E+06 1.64E+06 1.05E+06 3,4-Dihydroxy-L-phenylalanine (L-Dopa) 1.30E+06 1.74E+05 2.67E+05 8.79E+05 1.50E+05 3.38E+05 6.11E+05 1.37E+05 3.83E+05 3.89E+05 3.69E+05 2.81E+05 7.47E+05 3.82E+05 3.47E+05 1.35E+06 7.69E+05 7.53E+05 1.77E+05 3.82E+05 6.91E+05 3.68E+05 3.55E+05 4.89E+05 Ser-Abu-OH 4.91E+05 3.45E+05 6.74E+05 1.73E+05 2.87E+05 4.63E+05 7.34E+04 4.61E+05 3.63E+05 2.46E+05 5.52E+05 3.02E+05 4.48E+05 2.83E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 5.51E+05 5.02E+05 3.41E+05 6.15E+05 3.66E+05 5.47E+05 2-(4-Methoxyphenethyl)-5,6:7,8-Diepoxy-5,6,7,8-Tetrahydrochromone 4.91E+05 3.45E+05 6.74E+05 1.73E+05 2.87E+05 4.63E+05 7.34E+04 4.61E+05 3.63E+05 2.46E+05 5.52E+05 3.02E+05 4.48E+05 2.83E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 5.51E+05 5.02E+05 3.41E+05 6.15E+05 3.66E+05 5.47E+05 (3R,4R)-p-Menth-1-ene-3,4-diol-3-O-β-D-glucoside* 1.84E+06 1.42E+06 1.03E+06 1.35E+06 9.52E+05 4.08E+05 3.07E+05 4.86E+05 1.33E+06 2.82E+05 5.16E+05 2.95E+05 1.08E+06 6.00E+05 9.59E+05 3.76E+05 7.93E+05 1.55E+06 5.70E+05 4.16E+05 5.14E+05 7.04E+05 1.52E+06 3.02E+05 Luteolin-3'-O-glucoside 1.13E+05 4.57E+04 2.32E+05 1.01E+05 1.27E+05 7.67E+04 1.23E+05 4.83E+04 2.44E+04 1.46E+05 8.50E+04 4.19E+04 8.07E+04 2.14E+05 1.16E+05 2.23E+05 1.16E+05 6.69E+04 3.14E+05 2.67E+05 5.84E+04 1.34E+05 3.18E+05 4.05E+05 2,3-Dihydroxylup-20(29)-en-28-oic acid 6.97E+05 5.36E+04 5.97E+04 1.66E+04 9.49E+05 2.35E+05 4.30E+05 9.13E+04 1.52E+06 6.43E+05 2.03E+06 6.72E+05 1.40E+06 4.16E+05 8.08E+05 6.83E+05 4.12E+05 1.51E+06 7.83E+05 1.19E+06 2.38E+05 1.02E+04 4.49E+04 5.61E+03 Cordycepin (3'-Deoxyadenosine)* 3.79E+04 4.90E+04 2.60E+04 1.05E+05 3.34E+04 8.50E+04 1.45E+05 3.99E+04 6.30E+04 1.38E+05 5.51E+04 1.39E+05 2.21E+05 8.57E+04 2.80E+05 8.40E+04 1.08E+05 1.29E+05 7.14E+04 1.60E+05 1.47E+05 6.79E+04 1.46E+05 1.33E+05 1-((Pentanoyl)phloroglucinyl]-β-D-glucopyranoside 1.62E+06 9.50E+05 1.04E+06 1.46E+06 1.09E+06 1.14E+06 1.29E+06 1.04E+06 1.32E+06 9.61E+05 1.25E+06 1.10E+06 1.22E+06 5.35E+05 1.12E+06 4.39E+05 1.15E+06 1.31E+06 9.53E+05 1.32E+06 8.39E+05 9.07E+05 1.02E+06 1.39E+06 Isocrenatoside 3.01E+05 3.71E+05 7.59E+05 7.39E+05 6.09E+05 2.55E+05 4.42E+05 3.49E+05 5.38E+05 5.18E+05 2.33E+05 5.41E+05 4.55E+05 4.21E+05 3.93E+05 6.65E+05 4.88E+05 6.16E+05 3.85E+05 5.63E+05 4.07E+05 4.51E+05 6.55E+05 4.08E+05 Isorhamnetin-3-O-rutinoside-4'-O-glucoside* 2.50E+04 2.47E+04 2.75E+03 1.44E+04 4.50E+04 5.52E+03 2.07E+04 1.11E+04 3.17E+04 8.99E+03 1.72E+04 3.58E+04 1.50E+04 1.33E+04 7.67E+04 1.36E+04 2.67E+04 9.17E+04 3.50E+04 9.62E+03 1.33E+04 6.79E+03 1.33E+04 1.03E+04 Pro-Pro-Asn 6.28E+07 1.05E+08 4.99E+07 9.42E+07 3.44E+07 1.48E+07 2.20E+07 4.37E+07 3.22E+07 2.12E+07 1.77E+07 1.94E+07 9.22E+07 1.62E+07 1.65E+08 2.65E+06 6.51E+07 6.10E+07 8.99E+07 1.04E+08 3.31E+07 5.99E+07 3.34E+07 1.63E+08 N,N-Dimethyl-5-methoxytryptamine 1.57E+07 1.28E+07 1.07E+07 5.78E+06 7.29E+06 3.68E+06 5.08E+06 9.30E+06 1.05E+07 7.45E+06 2.93E+06 4.59E+06 3.63E+06 1.90E+06 8.53E+06 2.00E+07 1.25E+07 1.29E+07 1.69E+06 6.60E+06 4.19E+06 2.75E+06 4.45E+06 9.20E+06 L-Norleucine* 5.54E+06 2.13E+07 3.09E+07 2.54E+07 2.91E+07 1.68E+07 1.13E+08 7.94E+06 5.47E+07 9.77E+06 5.36E+07 5.10E+07 1.10E+08 1.78E+07 3.33E+07 1.66E+06 9.12E+06 2.24E+07 2.65E+07 4.85E+07 1.55E+08 1.06E+07 9.23E+07 9.76E+07 Galloylisorhamnetin 1.22E+06 6.69E+05 2.26E+05 4.33E+06 1.76E+06 5.64E+05 2.47E+06 1.20E+07 9.39E+06 8.64E+05 1.06E+06 1.06E+06 8.52E+04 7.79E+05 2.39E+06 6.14E+05 1.09E+06 5.08E+05 9.45E+05 5.00E+04 2.49E+05 1.51E+06 5.68E+05 1.70E+05 3-O-Cinnamoyl-4,6-(S)-HHDP-β-D-glucose 2.55E+05 2.96E+05 2.18E+05 2.83E+05 1.88E+05 4.49E+05 2.89E+05 2.78E+05 4.57E+05 2.74E+05 3.61E+05 3.64E+05 7.05E+04 3.14E+05 3.22E+05 4.84E+05 4.27E+05 4.85E+05 3.66E+05 8.88E+04 7.91E+04 3.37E+05 2.07E+05 1.37E+05 2-(4-((6,7-dihydroxy-5-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl)phenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol 6.40E+05 7.25E+05 2.74E+05 3.52E+05 4.50E+05 2.05E+05 4.67E+05 2.00E+05 4.27E+05 7.52E+05 2.67E+05 2.37E+05 1.13E+06 3.76E+05 1.01E+06 4.51E+05 7.34E+05 2.76E+05 5.09E+05 3.56E+05 6.00E+05 2.09E+05 8.04E+05 8.91E+05 Elaeocarpucin B 4.66E+05 2.95E+04 1.60E+05 2.06E+04 1.69E+05 2.52E+05 1.10E+06 3.11E+05 9.28E+05 1.34E+06 5.81E+06 1.56E+06 1.39E+06 1.39E+06 7.66E+05 1.07E+06 6.13E+05 2.09E+06 1.04E+06 2.51E+05 4.35E+05 3.10E+04 1.33E+05 1.16E+04 Chrysoeriol-6,8-di-C-glucoside-4'-O-glucoside 2.70E+05 2.19E+05 7.92E+05 5.56E+05 3.96E+05 1.46E+05 2.19E+05 1.31E+05 1.45E+05 2.97E+05 2.08E+05 2.57E+05 2.29E+05 5.38E+05 7.08E+05 7.84E+05 2.64E+05 1.97E+05 4.76E+05 1.21E+06 4.05E+05 5.80E+05 9.28E+05 1.01E+06 2,6-Dimethoxy-1,4-benzoquinone* 3.98E+05 4.48E+05 6.20E+05 9.11E+05 3.48E+05 3.63E+05 2.94E+05 1.09E+05 5.07E+05 4.25E+05 1.91E+05 6.43E+05 1.76E+05 7.04E+05 5.60E+05 5.45E+05 6.09E+05 4.38E+05 3.45E+05 4.75E+05 3.04E+05 4.44E+05 4.31E+05 4.50E+05 N-Caffeoylphenylalanine 7.53E+05 6.56E+05 9.68E+05 4.71E+05 9.54E+05 5.64E+05 1.16E+06 2.53E+05 8.62E+05 5.58E+05 1.01E+06 1.00E+06 4.59E+05 5.05E+05 6.04E+05 8.53E+05 7.09E+05 7.10E+05 1.22E+06 2.06E+05 3.74E+05 8.92E+05 2.18E+06 6.09E+05 3-(3'-Hydroxybutyl)-2,4,4-trimethylcyclohexa-2,5-dienone glucoside* 1.13E+06 6.68E+05 1.40E+06 4.32E+05 1.41E+06 1.25E+06 2.10E+06 6.24E+05 1.13E+06 9.87E+05 4.71E+06 1.56E+06 9.76E+05 2.60E+05 4.27E+05 5.98E+05 1.31E+06 3.60E+06 2.17E+05 2.76E+05 1.75E+06 4.26E+05 5.46E+05 4.91E+05 Isorhamnetin-3-O-rutinoside (Narcissin) 4.82E+04 5.67E+04 9.32E+04 5.64E+04 2.12E+04 1.52E+04 1.12E+05 7.84E+04 6.84E+04 6.34E+04 4.33E+04 4.71E+04 5.90E+04 4.52E+04 2.64E+04 5.67E+04 5.41E+04 5.34E+04 3.67E+04 3.19E+04 1.27E+04 2.50E+04 1.02E+05 3.07E+04 Frambinone 2.65E+06 4.14E+06 4.52E+06 3.93E+06 3.21E+06 4.27E+06 3.63E+06 4.49E+06 5.18E+06 2.63E+06 3.08E+06 9.68E+06 1.90E+06 1.39E+06 4.95E+06 4.41E+06 2.46E+06 5.62E+06 1.66E+06 1.08E+06 6.27E+05 6.50E+05 5.64E+05 2.48E+06 1-(3,4-dihydroxy-S-methoxypheny)-7-(4-hydroxyphenyl)hept-1-ene-3,5-diol 8.93E+05 5.48E+05 5.30E+05 4.91E+05 5.26E+05 4.59E+05 4.11E+05 4.36E+05 5.97E+05 4.75E+05 1.40E+05 2.40E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 0.00E+00 1.64E+05 2.72E+05 5.84E+05 2.87E+05 Isobavachalcone glucoside 3.70E+05 5.44E+05 2.09E+06 2.40E+05 6.65E+05 2.60E+05 6.82E+05 1.38E+06 1.47E+06 1.44E+06 2.84E+05 3.34E+06 1.90E+06 1.54E+05 2.58E+05 2.89E+05 3.62E+05 3.42E+05 9.57E+06 9.65E+05 3.87E+05 7.62E+05 2.67E+05 1.57E+06 Eriodictyol-7-O-glucoside* 1.28E+05 1.33E+05 3.40E+05 4.50E+04 1.12E+05 1.43E+05 5.18E+05 3.60E+05 1.44E+05 1.26E+06 2.71E+05 2.82E+05 2.67E+05 1.54E+05 1.12E+05 1.69E+05 1.78E+05 1.12E+05 6.57E+05 2.69E+05 2.02E+05 1.40E+05 2.14E+05 1.07E+05 Afzelechin (3,5,7,4'-Tetrahydroxyflavan) 3.58E+04 1.24E+04 2.62E+04 1.02E+04 1.79E+04 5.17E+04 1.86E+04 3.14E+04 2.28E+04 1.93E+04 3.50E+04 5.84E+04 8.34E+03 2.67E+04 1.17E+04 2.50E+04 4.33E+04 2.83E+04 1.90E+04 2.56E+04 2.17E+04 1.33E+04 1.87E+04 1.44E+04 catechin-3-O-α-L-rhamnopyranoside 1.85E+04 1.50E+04 3.67E+04 7.64E+03 3.00E+04 3.50E+04 3.00E+04 1.67E+04 2.50E+04 5.17E+04 3.35E+04 2.83E+04 3.55E+04 3.46E+04 2.26E+04 4.83E+04 3.86E+04 3.45E+04 1.67E+04 2.61E+04 2.87E+04 2.31E+04 2.13E+04 3.82E+03 Gallocatechin gallate 2.17E+03 1.23E+04 8.34E+03 1.44E+04 1.00E+04 7.59E+03 1.44E+04 5.05E+03 8.34E+03 1.28E+04 1.20E+04 2.67E+04 1.52E+04 1.92E+04 9.96E+03 3.55E+04 5.06E+03 1.17E+04 9.96E+03 1.67E+04 3.50E+04 2.33E+04 1.33E+04 3.50E+04 Isochlorogenic acid C 1.05E+06 5.73E+05 4.81E+05 5.29E+05 3.17E+05 3.39E+05 4.16E+05 6.98E+05 6.51E+05 3.65E+05 3.02E+05 2.22E+05 3.35E+05 3.77E+05 8.04E+05 3.49E+05 4.59E+05 6.25E+05 4.94E+05 8.66E+05 1.87E+05 4.24E+05 7.55E+05 1.08E+06 His-Tyr 7.54E+04 8.38E+04 5.75E+04 7.62E+04 8.04E+04 3.66E+04 7.82E+04 5.36E+04 3.64E+04 4.67E+04 5.27E+04 8.69E+04 5.90E+04 1.96E+04 1.10E+05 6.21E+04 5.79E+04 6.82E+04 8.57E+04 9.49E+04 6.11E+04 1.05E+05 2.04E+05 7.17E+04 (7R,8S)-9-acetyl-dehydrodiconiferyl alcohol 5.47E+07 3.76E+07 5.40E+07 2.67E+07 3.23E+07 4.39E+07 1.02E+07 6.12E+07 5.92E+07 2.05E+07 1.70E+07 2.13E+07 5.49E+07 6.54E+06 4.51E+07 4.95E+06 2.85E+07 2.49E+07 3.74E+07 1.94E+07 2.46E+07 2.57E+07 2.65E+07 2.63E+07 Desrhamnosylisoacteoside* 2.03E+06 5.15E+06 2.57E+06 1.40E+06 2.02E+06 2.51E+05 1.99E+06 1.89E+06 2.95E+06 1.21E+06 3.29E+05 1.44E+06 7.05E+05 8.46E+05 8.09E+05 9.37E+05 3.53E+06 7.89E+05 6.05E+06 1.71E+06 4.60E+06 1.45E+06 1.93E+06 1.44E+06 3',5,5',7-Tetrahydroxyflavanone-7-O-glucoside* 5.04E+05 5.90E+05 2.12E+05 1.88E+05 1.67E+05 3.07E+05 8.42E+05 3.01E+05 1.59E+05 4.64E+05 2.75E+05 2.56E+05 2.60E+05 1.09E+05 1.08E+05 4.65E+05 1.23E+05 4.08E+05 1.25E+05 3.38E+05 3.92E+05 8.34E+04 1.27E+05 4.28E+05 Okanin-4'-O-glucoside(Marein)* 5.04E+05 5.90E+05 2.12E+05 1.88E+05 1.67E+05 3.07E+05 8.42E+05 3.01E+05 1.59E+05 4.64E+05 2.75E+05 2.56E+05 2.60E+05 1.09E+05 1.08E+05 4.65E+05 1.23E+05 4.08E+05 1.25E+05 3.38E+05 3.92E+05 8.34E+04 1.27E+05 4.28E+05 Leucosceptoside A 4.67E+04 8.32E+04 1.00E+05 3.98E+04 4.12E+04 2.80E+04 1.27E+05 7.34E+04 1.87E+05 3.14E+05 3.00E+04 4.91E+05 1.27E+05 8.88E+04 9.74E+04 5.25E+04 7.50E+04 9.62E+04 1.07E+05 6.70E+04 8.50E+04 1.33E+05 6.84E+04 3.18E+04 Pyridoxine-5'-O-(6''-feruloyl)glucoside 7.50E+04 2.98E+04 6.50E+04 7.17E+04 1.29E+04 3.60E+04 5.50E+04 3.50E+04 4.08E+04 5.37E+04 2.85E+04 4.40E+04 7.12E+04 3.86E+04 1.53E+05 5.38E+04 1.13E+05 3.99E+04 2.00E+04 4.85E+04 1.24E+05 4.42E+04 2.00E+04 4.83E+04 3-(4-hydroxy-2,6-dimethoxyphenyl)-1-(4-methoxyphenyl)propan-1-one 3.44E+05 2.46E+05 1.40E+05 4.66E+05 3.11E+05 1.98E+05 2.02E+05 2.82E+05 2.77E+05 2.24E+05 2.24E+05 2.45E+05 1.91E+05 4.06E+05 2.92E+05 3.55E+05 2.14E+05 3.99E+05 2.35E+05 1.19E+05 2.24E+05 1.49E+05 8.50E+04 2.23E+05 11-methoxy viburtinal 9.05E+05 2.83E+06 1.95E+06 3.93E+06 2.06E+06 7.47E+06 2.76E+06 3.13E+06 2.08E+06 2.84E+06 4.68E+06 2.00E+06 7.29E+06 2.80E+06 3.93E+06 1.40E+06 1.16E+06 1.46E+06 3.73E+06 4.89E+06 1.64E+06 2.35E+06 2.59E+06 2.97E+06 Excelsioside 1.77E+06 9.70E+05 2.39E+06 2.03E+06 1.48E+06 1.42E+06 6.43E+05 2.66E+06 2.54E+06 8.60E+05 2.05E+06 1.63E+06 2.51E+06 2.28E+06 2.23E+06 6.55E+04 1.77E+06 1.50E+06 4.33E+06 3.54E+06 1.43E+06 2.09E+06 3.54E+06 4.76E+06 Integracide H 6.32E+06 4.01E+06 3.87E+06 4.67E+06 7.72E+06 6.29E+06 1.96E+06 5.12E+06 7.07E+06 5.81E+06 5.59E+06 4.73E+06 2.54E+06 4.93E+06 6.60E+06 4.87E+06 2.86E+06 5.73E+06 4.95E+06 6.97E+06 6.29E+06 2.02E+06 4.19E+06 5.53E+06 Quercetin-3-O-neohesperidoside* 3.52E+04 1.58E+04 2.59E+05 2.57E+05 2.55E+04 3.09E+04 3.99E+04 8.94E+03 3.82E+04 1.25E+05 4.27E+04 4.24E+04 7.22E+04 1.60E+05 7.13E+05 2.27E+05 4.03E+04 3.26E+04 9.35E+04 2.44E+05 1.19E+05 2.52E+05 1.04E+05 2.00E+05 Cirsimaritin-8-C-glucoside 1.42E+05 1.37E+05 9.90E+04 1.03E+05 1.51E+05 8.88E+04 7.87E+04 8.30E+04 1.09E+05 1.05E+05 1.64E+05 1.23E+05 6.79E+04 1.05E+05 9.10E+04 1.24E+05 9.29E+04 1.55E+05 8.30E+04 9.82E+04 1.78E+05 9.24E+04 6.64E+04 1.15E+05 Carambolaside A 4.50E+04 4.50E+04 8.62E+04 4.00E+04 7.03E+04 6.17E+04 9.47E+04 7.45E+04 3.50E+04 7.48E+04 1.23E+05 6.46E+04 5.12E+04 4.15E+05 8.27E+04 6.00E+04 5.26E+04 1.08E+05 1.14E+05 2.16E+05 5.20E+04 7.29E+04 7.09E+04 5.47E+05 Tanegoside 9.48E+04 6.00E+04 1.43E+05 1.24E+05 1.70E+05 3.67E+04 9.50E+04 9.00E+04 1.53E+05 5.09E+04 6.37E+04 1.03E+05 7.70E+04 5.73E+04 1.20E+05 4.16E+04 4.96E+04 8.21E+04 6.87E+04 9.00E+04 1.60E+05 4.05E+04 6.67E+04 1.01E+05 N-Feruloyltyramine 4'-glucoside 2.69E+05 1.35E+05 1.83E+05 7.70E+05 7.96E+05 6.75E+05 2.13E+05 1.87E+05 6.95E+05 3.71E+05 3.25E+05 1.02E+05 5.07E+04 4.32E+05 3.76E+05 7.27E+05 1.63E+05 1.00E+05 1.15E+06 5.81E+05 1.03E+06 5.26E+04 1.02E+05 3.34E+05 Pinolenic acid 8.14E+06 1.01E+07 3.19E+06 7.74E+06 1.30E+07 9.84E+06 7.92E+06 1.42E+07 4.84E+06 8.27E+06 9.87E+06 8.56E+06 3.01E+06 9.58E+06 5.93E+06 1.73E+07 7.17E+06 8.34E+06 9.57E+06 8.24E+06 4.75E+06 1.32E+07 9.89E+06 1.20E+07 Desrhamnosylacteoside 2.02E+06 3.89E+06 2.25E+06 9.90E+05 5.79E+06 7.50E+05 5.39E+06 8.04E+06 4.85E+06 1.65E+07 8.44E+05 9.38E+06 1.03E+06 2.55E+06 3.66E+06 1.94E+06 7.15E+06 9.30E+06 2.99E+06 2.09E+06 2.40E+05 6.75E+05 1.20E+06 7.89E+05 1-Monomyristin 8.31E+04 3.35E+04 8.95E+04 1.14E+05 1.24E+05 9.91E+04 1.32E+05 5.78E+04 9.12E+04 1.45E+05 1.30E+05 5.61E+04 2.46E+05 4.12E+04 6.56E+04 1.03E+05 8.94E+04 2.65E+04 6.67E+04 5.30E+04 2.33E+04 1.93E+05 1.45E+05 7.51E+04 Acteoside; Verbascoside* 3.28E+06 8.25E+05 1.67E+06 4.44E+05 7.10E+05 8.34E+04 4.34E+06 1.32E+06 7.62E+05 2.46E+06 5.98E+05 3.79E+06 1.00E+06 6.75E+05 3.85E+06 6.92E+05 4.80E+06 4.41E+06 1.64E+06 1.22E+06 3.27E+05 7.27E+05 1.77E+06 2.97E+05 3-Prenyl-4,2',4'-Trihydroxychalcone 9.72E+06 1.58E+07 1.00E+07 3.00E+07 2.83E+07 1.79E+07 3.17E+07 1.02E+07 8.45E+06 1.93E+07 2.26E+07 2.70E+07 3.80E+07 1.15E+07 2.66E+07 1.44E+07 5.12E+07 1.28E+07 2.14E+07 3.86E+07 3.18E+07 2.75E+07 5.54E+07 5.94E+07 L-Cysteinyl-L-glycine 4.83E+04 1.84E+04 1.25E+04 1.67E+04 1.97E+04 9.55E+03 9.79E+03 2.33E+04 3.67E+04 1.43E+04 3.30E+04 1.31E+04 1.67E+04 2.50E+04 1.50E+04 1.00E+04 7.34E+04 2.83E+04 1.91E+04 2.15E+04 2.67E+04 1.28E+04 2.50E+04 1.30E+04 3-Hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)propan-1-one 7.84E+04 2.91E+05 1.76E+05 1.40E+05 1.48E+05 2.16E+05 4.14E+05 4.05E+05 1.25E+05 2.94E+05 2.69E+05 4.86E+05 2.97E+05 3.49E+05 1.38E+05 3.57E+05 4.24E+05 2.15E+05 4.67E+05 2.94E+05 1.76E+05 9.03E+04 3.57E+05 1.92E+05 Avicularin(Quercetin-3-O-α-L-arabinofuranoside) 7.31E+04 1.21E+05 2.75E+05 9.17E+04 1.89E+05 1.88E+05 6.00E+04 1.34E+05 1.09E+05 4.31E+04 2.57E+05 2.47E+05 8.04E+04 3.00E+04 2.83E+04 4.00E+04 3.66E+04 1.02E+05 7.81E+04 5.17E+04 1.12E+05 4.82E+04 8.11E+04 2.39E+04 (5R,6S,7R)-5-(3,4,5-Trimethoxyphenyl)-7-methyl-8-oxo-5,6,7,8-tetrahydronaphtho[2,3-d]-1,3-dioxole-6-carboxylic acidethylester 5.24E+05 1.58E+06 1.01E+06 4.89E+05 1.15E+06 8.91E+05 5.36E+05 7.70E+05 6.42E+05 4.59E+05 5.00E+05 1.07E+06 7.35E+05 1.86E+05 9.40E+05 2.75E+05 9.44E+05 5.37E+05 6.00E+05 4.27E+05 1.11E+06 1.55E+06 6.10E+05 5.57E+05 9-O-β-D-Glucoside of 3-hydroxy-7,8-didehydro-β-ionol 1.27E+06 7.81E+05 1.24E+06 1.25E+06 2.30E+06 7.57E+05 3.00E+05 6.20E+05 6.90E+05 3.41E+05 1.27E+06 2.04E+06 3.81E+05 2.19E+05 1.88E+06 9.53E+05 7.76E+05 1.98E+06 9.26E+05 7.88E+05 3.23E+05 5.27E+05 4.74E+05 5.14E+05 Guettardionoside* 2.08E+05 1.82E+06 2.14E+05 7.47E+04 1.29E+06 1.01E+06 8.53E+05 3.79E+05 5.13E+05 1.91E+06 1.77E+06 4.92E+05 1.05E+05 1.70E+05 1.03E+05 1.05E+05 8.39E+05 8.67E+04 3.87E+05 1.50E+05 3.71E+04 2.45E+05 1.57E+05 2.20E+05 Mucic acid-dimethyl-2-O-gallate 2.21E+05 1.58E+05 2.21E+05 2.72E+05 8.23E+04 2.19E+05 1.83E+05 3.34E+05 1.59E+05 1.06E+05 1.38E+05 1.01E+05 1.34E+05 1.41E+05 2.43E+05 3.92E+05 1.01E+05 2.32E+05 8.74E+04 5.39E+05 1.68E+05 7.34E+04 1.14E+05 1.07E+06 1,7-Bis-(3,4-dihydroxyphenyl)-5-methoxy-3-heptanone 1.46E+06 2.32E+06 1.76E+06 2.83E+06 2.26E+06 1.58E+06 1.94E+06 1.10E+06 1.67E+06 7.83E+05 2.70E+06 2.85E+06 7.99E+05 3.38E+05 1.39E+06 8.09E+05 3.18E+06 1.22E+06 6.91E+05 7.02E+05 1.06E+06 1.22E+06 1.45E+06 3.16E+05 Okanin-3',4'-di-O-glucoside 1.73E+05 6.43E+05 8.42E+05 4.12E+05 1.10E+06 2.90E+05 6.17E+04 1.27E+05 4.84E+05 1.98E+05 3.67E+05 3.28E+05 1.41E+05 6.51E+04 1.54E+05 4.83E+04 7.66E+04 4.84E+05 1.72E+05 2.47E+05 9.84E+04 1.07E+05 6.94E+04 1.77E+05 Dimethyllimettin 9.40E+05 1.05E+06 2.66E+06 1.15E+06 9.47E+05 6.56E+05 5.85E+05 9.42E+05 1.09E+06 1.03E+06 8.61E+05 1.17E+06 1.79E+06 1.08E+06 1.50E+06 3.83E+05 2.72E+06 1.30E+06 9.26E+05 1.08E+06 2.01E+06 1.11E+06 1.76E+06 2.14E+06 N-(3-Indolylacetyl)-L-alanine 7.22E+04 6.45E+04 6.34E+04 6.34E+04 1.63E+05 1.08E+05 7.39E+04 1.13E+05 1.18E+05 8.00E+04 1.67E+05 7.50E+04 6.84E+04 4.67E+04 7.34E+04 1.83E+04 7.15E+04 1.13E+05 1.10E+05 9.84E+04 6.67E+04 8.68E+04 5.77E+04 5.27E+04 Met-Ala-Glu 8.30E+05 7.13E+05 4.15E+05 5.05E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 3.33E+05 7.88E+05 3.63E+05 4.83E+05 5.20E+05 1.48E+05 0.00E+00 0.00E+00 0.00E+00 0.00E+00 5.01E+05 7.70E+05 3.19E+05 1.08E+06 1.07E+06 6.72E+05 5'-Deoxyadenosine* 1.14E+05 4.99E+04 1.62E+05 5.75E+04 1.70E+05 8.51E+04 1.72E+05 8.67E+04 1.13E+05 9.92E+04 1.23E+05 6.15E+05 3.61E+05 1.42E+05 2.96E+05 1.20E+05 1.88E+05 2.22E+05 3.51E+05 2.67E+05 3.14E+05 2.95E+05 4.77E+05 1.32E+05 3-Hydroxyolean-12-ene-28,29-dioic acid (Serratagenic Acid)* 4.87E+05 5.39E+04 5.22E+04 4.22E+04 2.09E+05 2.25E+05 1.34E+06 4.81E+05 1.68E+05 1.04E+05 1.76E+06 1.54E+06 1.97E+06 9.53E+05 7.02E+05 5.42E+05 8.32E+05 2.46E+06 6.62E+05 4.87E+05 2.94E+05 1.90E+04 6.31E+04 1.56E+04 Gallacetophenone 4.31E+05 3.52E+05 1.84E+05 2.99E+05 3.10E+05 2.66E+05 2.97E+05 3.00E+05 1.55E+05 1.45E+05 2.65E+05 4.27E+05 3.10E+05 4.74E+05 3.40E+05 4.88E+05 3.92E+05 2.28E+05 3.59E+05 2.90E+05 2.22E+05 3.12E+05 2.55E+05 3.05E+05 2,3,19-Trihydroxyolean-12-en-28-oic acid (Arjunic acid) 1.09E+05 1.09E+04 5.80E+04 5.24E+03 4.45E+04 1.78E+04 4.53E+05 1.95E+05 1.51E+05 4.33E+05 2.92E+05 1.48E+05 1.55E+05 2.98E+05 1.06E+05 5.08E+05 1.88E+05 1.07E+05 3.84E+05 6.70E+04 3.50E+04 3.53E+03 3.04E+04 3.91E+03 10-Dehydrogeniposide 4.24E+05 4.65E+05 4.27E+06 6.47E+06 3.15E+05 5.28E+05 3.70E+06 4.28E+05 1.55E+06 2.64E+06 8.99E+05 7.31E+05 1.37E+06 4.09E+06 5.58E+06 3.35E+06 6.54E+06 3.00E+06 8.88E+06 1.79E+07 4.22E+06 3.58E+06 9.09E+06 2.06E+07 Rel-(5R,6S,7R)-5,6,7,8-Tetrahydro-5,6,7-trihydroxy-2-[2-(4-methoxyphenyl)ethyl]-4H-1-benzopyran-4-one 2.52E+06 1.47E+06 1.52E+06 1.70E+06 1.01E+06 1.43E+06 9.03E+05 1.46E+06 1.76E+06 1.23E+06 1.44E+06 4.04E+05 1.03E+06 1.16E+06 1.81E+06 6.48E+05 1.89E+06 1.45E+06 1.08E+06 1.01E+06 1.34E+06 1.13E+06 1.52E+06 6.77E+05 3-Deaza-2'-deoxyadenosine 6.69E+06 4.64E+06 3.77E+06 7.53E+06 1.31E+06 1.77E+06 2.83E+06 3.16E+06 3.53E+06 2.41E+06 9.05E+05 1.84E+06 1.86E+06 6.56E+05 7.71E+06 2.14E+06 4.72E+06 5.03E+06 4.27E+05 4.17E+06 2.71E+06 1.28E+06 1.76E+06 4.18E+06 12S-HHT 3.95E+04 9.69E+04 4.58E+04 1.08E+05 1.11E+05 4.63E+05 1.60E+06 1.41E+05 1.25E+04 6.53E+04 1.88E+05 4.50E+05 2.11E+05 2.44E+05 9.90E+04 3.93E+04 2.29E+05 1.98E+04 1.50E+06 6.11E+04 7.61E+04 2.40E+04 4.35E+05 4.06E+04 Comolactone A 1.17E+07 1.13E+07 1.26E+07 1.16E+07 1.05E+07 1.02E+07 8.40E+06 1.13E+07 1.21E+07 7.43E+06 1.02E+07 1.09E+07 1.40E+07 5.16E+06 1.25E+07 4.48E+06 1.12E+07 1.12E+07 1.08E+07 1.17E+07 9.52E+06 9.84E+06 1.09E+07 1.36E+07 Ala-Lys 6.78E+04 5.37E+04 6.79E+05 3.47E+04 2.96E+05 5.47E+04 5.61E+05 1.19E+06 5.63E+04 3.45E+05 2.08E+05 2.38E+05 2.91E+05 6.23E+05 3.18E+04 3.54E+05 2.07E+05 6.15E+04 8.72E+05 7.67E+05 1.20E+05 1.67E+04 7.17E+05 5.39E+04 Pro-ala 1.83E+07 9.52E+06 4.37E+06 1.08E+07 8.90E+06 1.27E+06 7.54E+06 1.42E+07 1.47E+07 6.19E+06 9.45E+06 6.21E+06 6.55E+06 4.19E+06 1.26E+07 8.78E+06 8.32E+06 1.45E+07 4.78E+06 5.34E+06 3.71E+06 1.28E+06 5.43E+06 5.77E+06 Thr-Ala-Gln 1.52E+07 7.27E+06 5.32E+06 9.72E+06 6.68E+06 2.92E+06 8.92E+06 6.89E+06 7.06E+06 4.01E+06 3.14E+06 5.75E+06 1.19E+07 5.68E+06 2.17E+07 1.31E+06 1.46E+07 9.26E+06 6.33E+06 8.08E+06 4.30E+06 9.86E+06 6.84E+06 1.16E+07 Maltotriose 3.65E+06 5.17E+06 2.55E+06 4.68E+06 4.71E+06 2.73E+06 1.55E+06 4.19E+06 4.46E+06 1.95E+06 2.07E+06 3.52E+06 1.74E+06 7.98E+05 2.92E+06 5.68E+05 4.95E+06 4.24E+06 6.40E+06 3.34E+06 2.90E+06 3.54E+06 3.69E+06 3.90E+06 Nonic acid 2.10E+06 3.94E+06 3.06E+06 4.26E+06 4.77E+06 4.55E+06 3.58E+06 2.50E+06 4.42E+06 2.72E+06 4.59E+06 5.10E+06 2.75E+06 1.63E+06 2.19E+06 4.02E+06 2.58E+06 1.70E+06 2.40E+06 2.50E+06 1.93E+06 2.64E+06 2.53E+06 9.71E+05 Asn-Asn-Ala 3.46E+05 4.54E+05 7.99E+05 1.69E+05 3.51E+05 4.93E+05 7.55E+05 3.72E+05 1.32E+06 4.38E+05 4.78E+05 5.84E+05 8.84E+05 1.21E+06 7.91E+05 8.12E+05 6.13E+05 4.12E+05 1.49E+06 3.26E+05 3.67E+05 1.10E+05 3.35E+05 4.06E+04 Matairesinol-4'-O-glucoside (Matairesinoside) 1.31E+05 1.14E+05 2.58E+05 5.79E+05 2.31E+05 3.74E+04 1.20E+05 1.17E+05 1.30E+05 1.81E+05 1.06E+05 1.33E+05 2.34E+05 1.41E+05 2.89E+05 3.83E+04 1.03E+05 3.11E+05 1.45E+05 1.33E+05 6.56E+04 4.57E+04 1.21E+05 1.42E+05 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name Ionization model Class I Class II CAS Q1 (Da) Q3 (Da) Molecular weight (Da) Formula cpd_ID kegg_map N-Methyl-α-aminoisobutyric acid [2M+H]+ Amino acids and derivatives Amino acids and derivatives 2566-34-9 2.35E+02 1.18E+02 1.17E+02 C5H11NO2 - - Senkyunolide H [M-H2O+H]+ Others Lactones 94596-27-7 2.07E+02 1.19E+02 2.24E+02 C12H16O4 - - Senkyunolide I [M-H2O+H]+ Others Lactones 94596-28-8 2.07E+02 1.19E+02 2.24E+02 C12H16O4 - - O-Phosphocholine [M]+ Alkaloids Alkaloids 107-73-3 1.84E+02 1.25E+02 1.84E+02 C5H15NO4P+ C00588 ko00552,ko00564,ko01100,ko05231 Caffeoylcholine [M]+ Alkaloids Phenolamine 87189-10-4 2.66E+02 2.07E+02 2.66E+02 C14H20NO4+ - - Thiamine (Vitamin B1) [M]+ Others Vitamin 70-16-6 2.65E+02 1.22E+02 2.65E+02 C12H17N4OS+ C00378 ko00730,ko01100,ko01240,ko02010,ko04122,ko04977 Nicotinate D-ribonucleoside [M]+ Others Vitamin 17720-18-2 2.56E+02 1.24E+02 2.56E+02 C11H14NO6+ C05841 ko00760,ko01100 S-Adenosylmethionine [M]+ Amino acids and derivatives Amino acids and derivatives 485-80-3 3.99E+02 2.50E+02 3.99E+02 C15H23N6O5S+ - - 2,6-Dihydroxy-4-isopropylphenyl-1-O-β-D-glucoside [M+H]+ Phenolic acids Phenolic acids - 3.31E+02 1.51E+02 3.30E+02 C15H22O8 - - Eugenyl formate [M+H]+ Others Others - 1.93E+02 1.05E+02 1.92E+02 C11H12O3 - - γ-Aminobutyric acid [M+H]+ Organic acids Organic acids 56-12-2 1.04E+02 6.90E+01 1.03E+02 C4H9NO2 C00334 ko00250,ko00330,ko00410,ko00650,ko00760,ko01100,ko01120,ko02024,ko04024,ko04080,ko04721,ko04723,ko04727,ko04742,ko04915,ko04929,ko05032,ko05033 Choline Alfoscerate [M+H]+ Lipids PC 28319-77-9 2.58E+02 1.04E+02 2.57E+02 C8H20NO6P C00670 ko00564,ko00565,ko05231 Methyl Hydroxycinnamate [M+H]+ Phenolic acids Phenolic acids 80540-55-2 1.79E+02 1.19E+02 1.78E+02 C10H10O3 - - Oleamide (9-Octadecenamide) [M+H]+ Lipids Free fatty acids 301-02-0 2.82E+02 2.47E+02 2.81E+02 C18H35NO C19670 - N-Benzylmethylene isomethylamine [M+H]+ Alkaloids Alkaloids - 1.20E+02 1.03E+02 1.19E+02 C8H9N - - 2-benzoyl-4-[(2r)-1-hydroxy-7-methyl-3-methylideneoct-6-en-1-yl]benzene-1,3,5-triol [M+H]+ Others Ketone compounds - 3.83E+02 3.27E+02 3.82E+02 C23H26O5 - - 3,5-Diacetyltambulin [M+H]+ Flavonoids Flavones - 4.29E+02 3.85E+02 4.28E+02 C22H20O9 - - 4-Hydroxy-L-Isoleucine [M+H]+ Amino acids and derivatives Amino acids and derivatives 781658-23-9 1.48E+02 7.40E+01 1.47E+02 C6H13NO3 - - 1-Aminocyclopropane-1-carboxylic acid* [M+H]+ Organic acids Organic acids 22059-21-8 1.02E+02 5.61E+01 1.01E+02 C4H7NO2 C01234 ko00270,ko01060,ko01070,ko01100,ko01110 L-Homomethionine [M+H]+ Amino acids and derivatives Amino acids and derivatives 25148-30-5 1.64E+02 5.61E+01 1.63E+02 C6H13NO2S C17213 ko00966,ko01110,ko01210 L-Homoserine [M+H]+ Amino acids and derivatives Amino acids and derivatives 672-15-1 1.20E+02 7.41E+01 1.19E+02 C4H9NO3 C00263 ko00260,ko00270,ko00300,ko00920,ko01100,ko01110,ko01120,ko01230 LysoPC 16:0* [M+H]+ Lipids LPC 17364-16-8 4.96E+02 1.84E+02 4.95E+02 C24H50NO7P - - Phenyl salicylate [M+H]+ Phenolic acids Phenolic acids 118-55-8 2.15E+02 1.21E+02 2.14E+02 C13H10O3 C14163 - Elemicin [M+H]+ Phenolic acids Phenolic acids 487-11-6 2.09E+02 1.53E+02 2.08E+02 C12H16O3 C10451 - (6S)-2-Methyl-6-[(1R,5S)-(4-methene-5-hydroxyl-2-cyclohexen)-2-hepten-4-one [M+H]+ Terpenoids Sesquiterpenoids - 2.35E+02 1.37E+02 2.34E+02 C15H22O2 - - epieudesmin [M+H]+ Lignans and Coumarins Lignans - 3.87E+02 1.37E+02 3.86E+02 C22H26O6 - - 2',4'-Dimethylacetophenone [M+H]+ Others Ketone compounds 89-74-7 1.49E+02 6.50E+01 1.48E+02 C10H12O - - N-(gamma-L-glutamyl)tyramine O-glucoside [M+H]+ Alkaloids Phenolamine - 4.29E+02 2.67E+02 4.28E+02 C19H28N2O9 - - Beta-asarone* [M+H]+ Phenolic acids Phenolic acids 5273-86-9 2.09E+02 1.79E+02 2.08E+02 C12H16O3 C10430 - 2-Aminooctadecane-1,16,18,18-tetraol [M+H]+ Lipids Sphingolipids - 3.34E+02 2.42E+02 3.33E+02 C18H39NO4 - - Isosclerone;(4S)-4,8-Dihydroxy-3,4-Dihydronaphthalene-1(2H)-One [M+H]+ Quinones Quinones 54712-38-8 1.79E+02 1.15E+02 1.78E+02 C10H10O3 - - Isoalantolactone [M+H]+ Terpenoids Sesquiterpenoids 470-17-7 2.33E+02 1.19E+02 2.32E+02 C15H20O2 C09484 - cis-4-Hydroxy-D-proline* [M+H]+ Amino acids and derivatives Amino acids and derivatives 2584-71-6 1.32E+02 8.61E+01 1.31E+02 C5H9NO3 C03440 ko00470,ko01100 2-aminodocoSane-1,5,7,21-tetraol [M+H]+ Lipids Sphingolipids - 3.90E+02 3.28E+02 3.89E+02 C22H47NO4 - - L-Valinol [M+H]+ Amino acids and derivatives Amino acids and derivatives 2026-48-4 1.04E+02 6.01E+01 1.03E+02 C5H13NO - - (2e)-3-(4-hydroxyphenyl)-n-[2-(4-hydroxyphenyl)ethyl]prop-2-enimidic acid* [M+H]+ Alkaloids Isoquinoline alkaloids - 2.84E+02 1.21E+02 2.83E+02 C17H17NO3 - - 14,15-Dehydrocrepenynic acid* [M+H]+ Lipids Free fatty acids 4154-44-3 2.77E+02 9.31E+01 2.76E+02 C18H28O2 - - 9,12-Octadecadiynoic Acid* [M+H]+ Lipids Free fatty acids 2012-14-8 2.77E+02 9.31E+01 2.76E+02 C18H28O2 - - Succinic anhydride [M+H]+ Organic acids Organic acids 108-30-5 1.01E+02 5.50E+01 1.00E+02 C4H4O3 C19524 - 1-Methoxy-indole-3-acetamide [M+H]+ Alkaloids Plumerane - 2.05E+02 1.46E+02 2.04E+02 C11H12N2O2 - - Linolenyl Alcohol [M+H]+ Others Others 506-44-5 2.65E+02 6.91E+01 2.64E+02 C18H32O - - 4-Nitrophenol [M+H]+ Phenolic acids Phenolic acids 100-02-7 1.40E+02 9.90E+01 1.39E+02 C6H5NO3 C00870 ko00627,ko01120 Collinusin [M+H]+ Lignans and Coumarins Lignans 17990-72-6 3.67E+02 3.35E+02 3.66E+02 C21H18O6 - - Feruloyl syringic acid [M+H]+ Phenolic acids Phenolic acids - 3.75E+02 1.37E+02 3.74E+02 C19H18O8 - - Glu-Phe [M+H]+ Amino acids and derivatives Amino acids and derivatives 20556-22-3 2.95E+02 1.20E+02 2.94E+02 C14H18N2O5 - - DL-Threonine [M+H]+ Amino acids and derivatives Amino acids and derivatives 80-68-2 1.20E+02 5.61E+01 1.19E+02 C4H9NO3 - - Tetradecasphinganine* [M+H]+ Others Others - 2.46E+02 8.81E+01 2.45E+02 C14H31NO2 - - N-Carbamoylsarcosine [M+H]+ Amino acids and derivatives Amino acids and derivatives - 1.33E+02 1.05E+02 1.32E+02 C4H8N2O3 C01043 ko00330,ko01100 N,N-Dimethylglycine* [M+H]+ Amino acids and derivatives Amino acids and derivatives 1118-68-9 1.04E+02 5.81E+01 1.03E+02 C4H9NO2 C01026 ko00260,ko01100 8-hydroxy-2,3,3,9-tetramethyl-2h-furo[3,2-c]chromen-4-one [M+H]+ Others Others - 2.61E+02 1.87E+02 2.60E+02 C15H16O4 - - L-Asparagine [M+H]+ Amino acids and derivatives Amino acids and derivatives 70-47-3 1.33E+02 7.40E+01 1.32E+02 C4H8N2O3 C00152 ko00250,ko00460,ko00970,ko01060,ko01100,ko01110,ko01230,ko04974,ko04978,ko05230 Nicotinamide [M+H]+ Others Vitamin 98-92-0 1.23E+02 8.01E+01 1.22E+02 C6H6N2O C00153 ko00760,ko01100,ko01240,ko04212,ko04977 Lithospermoside [M+H]+ Alkaloids Alkaloids 63492-69-3 3.30E+02 1.68E+02 3.29E+02 C14H19NO8 C17771 - Methyl-3-(3-hydroxyphenyl)Propionate [M+H]+ Phenolic acids Phenolic acids 61389-68-2 1.81E+02 1.21E+02 1.80E+02 C10H12O3 - - 2-Aminooctadecane-1,4-diol [M+H]+ Lipids Sphingolipids - 3.02E+02 8.81E+01 3.01E+02 C18H39NO2 - - 2,3-Dihydro-1,4-naphthoquinone [M+H]+ Quinones Quinones 21545-31-3 1.61E+02 1.33E+02 1.60E+02 C10H8O2 - - 2,3-Dihydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)propan-1-one [M+H]+ Phenolic acids Phenolic acids - 2.43E+02 1.40E+02 2.42E+02 C11H14O6 - - 2,6-Dimethoxy-4-(7-methoxy-3-methyl-5-prop-1-enyl-2,3-dihydro-1-benzofuran-2-yl)phenol* [M+H]+ Lignans and Coumarins Lignans - 3.57E+02 2.03E+02 3.56E+02 C21H24O5 - - L-Glutamic acid [M+H]+ Amino acids and derivatives Amino acids and derivatives 56-86-0 1.48E+02 8.40E+01 1.47E+02 C5H9NO4 C00025 ko00220,ko00250,ko00330,ko00332,ko00340,ko00430,ko00470,ko00480,ko00524,ko00630,ko00650,ko00660,ko00860,ko00910,ko00970,ko00997,ko00998,ko01060,ko01064,ko01100,ko01110,ko01120,ko01200,ko01210,ko01230,ko01240,ko02010,ko02020,ko04068,ko04072,ko04080,ko04216,ko04540,ko04713,ko04720,ko04721,ko04723,ko04724,ko04727,ko04730,ko04742,ko04964,ko04974,ko05014,ko05016,ko05017,ko05022,ko05030,ko05031,ko05033,ko05034,ko05230 LysoPC 18:1(2n isomer) [M+H]+ Lipids LPC - 5.22E+02 1.84E+02 5.21E+02 C26H52NO7P - - 6-Aminocaproic acid [M+H]+ Organic acids Organic acids 60-32-2 1.32E+02 6.91E+01 1.31E+02 C6H13NO2 C02378 ko00930,ko01100,ko01120 Betaine [M+H]+ Alkaloids Alkaloids 107-43-7 1.18E+02 5.81E+01 1.17E+02 C5H11NO2 C00719 ko00260,ko01100,ko02010 L-Histidine [M+H]+ Amino acids and derivatives Amino acids and derivatives 71-00-1 1.56E+02 1.10E+02 1.55E+02 C6H9N3O2 C00135 ko00340,ko00404,ko00410,ko00470,ko00970,ko01060,ko01065,ko01100,ko01110,ko01230,ko02010,ko04974,ko05230 Imidazole-4-Acetic Acid [M+H]+ Alkaloids Alkaloids 645-65-8 1.27E+02 8.10E+01 1.26E+02 C5H6N2O2 C02835 ko00340,ko01100 2-Pentyl-3-phenyl-2-propenal [M+H]+ Others Aldehyde compounds 122-40-7 2.03E+02 1.29E+02 2.02E+02 C14H18O C12288 - Glycerol 9(E),11(Z),13(E)-octadecatrienoyl ester* [M+H]+ Lipids Glycerol ester - 3.53E+02 2.61E+02 3.52E+02 C21H36O4 - - 2-Aminohexadecane-1,16,16-triol [M+H]+ Lipids Sphingolipids - 2.90E+02 2.42E+02 2.89E+02 C16H35NO3 - - L-Cyclopentylglycine [M+H]+ Amino acids and derivatives Amino acids and derivatives 2521-84-8 1.44E+02 9.81E+01 1.43E+02 C7H13NO2 - - N-benzylformamide [M+H]+ Alkaloids Alkaloids 6343-54-0 1.36E+02 9.11E+01 1.35E+02 C8H9NO C15561 - Casuarine Analogue* [M+H]+ Alkaloids Alkaloids - 2.20E+02 9.01E+01 2.19E+02 C9H17NO5 - - L-Carnitine [M+H]+ Alkaloids Alkaloids 541-15-1 1.62E+02 8.50E+01 1.61E+02 C7H15NO3 C00318 ko04714,ko04976,ko05415 3,4-Methylenedioxycinnamaldehyde [M+H]+ Others Aldehyde compounds 58095-77-5 1.77E+02 1.49E+02 1.76E+02 C10H8O3 - - LysoPC 19:1 [M+H]+ Lipids LPC - 5.36E+02 1.84E+02 5.35E+02 C27H54NO7P - - Glycylphenylalanine [M+H]+ Amino acids and derivatives Amino acids and derivatives 3321-03-7 2.23E+02 1.20E+02 2.22E+02 C11H14N2O3 - - 2,3-cis-4-(3,4-hydroxyphenyl)-2,3-dihydro-2,3-dihydroxyphenalen-1-one [M+H]+ Quinones Quinones - 3.23E+02 1.21E+02 3.22E+02 C19H14O5 - - Asp-Pro-Asn [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.45E+02 1.37E+02 3.44E+02 C13H20N4O7 - - Α-hydroxyquinoline [M+H]+ Alkaloids Alkaloids - 1.46E+02 1.18E+02 1.45E+02 C9H7NO - - Dihydrocostunolide [M+H]+ Terpenoids Sesquiterpenoids 2225-79-8 2.35E+02 1.05E+02 2.34E+02 C15H22O2 - - Crotonoside; 2-Hydroxyadenosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 1818-71-9 2.84E+02 1.52E+02 2.83E+02 C10H13N5O5 C08432 - 5-O-β-D-Glucopyranosyl-3-hydrobenzo(b)fu-ran-2-one [M+H]+ Phenolic acids Phenolic acids - 3.13E+02 1.51E+02 3.12E+02 C14H16O8 - - Pipecolic acid [M+H]+ Alkaloids Piperidine alkaloids 535-75-1 1.30E+02 5.61E+01 1.29E+02 C6H11NO2 - - 6-Chloropurine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 87-42-3 1.55E+02 1.19E+02 1.54E+02 C5H3ClN4 - - Octadec-8-enamide [M+H]+ Alkaloids Alkaloids - 2.82E+02 6.91E+01 2.81E+02 C18H35NO - - 2'-O-Methyladenosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 2140-79-6 2.82E+02 1.36E+02 2.81E+02 C11H15N5O4 - - 2-Aminohexadecane-1,5,6-triol [M+H]+ Lipids Sphingolipids - 2.90E+02 8.81E+01 2.89E+02 C16H35NO3 - - Aketrilignoside B [M+H]+ Lignans and Coumarins Lignans 1020108-72-8 5.97E+02 4.17E+02 5.96E+02 C28H36O14 - - Val-Tyr [M+H]+ Amino acids and derivatives Amino acids and derivatives 3061-91-4 2.81E+02 1.52E+02 2.80E+02 C14H20N2O4 - - DL-2-Aminoadipic acid [M+H]+ Alkaloids Alkaloids 542-32-5 1.62E+02 9.81E+01 1.61E+02 C6H11NO4 C00956 ko00300,ko00310,ko00311,ko01100,ko01110,ko01120,ko01210,ko01230 LysoPC 16:0(2n isomer)* [M+H]+ Lipids LPC - 4.96E+02 1.84E+02 4.95E+02 C24H50NO7P - - L-Pipecolic Acid [M+H]+ Organic acids Organic acids 3105-95-1 1.30E+02 8.41E+01 1.29E+02 C6H11NO2 C00408 ko00310,ko00960,ko01060,ko01064,ko01100,ko01110,ko01120 LysoPE 16:1* [M+H]+ Lipids LPE - 4.52E+02 3.11E+02 4.51E+02 C21H42NO7P - - Punicic acid (9Z,11E,13Z-octadecatrienoic acid) [M+H]+ Lipids Free fatty acids 544-72-9 2.79E+02 9.51E+01 2.78E+02 C18H30O2 C08364 - 3,5-Dihydro-2H-Furo[3,2-C]Quinolin-4-One* [M+H]+ Alkaloids Quinoline alkaloids - 1.88E+02 1.18E+02 1.87E+02 C11H9NO2 - - Acacetin-7-O-glucuronide [M+H]+ Flavonoids Flavones - 4.61E+02 2.85E+02 4.60E+02 C26H20O8 - - Lauryldiethanolamine* [M+H]+ Others Others 1541-67-9 2.74E+02 8.81E+01 2.73E+02 C16H35NO2 - - 3,4-dihydroxy phenylethanol [M+H]+ Phenolic acids Phenolic acids - 1.55E+02 9.11E+01 1.54E+02 C8H10O3 - - O-Acetyl-L-carnitine [M+H]+ Alkaloids Alkaloids 3040-38-8 2.04E+02 8.50E+01 2.03E+02 C9H17NO4 - - 5-Hydroxy-2-pyrrolidinone [M+H]+ Alkaloids Pyrrole alkaloids 62312-55-4 1.02E+02 8.41E+01 1.01E+02 C4H7NO2 - - Sugiol [M+H]+ Terpenoids Ditepenoids 511-05-7 3.01E+02 2.59E+02 3.00E+02 C20H28O2 C21822 ko00904,ko01110 Myristicanol B* [M+H]+ Lignans and Coumarins Lignans 114912-33-3 4.05E+02 1.67E+02 4.04E+02 C22H28O7 - - Carvylacetate [M+H]+ Terpenoids Monoterpenoids 97-42-7 1.95E+02 6.71E+01 1.94E+02 C12H18O2 - - Hyp-Ser [M+H]+ Amino acids and derivatives Amino acids and derivatives - 2.19E+02 8.61E+01 2.18E+02 C8H14N2O5 - - Dihydrocaffeic acid [M+H]+ Phenolic acids Phenolic acids 1078-61-1 1.83E+02 1.65E+02 1.82E+02 C9H10O4 C10447 ko00350,ko00946,ko01100 (10Z,14E,16E)-10,14,16-Octadecatrien-12-Ynoic Acid [M+H]+ Lipids Free fatty acids - 2.75E+02 1.33E+02 2.74E+02 C18H26O2 - - Ribosyladenosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives - 4.00E+02 1.36E+02 3.99E+02 C15H21N5O8 - - Alanylproline [M+H]+ Amino acids and derivatives Amino acids and derivatives 13485-59-1 1.87E+02 7.01E+01 1.86E+02 C8H14N2O3 - - (1S,3R,3a1S,8R,10S,11aS)-1,5,10-trihydroxy-3,3a1,8,11a-tetramethyl-2,11-dioxohexadecahydrodibenzo[de,g]chromen-4-yl acetate [M+H]+ Terpenoids Ditepenoids - 4.25E+02 3.65E+02 4.24E+02 C22H32O8 - - 3-Hydroxy-3,7,11-trimethyldodeca-1,6E,10-trien-9-yl isobutyrate [M+H]+ Terpenoids Sesquiterpenoids - 2.95E+02 1.51E+02 2.94E+02 C18H30O3 - - Homoproline [M+H]+ Amino acids and derivatives Amino acids and derivatives 56879-46-0 1.30E+02 7.01E+01 1.29E+02 C6H11NO2 - - N-Methyl-Trans-4-Hydroxy-L-Proline [M+H]+ Amino acids and derivatives Amino acids and derivatives 4252-82-8 1.46E+02 8.21E+01 1.45E+02 C6H11NO3 - - LysoPC 20:2 [M+H]+ Lipids LPC - 5.48E+02 1.84E+02 5.47E+02 C28H54NO7P - - (3r,4r)-3-(2h-1,3-benzodioxol-5-ylmethyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one* [M+H]+ Lignans and Coumarins Lignans - 3.57E+02 3.07E+02 3.56E+02 C20H20O6 - - alanine betaine* [M+H]+ Alkaloids Alkaloids - 1.18E+02 7.21E+01 1.17E+02 C5H11NO2 - - 4-Methoxybenzaldehyde [M+H]+ Others Aldehyde compounds 123-11-5 1.37E+02 9.40E+01 1.36E+02 C8H8O2 C10761 - L-Serine [M+H]+ Amino acids and derivatives Amino acids and derivatives 56-45-1 1.06E+02 7.00E+01 1.05E+02 C3H7NO3 C00065 ko00260,ko00261,ko00270,ko00460,ko00470,ko00564,ko00600,ko00630,ko00680,ko00920,ko00970,ko00997,ko00998,ko01060,ko01100,ko01110,ko01120,ko01200,ko01230,ko01240,ko01502,ko02010,ko04071,ko04974,ko04978,ko05230 Azetidine-2-carboxylic acid* [M+H]+ Alkaloids Alkaloids 2517-04-6 1.02E+02 5.61E+01 1.01E+02 C4H7NO2 C08267 - 10-Acetyligustroside [M+H]+ Terpenoids Monoterpenoids - 5.67E+02 1.67E+02 5.66E+02 C27H34O13 - - 2,3,19-Trihydroxy-24-oxo-olean-12-en-28-oic acid [M+H]+ Terpenoids Triterpene - 5.03E+02 4.57E+02 5.02E+02 C30H46O6 - - Riboflavin (Vitamin B2) [M+H]+ Others Vitamin 83-88-5 3.77E+02 2.43E+02 3.76E+02 C17H20N4O6 C00255 ko00740,ko01100,ko01110,ko01240,ko02010,ko04977 8-[3-oxo-2-[(E)-pent-2-enyl]cyclopenten-1-yl]octanoic acid [M+H]+ Others Others - 2.93E+02 8.11E+01 2.92E+02 C18H28O3 - - 2-α-Linolenoyl-glycerol* [M+H]+ Lipids Glycerol ester 55268-58-1 3.53E+02 2.61E+02 3.52E+02 C21H36O4 - - 2-AminoicoSane-1,5,19-triol [M+H]+ Lipids Sphingolipids - 3.46E+02 8.81E+01 3.45E+02 C20H43NO3 - - Balsaminace G [M+H]+ Phenolic acids Phenolic acids - 3.47E+02 1.85E+02 3.46E+02 C14H18O10 - - N-Methyl-L-proline [M+H]+ Amino acids and derivatives Amino acids and derivatives 475-11-6 1.30E+02 8.41E+01 1.29E+02 C6H11NO2 C22223 - Lys-Gly [M+H]+ Amino acids and derivatives Amino acids and derivatives 7563-03-3 2.04E+02 8.41E+01 2.03E+02 C8H17N3O3 - - 11,12-O-Isopropyfidenesolajiangxin F [M+H]+ Terpenoids Sesquiterpenoids - 2.93E+02 1.19E+02 2.92E+02 C18H28O3 - - LysoPC 18:1 [M+H]+ Lipids LPC - 5.22E+02 1.84E+02 5.21E+02 C26H52NO7P - - dihydrosesamin* [M+H]+ Lignans and Coumarins Lignans - 3.57E+02 3.07E+02 3.56E+02 C20H20O6 - - Fraxiresinol [M+H]+ Lignans and Coumarins Lignans 89199-97-3 4.05E+02 1.67E+02 4.04E+02 C21H24O8 - - cyclo-(Gly-Phe) [M+H]+ Amino acids and derivatives Amino acids and derivatives 10125-07-2 2.05E+02 1.46E+02 2.04E+02 C11H12N2O2 - - Justicidinoside A [M+H]+ Lignans and Coumarins Lignans - 5.73E+02 4.11E+02 5.72E+02 C28H28O13 - - 5-Hydroxy-1-tetralone [M+H]+ Others Ketone compounds 28315-93-7 1.63E+02 1.07E+02 1.62E+02 C10H10O2 - - Skimmin (7-Hydroxycoumarin-7-O-glucoside) [M+H]+ Lignans and Coumarins Coumarins 93-39-0 3.25E+02 1.63E+02 3.24E+02 C15H16O8 - - 16-oxo-21β-hydroxyserrat-14-en-3α-yl acetate [M+H]+ Terpenoids Triterpene - 4.57E+02 4.57E+02 4.56E+02 C30H48O3 - - D-Threose [M+H]+ Others Saccharides 95-43-2 1.21E+02 9.31E+01 1.20E+02 C4H8O4 C06463 - 1-18:3-LysoPC [M+H]+ Others Others - 5.18E+02 1.84E+02 5.17E+02 C26H48NO7P - - Methyl 3-aminopropanoate [M+H]+ Amino acids and derivatives Amino acids and derivatives 4138-35-6 1.04E+02 5.90E+01 1.03E+02 C4H9NO2 - - 2-Aminotetradecane-1,4-diol* [M+H]+ Lipids Sphingolipids - 2.46E+02 8.81E+01 2.45E+02 C14H31NO2 - - 3'-Methoxy-6''-O-xylosyl puerarin [M+H]+ Flavonoids Isoflavones - 5.79E+02 4.17E+02 5.78E+02 C27H30O14 - - Tetradecyldiethanolamine [M+H]+ Alkaloids Alkaloids 18924-66-8 3.02E+02 8.81E+01 3.01E+02 C18H39NO2 - - 5-hydroxyindene-1,3-dione [M+H]+ Terpenoids Sesquiterpenoids 131977-61-2 1.63E+02 1.33E+02 1.62E+02 C9H6O3 - - DL-Dopa [M+H]+ Amino acids and derivatives Amino acids and derivatives 63-84-3 1.98E+02 1.70E+02 1.97E+02 C9H11NO4 - - Macrophypene B* [M+H]+ Terpenoids Ditepenoids - 2.77E+02 9.31E+01 2.76E+02 C18H28O2 - - 1-Stearidonoyl-Glycerol [M+H]+ Lipids Glycerol ester - 3.51E+02 1.47E+02 3.50E+02 C21H34O4 - - N-Phenylacetylglycine [M+H]+ Amino acids and derivatives Amino acids and derivatives 500-98-1 1.94E+02 9.11E+01 1.93E+02 C10H11NO3 C05598 ko00360 5-Aminoimidazole ribonucleotide [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 25635-88-5 2.96E+02 1.04E+02 2.95E+02 C8H14N3O7P - - 4-methyl-1,5,2,3-dioxadiazinan-2-amine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives - 1.20E+02 7.70E+01 1.19E+02 C3H9N3O2 - - Licarin A [M+H]+ Lignans and Coumarins Lignans 23518-30-1 3.27E+02 2.03E+02 3.26E+02 C20H22O4 - - Yuanhuanin* [M+H]+ Flavonoids Flavones 83133-14-6 4.63E+02 3.01E+02 4.62E+02 C22H22O11 - - Vanillin acetate [M+H]+ Phenolic acids Phenolic acids 881-68-5 1.95E+02 9.30E+01 1.94E+02 C10H10O4 - - L-Leucyl-L-phenylalanine [M+H]+ Amino acids and derivatives Amino acids and derivatives 56217-82-4 2.79E+02 1.20E+02 2.78E+02 C15H22N2O3 - - Nectandrin B* [M+H]+ Lignans and Coumarins Lignans 74683-16-2 3.45E+02 1.37E+02 3.44E+02 C20H24O5 - - N-Methylserotonin [M+H]+ Alkaloids Plumerane 1134-01-6 1.91E+02 1.60E+02 1.90E+02 C11H14N2O C06212 ko00380 Hexadecyl ethanolamine [M+H]+ Alkaloids Alkaloids - 2.86E+02 2.68E+02 2.85E+02 C18H39NO - - 3,4-Dehydro-DL-proline [M+H]+ Amino acids and derivatives Amino acids and derivatives 3395-35-5 1.14E+02 6.81E+01 1.13E+02 C5H7NO2 - - L-Isoserine [M+H]+ Amino acids and derivatives Amino acids and derivatives 632-13-3 1.06E+02 6.00E+01 1.05E+02 C3H7NO3 - - 6-Deoxyfagomine [M+H]+ Alkaloids Piperidine alkaloids 197449-09-5 1.32E+02 5.70E+01 1.31E+02 C6H13NO2 - - 4-Methylazetidine-2-Carboxylic acid* [M+H]+ Alkaloids Alkaloids 1779725-63-1 1.16E+02 7.01E+01 1.15E+02 C5H9NO2 - - 3,7,11-trimethyl-2-oxa-6,10,13-triazatricyclo[7.3.1.05,13]tridecane [M+H]+ Alkaloids Alkaloids - 2.26E+02 1.80E+02 2.25E+02 C12H23N3O - - Hexadecylsphingosine [M+H]+ Lipids Sphingolipids - 2.74E+02 2.56E+02 2.73E+02 C16H35NO2 - - Nicotianamine [M+H]+ Alkaloids Alkaloids 34441-14-0 3.04E+02 1.85E+02 3.03E+02 C12H21N3O6 C05324 ko00270,ko00999,ko01100,ko01110 3-Hydroxy-4H-pyran-4-one [M+H]+ Organic acids Organic acids - 1.13E+02 6.70E+01 1.12E+02 C5H4O3 - - 2-Aminopurine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 452-06-2 1.36E+02 1.19E+02 1.35E+02 C5H5N5 - - Virgatic acid [M+H]+ Terpenoids Triterpene 14356-51-5 4.71E+02 4.71E+02 4.70E+02 C30H46O4 - - 2-Aminotetradecan-1-ol* [M+H]+ Lipids Sphingolipids - 2.30E+02 6.21E+01 2.29E+02 C14H31NO - - 9-Alpha-Ribofuranosyladenine* [M+H]+ Nucleotides and derivatives Nucleotides and derivatives - 2.68E+02 1.36E+02 2.67E+02 C10H13N5O4 - - Octadecadienamide [M+H]+ Alkaloids Alkaloids - 2.80E+02 8.11E+01 2.79E+02 C18H33NO - - 15(R)-Hydroxylinoleic Acid [M+H]+ Lipids Free fatty acids 177931-23-6 2.97E+02 8.11E+01 2.96E+02 C18H32O3 - - L-Valyl-L-Phenylalanine [M+H]+ Amino acids and derivatives Amino acids and derivatives 3918-92-1 2.65E+02 7.21E+01 2.64E+02 C14H20N2O3 - - 2-Aminotetradecane-1,5,13-triol [M+H]+ Lipids Sphingolipids - 2.62E+02 2.00E+02 2.61E+02 C14H31NO3 - - Val-Val [M+H]+ Amino acids and derivatives Amino acids and derivatives 3918-94-3 2.17E+02 1.44E+02 2.16E+02 C10H20N2O3 - - 1,4-Benzodioxin-6-propanol [M+H]+ Others Alcohol compounds - 1.93E+02 1.05E+02 1.92E+02 C11H12O3 - - O-Acetylserine [M+H]+ Amino acids and derivatives Amino acids and derivatives 5147-00-2 1.48E+02 8.80E+01 1.47E+02 C5H9NO4 C00979 ko00270,ko00908,ko00920,ko00998,ko01100,ko01110,ko01120,ko01200,ko01230,ko04122 7-oxo-11-Dodecenoic acid [M+H]+ Lipids Free fatty acids 54921-60-7 2.13E+02 8.11E+01 2.12E+02 C12H20O3 - - Otobaphenol* [M+H]+ Lignans and Coumarins Lignans 10240-16-1 3.27E+02 1.88E+02 3.26E+02 C20H22O4 - - 3-(Cyclohexen-1-yl)-2-hydroxy-4a,5-dimethyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one* [M+H]+ Others Others - 2.77E+02 9.31E+01 2.76E+02 C18H28O2 - - L-Phenylalanine [M+H]+ Amino acids and derivatives Amino acids and derivatives 63-91-2 1.66E+02 1.20E+02 1.65E+02 C9H11NO2 C00079 ko00360,ko00400,ko00460,ko00470,ko00940,ko00960,ko00966,ko00970,ko00996,ko00997,ko00999,ko01060,ko01061,ko01063,ko01064,ko01070,ko01100,ko01110,ko01210,ko01230,ko02010,ko04974,ko04978,ko05230 3-O-Acetylnarcissidine [M+H]+ Alkaloids Alkaloids - 3.76E+02 1.36E+02 3.75E+02 C20H25NO6 - - 2-Aminohexadecane-1,4-diol* [M+H]+ Lipids Sphingolipids - 2.74E+02 8.81E+01 2.73E+02 C16H35NO2 - - LysoPC 18:2 [M+H]+ Lipids LPC - 5.20E+02 1.84E+02 5.19E+02 C26H50NO7P - - L-Methionine Sulfoxide [M+H]+ Amino acids and derivatives Amino acids and derivatives 3226-65-1 1.66E+02 1.02E+02 1.65E+02 C5H11NO3S C02989 ko00270,ko01100 Ile-Asn [M+H]+ Amino acids and derivatives Amino acids and derivatives 59652-59-4 2.46E+02 8.61E+01 2.45E+02 C10H19N3O4 - - Procurcumenol [M+H]+ Terpenoids Sesquiterpenoids - 2.35E+02 1.33E+02 2.34E+02 C15H22O2 - - cedrusinin [M+H]+ Lignans and Coumarins Lignans - 3.61E+02 1.89E+02 3.60E+02 C20H24O6 - - 2-Amino-3-methoxybenzoic acid [M+H]+ Phenolic acids Phenolic acids 3177-80-8 1.68E+02 9.41E+01 1.67E+02 C8H9NO3 C05831 ko00380 L-Proline* [M+H]+ Amino acids and derivatives Amino acids and derivatives 147-85-3 1.16E+02 7.01E+01 1.15E+02 C5H9NO2 C00148 ko00330,ko00332,ko00333,ko00401,ko00404,ko00470,ko00970,ko01100,ko01110,ko01230,ko02010,ko04974,ko04978,ko05230 Lauramine oxide [M+H]+ Others Others 1643-20-5 2.30E+02 5.71E+01 2.29E+02 C14H31NO - - (3S)-1,3-dihydroxy-2,3,3a,4-tetrahydropyrrolo[2,1-b]quinazolin-9(1H)-one [M+H]+ Alkaloids Alkaloids - 2.21E+02 1.75E+02 2.20E+02 C11H12N2O3 - - Phenylethanolamine [M+H]+ Alkaloids Alkaloids 7568-93-6 1.38E+02 1.20E+02 1.37E+02 C8H11NO C02735 - L-Glutamine [M+H]+ Amino acids and derivatives Amino acids and derivatives 56-85-9 1.47E+02 8.40E+01 1.46E+02 C5H10N2O3 C00064 ko00220,ko00230,ko00240,ko00250,ko00470,ko00630,ko00750,ko00910,ko00970,ko01060,ko01100,ko01120,ko01230,ko01232,ko01240,ko02010,ko02020,ko04724,ko04727,ko04964,ko04974,ko04978,ko05230 7,8-Dihydrofurocoumarin [M+H]+ Lignans and Coumarins Coumarins - 1.89E+02 1.31E+02 1.88E+02 C11H8O3 - - 3-Dehydrosphinganine [M+H]+ Lipids Sphingolipids 16105-69-4 3.00E+02 6.01E+01 2.99E+02 C18H37NO2 C02934 ko00600,ko01100 2-Aminohexadecane-1,5,15-triol [M+H]+ Lipids Sphingolipids - 2.90E+02 2.28E+02 2.89E+02 C16H35NO3 - - 9β-hydroxyeudesma-4,11(13)-dien-12-al [M+H]+ Terpenoids Sesquiterpenoids - 2.35E+02 1.05E+02 2.34E+02 C15H22O2 - - 5-hydroxy-6,7-dimethoxy-2-[2-(4'-methoxyphenyl)ethyl]chromone [M+H]+ Others Chromone - 3.57E+02 1.37E+02 3.56E+02 C20H20O6 - - Cubebin Dimethyl Ether [M+H]+ Lignans and Coumarins Lignans - 3.87E+02 2.01E+02 3.86E+02 C22H26O6 - - balanophon n [M+H]+ Lignans and Coumarins Lignans - 3.57E+02 1.75E+02 3.56E+02 C20H20O6 - - Ser-Lys [M+H]+ Amino acids and derivatives Amino acids and derivatives 22677-61-8 2.34E+02 8.41E+01 2.33E+02 C9H19N3O4 - - 3-Chloroaniline [M+H]+ Alkaloids Alkaloids 108-42-9 1.28E+02 9.31E+01 1.27E+02 C6H6ClN - - (S)-2,3-dihydroxypropyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate [M+H]+ Others Others 129828-41-7 3.53E+02 2.61E+02 3.52E+02 C21H36O4 - - LysoPE 18:1* [M+H]+ Lipids LPE 89576-29-4 4.80E+02 3.39E+02 4.79E+02 C23H46NO7P - - 2-Aminoisobutyric acid* [M+H]+ Organic acids Organic acids 62-57-7 1.04E+02 5.81E+01 1.03E+02 C4H9NO2 C03665 - Dehydrodiisoeugenol* [M+H]+ Lignans and Coumarins Lignans 2680-81-1 3.27E+02 1.88E+02 3.26E+02 C20H22O4 C10650 - Lys-Tyr [M+H]+ Amino acids and derivatives Amino acids and derivatives 35978-98-4 3.10E+02 8.41E+01 3.09E+02 C15H23N3O4 - - DL-Methionine [M+H]+ Amino acids and derivatives Amino acids and derivatives 59-51-8 1.50E+02 6.10E+01 1.49E+02 C5H11NO2S C01733 - Abu-Val-OH [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.11E+02 1.37E+02 3.10E+02 C14H18N2O6 - - Piperonylic acid [M+H]+ Organic acids Organic acids 94-53-1 1.67E+02 1.23E+02 1.66E+02 C8H6O4 - - LysoPC 16:1(2n isomer)* [M+H]+ Lipids LPC - 4.94E+02 1.84E+02 4.93E+02 C24H48NO7P - - N-(beta-D-Glucosyl)nicotinate [M+H]+ Others Vitamin - 2.86E+02 1.24E+02 2.85E+02 C12H15NO7 - - Ala-His [M+H]+ Amino acids and derivatives Amino acids and derivatives 3253-17-6 2.27E+02 1.10E+02 2.26E+02 C9H14N4O3 - - Asp-Lys [M+H]+ Amino acids and derivatives Amino acids and derivatives 5891-51-0 2.62E+02 8.41E+01 2.61E+02 C10H19N3O5 - - L-Valyl-L-Leucine [M+H]+ Amino acids and derivatives Amino acids and derivatives 3989-97-7 2.31E+02 7.21E+01 2.30E+02 C11H22N2O3 - - Leu-Abu-OH [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.25E+02 1.63E+02 3.24E+02 C15H20N2O6 - - Cinnamic acid [M+H]+ Phenolic acids Phenolic acids 140-10-3 1.49E+02 1.03E+02 1.48E+02 C9H8O2 C00423 ko00130,ko00360,ko00940,ko00996,ko00999,ko01060,ko01070,ko01100,ko01110,ko01120,ko01220 2'-Deoxyinosine-5'-monophosphate [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 3393-18-8 3.33E+02 1.37E+02 3.32E+02 C10H13N4O7P C06196 ko00230,ko01232 LysoPC 18:3(2n isomer) [M+H]+ Lipids LPC - 5.18E+02 1.84E+02 5.17E+02 C26H48NO7P - - Fragransin B3 [M+H]+ Lignans and Coumarins Lignans - 4.05E+02 2.51E+02 4.04E+02 C22H28O7 - - Peucedanol 7-O-glucoside [M+H]+ Lignans and Coumarins Coumarins 65853-04-5 4.27E+02 2.65E+02 4.26E+02 C20H26O10 - - Machilusol A* [M+H]+ Lignans and Coumarins Lignans - 3.57E+02 2.03E+02 3.56E+02 C21H24O5 - - δ-Guanidinovaleric acid [M+H]+ Organic acids Organic acids 462-93-1 1.60E+02 1.14E+02 1.59E+02 C6H13N3O2 - - Guanosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 118-00-3 2.84E+02 1.52E+02 2.83E+02 C10H13N5O5 C00387 ko00230,ko01100,ko01232,ko02010 Adenosine* [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 58-61-7 2.68E+02 1.36E+02 2.67E+02 C10H13N5O4 C00212 ko00230,ko01100,ko01232,ko02010,ko04022,ko04024,ko04071,ko04080,ko04270,ko04923,ko04924,ko05012,ko05032,ko05034 14-Amino-15-hydroxy-11-methylpentadecanoic acid [M+H]+ Lipids Sphingolipids - 2.88E+02 8.81E+01 2.87E+02 C16H33NO3 - - Lys-Thr [M+H]+ Amino acids and derivatives Amino acids and derivatives 97791-84-9 2.48E+02 8.41E+01 2.47E+02 C10H21N3O4 - - Oxaceprol [M+H]+ Amino acids and derivatives Amino acids and derivatives 33996-33-7 1.74E+02 8.61E+01 1.73E+02 C7H11NO4 - - N-Acetyl-D-galactosamine [M+H]+ Others Saccharides 1811-31-0 2.22E+02 8.41E+01 2.21E+02 C8H15NO6 C01132 ko00052,ko00520,ko01100,ko01250,ko02060 (2-Oxo-5-methoxyindoline-1-yl)carbamic acidmethylester [M+H]+ Alkaloids Alkaloids - 2.37E+02 1.62E+02 2.36E+02 C11H12N2O4 - - Prolylproline [M+H]+ Amino acids and derivatives Amino acids and derivatives 20488-28-2 2.13E+02 7.01E+01 2.12E+02 C10H16N2O3 - - 2-Amino-7-methyltridecan-1-ol* [M+H]+ Lipids Sphingolipids - 2.30E+02 6.21E+01 2.29E+02 C14H31NO - - Horsfieldin* [M+H]+ Lignans and Coumarins Lignans - 3.57E+02 3.07E+02 3.56E+02 C20H20O6 - - Diethanolamine [M+H]+ Alkaloids Alkaloids 111-42-2 1.06E+02 8.81E+01 1.05E+02 C4H11NO2 C06772 ko00564 Phenylacetaldehyde [M+H]+ Phenolic acids Phenolic acids 122-78-1 1.21E+02 7.70E+01 1.20E+02 C8H8O C00601 ko00360,ko00643,ko01100,ko01120 Acetoxypinoresinol [M+H]+ Lignans and Coumarins Lignans 81426-14-4 4.17E+02 3.85E+02 4.16E+02 C22H24O8 - - Coccilignan A* [M+H]+ Lignans and Coumarins Lignans - 4.05E+02 1.67E+02 4.04E+02 C22H28O7 - - 24-Hydroxy-3-oxooleana-11,13(18)-dien-28-oic acid [M+H]+ Terpenoids Triterpene - 4.69E+02 4.23E+02 4.68E+02 C30H44O4 - - linoleoyl ethanolamine [M+H]+ Lipids LPE 68171-52-8 3.24E+02 6.21E+01 3.23E+02 C20H37NO2 - - Dihydrodehydrodiconiferyl alcohol [M+H]+ Lignans and Coumarins Lignans 126253-41-6 3.61E+02 1.89E+02 3.60E+02 C20H24O6 - - (2S)-5,7-dimethoxy-3',4'-methylenedioxyflavanone [M+H]+ Flavonoids Other Flavonoids - 3.29E+02 3.14E+02 3.28E+02 C18H16O6 - - 3-Ethyl-7-hydroxyphthalide [M+H]+ Others Others - 1.79E+02 1.19E+02 1.78E+02 C10H10O3 - - LysoPC 18:0 [M+H]+ Lipids LPC 19420-57-6 5.24E+02 1.84E+02 5.23E+02 C26H54NO7P - - Isorhamnetin-3-O-(2''-O-xylosyl)glucoside [M+H]+ Flavonoids Flavonols - 6.11E+02 3.17E+02 6.10E+02 C27H30O16 - - Chrysin-7-O-glucoside [M+H]+ Flavonoids Flavones 31025-53-3 4.17E+02 2.55E+02 4.16E+02 C21H20O9 - - 1-(2-Amino-4-methylpentanoyl)pyrrolidine-2-carboxylic acid [M+H]+ Amino acids and derivatives Amino acids and derivatives - 2.29E+02 1.16E+02 2.28E+02 C11H20N2O3 - - LysoPC 16:1* [M+H]+ Lipids LPC 76790-27-7 4.94E+02 1.84E+02 4.93E+02 C24H48NO7P - - LysoPC 18:2(2n isomer) [M+H]+ Lipids LPC - 5.20E+02 1.84E+02 5.19E+02 C26H50NO7P - - LysoPC 17:0(2n isomer)* [M+H]+ Lipids LPC - 5.10E+02 1.84E+02 5.09E+02 C25H52NO7P - - trans-1,2-dihydrodehydroguaiaretic acid [M+H]+ Lignans and Coumarins Lignans - 3.27E+02 2.03E+02 3.26E+02 C20H22O4 - - 4,6-dimethoxy-2-methoxyphenyl-1-O-beta-D-glucopyranoside [M+H]+ Phenolic acids Phenolic acids - 3.19E+02 1.25E+02 3.18E+02 C13H18O9 - - Gln-Gly [M+H]+ Amino acids and derivatives Amino acids and derivatives 2650-65-9 2.04E+02 8.40E+01 2.03E+02 C7H13N3O4 - - Creatinine [M+H]+ Organic acids Organic acids 60-27-5 1.14E+02 8.61E+01 1.13E+02 C4H7N3O C00791 ko00330,ko01100 N-Oleoylethanolamine [M+H]+ Alkaloids Alkaloids 111-58-0 3.26E+02 6.21E+01 3.25E+02 C20H39NO2 C20792 ko04024 5'-Deoxy-5'-(methylthio)adenosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 2457-80-9 2.98E+02 1.36E+02 2.97E+02 C11H15N5O3S C00170 ko00270,ko00908,ko01060,ko01100 3-hydroxy-1-methylpyrrolidin-2-one* [M+H]+ Alkaloids Pyrrole alkaloids 132996-63-5 1.16E+02 7.01E+01 1.15E+02 C5H9NO2 - - alpha-hexylcinnamaldehyde [M+H]+ Phenolic acids Phenolic acids 101-86-0 2.17E+02 1.29E+02 2.16E+02 C15H20O - - D-Pantothenic Acid* [M+H]+ Others Vitamin 79-83-4 2.20E+02 9.01E+01 2.19E+02 C9H17NO5 C00864 ko00410,ko00770,ko01100,ko01110,ko01240,ko04977 L-Homocysteine [M+H]+ Amino acids and derivatives Amino acids and derivatives 6027-13-0 1.36E+02 1.18E+02 1.35E+02 C4H9NO2S C00155 ko00270,ko00920,ko01100,ko01110,ko01230,ko01523,ko04621 4,4'-dihydroxy-2'-methoxychalcone [M+H]+ Flavonoids Chalcones - 2.71E+02 1.21E+02 2.70E+02 C16H14O4 - - Divanillyltetrahydrofuran [M+H]+ Lignans and Coumarins Lignans - 3.45E+02 1.37E+02 3.44E+02 C20H24O5 - - 2-Aminooctadecane-1,5,7,17-tetraol [M+H]+ Lipids Sphingolipids - 3.34E+02 8.81E+01 3.33E+02 C18H39NO4 - - 1,8-dimethyl-1,3a,8,8a-tetrahydropyrrolo[2,3-b]indole [M+H]+ Alkaloids Plumerane - 1.87E+02 1.44E+02 1.86E+02 C12H14N2 - - 2-Methyl-5-acetonyl-7-hydroxychromone glucoside [M+H]+ Others Chromone - 3.95E+02 2.33E+02 3.94E+02 C19H22O9 - - LysoPC 17:0* [M+H]+ Lipids LPC 50930-23-9 5.10E+02 1.84E+02 5.09E+02 C25H52NO7P - - LysoPC 17:1 [M+H]+ Lipids LPC - 5.08E+02 1.84E+02 5.07E+02 C25H50NO7P - - 4-MethoxycinnaMaldehyde [M+H]+ Others Aldehyde compounds 1963-36-6 1.63E+02 9.11E+01 1.62E+02 C10H10O2 C10475 - 10,11-Dihydroxy-N-(2-hydroxy-2-methylpropyl)-2,6,8-dodecatrienam-Ide [M+H]+ Alkaloids Alkaloids - 2.98E+02 1.61E+02 2.97E+02 C16H27NO4 - - 2-Aminotetradecane-1,5,11-triol [M+H]+ Lipids Sphingolipids - 2.62E+02 8.81E+01 2.61E+02 C14H31NO3 - - Succinyladenosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 4542-23-8 3.84E+02 2.52E+02 3.83E+02 C14H17N5O8 - - Dihydromonotropein methyl ester [M+H]+ Terpenoids Monoterpenoids - 4.07E+02 2.75E+02 4.06E+02 C17H26O11 - - 3,4,5-trihydroxy-6-(4-octylphenoxy)oxane-2-carboxylic acid [M+H]+ Phenolic acids Phenolic acids - 3.83E+02 2.67E+02 3.82E+02 C20H30O7 - - 4-Guanidinobutyric acid [M+H]+ Organic acids Organic acids 463-00-3 1.46E+02 8.70E+01 1.45E+02 C5H11N3O2 C01035 ko00330,ko01100 2,5-Bis(1,3-benzodioxol-5-yl)-3,4-dimethyloxolane-2,3-diol [M+H]+ Lignans and Coumarins Lignans - 3.73E+02 1.35E+02 3.72E+02 C20H20O7 - - Cytidine 5'-monophosphate(Cytidylic acid) [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 63-37-6 3.24E+02 1.12E+02 3.23E+02 C9H14N3O8P C00055 ko00240,ko01100,ko01232 L-Homocitrulline [M+H]+ Amino acids and derivatives Amino acids and derivatives 1190-49-4 1.90E+02 8.41E+01 1.89E+02 C7H15N3O3 C02427 - 2,6-Diaminooimelic acid [M+H]+ Organic acids Organic acids 583-93-7 1.91E+02 1.28E+02 1.90E+02 C7H14N2O4 C00666 ko00300,ko00470,ko01100,ko01110,ko01120,ko01230 7-Ethoxy-4-hydroxy-3,4-dihydroisochromen-1-one [M+H]+ Others Others - 2.09E+02 1.49E+02 2.08E+02 C11H12O4 - - 8-hydroxyquinoline [M+H]+ Alkaloids Quinoline alkaloids 148-24-3 1.46E+02 9.11E+01 1.45E+02 C9H7NO C19434 - 4,6-Dihydroxyquinoline [M+H]+ Alkaloids Quinoline alkaloids 3517-61-1 1.62E+02 1.16E+02 1.61E+02 C9H7NO2 C05639 ko00380,ko01100 5-Methoxyfurfural* [M+H]+ Others Aldehyde compounds 21300-07-2 1.27E+02 5.30E+01 1.26E+02 C6H6O3 - - 6-Hydroxy-7-Methoxy-2-[2-(3'-Hydroxy-4'-Methoxyphenyl)Ethyl]Chromone [M+H]+ Others Chromone - 3.43E+02 1.37E+02 3.42E+02 C19H18O6 - - p-Coumaroylcadaverine [M+H]+ Alkaloids Phenolamine - 2.49E+02 1.47E+02 2.48E+02 C14H20N2O2 - - LysoPE 16:0(2n isomer) [M+H]+ Lipids LPE - 4.54E+02 3.13E+02 4.53E+02 C21H44NO7P - - Clemaphenol A* [M+H]+ Lignans and Coumarins Lignans 362606-60-8 3.59E+02 3.27E+02 3.58E+02 C20H22O6 C17808 - L-Arginine [M+H]+ Amino acids and derivatives Amino acids and derivatives 74-79-3 1.75E+02 7.01E+01 1.74E+02 C6H14N4O2 C00062 ko00220,ko00261,ko00330,ko00331,ko00470,ko00970,ko00998,ko01060,ko01064,ko01100,ko01110,ko01230,ko02010,ko04150,ko04974,ko05014,ko05022,ko05142,ko05146,ko05230 4'-Hydroxy-5,6,7,8,3',5'-Hexamethoxyflavone O-Glucoside [M+H]+ Flavonoids Flavones - 5.81E+02 4.19E+02 5.80E+02 C27H32O14 - - 6,7-dimethoxy-2-[2-(4'-hydroxy-3'-methoxyphenyl)ethyl]chromone* [M+H]+ Others Chromone - 3.57E+02 3.07E+02 3.56E+02 C20H20O6 - - Vidarabine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 5536-17-4 2.68E+02 1.36E+02 2.67E+02 C10H13N5O4 - - L-Citrulline [M+H]+ Amino acids and derivatives Amino acids and derivatives 372-75-8 1.76E+02 1.13E+02 1.75E+02 C6H13N3O3 C00327 ko00220,ko01100,ko01110,ko01230 1-Methylguanidine [M+H]+ Alkaloids Alkaloids 471-29-4 7.41E+01 5.71E+01 7.31E+01 C2H7N3 C02294 - 1,7-bis(4-hydroxy-3-methoxyphenyl)hept-1-ene-3-ol [M+H]+ Phenolic acids Phenolic acids - 3.59E+02 1.37E+02 3.58E+02 C21H26O5 - - Lys-Asn [M+H]+ Amino acids and derivatives Amino acids and derivatives 19908-06-6 2.61E+02 8.41E+01 2.60E+02 C10H20N4O4 - - 2-Aminotetradecane-1,5,7,11-tetraol [M+H]+ Lipids Sphingolipids - 2.78E+02 8.81E+01 2.77E+02 C14H31NO4 - - 11-O-Vanilloylbergenin [M+H]+ Lignans and Coumarins Coumarins - 4.79E+02 1.51E+02 4.78E+02 C22H22O12 - - 2-AminoicoSane-1,5,7,19-tetraol [M+H]+ Lipids Sphingolipids - 3.62E+02 3.00E+02 3.61E+02 C20H43NO4 - - 8-hydroxy-1,4a-dimethyl-7-(prop-1-en-2-yl)-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one [M+H]+ Terpenoids Sesquiterpenoids - 2.35E+02 1.05E+02 2.34E+02 C15H22O2 - - 5-ethyl-6-hydroxy-7-((7-hydroxyhexahydro-1H-pyrrolizin-1-yl)methoxy)-6-methyl-7-oxoheptanoic acid [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.58E+02 1.58E+02 3.57E+02 C18H31NO6 - - LysoPE 18:0 [M+H]+ Lipids LPE 69747-55-3 4.82E+02 3.41E+02 4.81E+02 C23H48NO7P - - Histamine [M+H]+ Alkaloids Alkaloids 51-45-6 1.12E+02 9.51E+01 1.11E+02 C5H9N3 C00388 ko00340,ko01065,ko01100,ko01110,ko04080,ko04664,ko04721,ko04750,ko04971,ko04974,ko05310,ko07227 Acutissimalignan B* [M+H]+ Lignans and Coumarins Lignans - 3.57E+02 3.07E+02 3.56E+02 C20H20O6 - - 3,4,5-trihydroxy-5-[4-(prop-2-enoyloxymethyl)phenoxy]oxane-2-carboxylic acid [M+H]+ Phenolic acids Phenolic acids - 3.55E+02 1.92E+02 3.54E+02 C16H18O9 - - 2-Aminotetradecane-1,11,13-triol [M+H]+ Lipids Sphingolipids - 2.62E+02 8.81E+01 2.61E+02 C14H31NO3 - - L-Cystine [M+H]+ Amino acids and derivatives Amino acids and derivatives 56-89-3 2.41E+02 1.52E+02 2.40E+02 C6H12N2O4S2 C00491 ko00270,ko01100,ko02010,ko04216,ko04974 8-(P-Hydroxyphenyl)-Menthone [M+H]+ Terpenoids Monoterpenoids - 2.47E+02 2.01E+02 2.46E+02 C16H22O2 - - p-Coumaroyltyramine* [M+H]+ Alkaloids Phenolamine 36417-86-4 2.84E+02 1.21E+02 2.83E+02 C17H17NO3 - - 4-Hydroxysphinganine; Phytosphingosine [M+H]+ Lipids Sphingolipids 554-62-1 3.18E+02 6.00E+01 3.17E+02 C18H39NO3 C12144 ko00600,ko01100 O-phosphate-L-tyrosine [M+H]+ Amino acids and derivatives Amino acids and derivatives 21820-51-9 2.62E+02 2.16E+02 2.61E+02 C9H12NO6P C06501 - NG,NG-Dimethyl-L-arginine* [M+H]+ Amino acids and derivatives Amino acids and derivatives 30315-93-6 2.03E+02 7.01E+01 2.02E+02 C8H18N4O2 C03626 - Deoxypodophyllotoxin [M+H]+ Lignans and Coumarins Lignans 19186-35-7 3.99E+02 3.21E+02 3.98E+02 C22H22O7 - - 1-(9Z,12Z-Octadecadienoyl)-Sn-Glycero-3-Phosphocholine [M+H]+ Others Others 22252-07-9 5.20E+02 1.84E+02 5.19E+02 C26H50NO7P - - 1-(4-hydroxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-4-ene-3-heptanone [M+H]+ Others Ketone compounds - 3.27E+02 1.37E+02 3.26E+02 C20H22O4 - - 5-Hydroxymethylfurfural* [M+H]+ Others Aldehyde compounds 67-47-0 1.27E+02 5.30E+01 1.26E+02 C6H6O3 C11101 ko00365,ko01120 Senkyunolide K [M+H]+ Others Lactones 114569-33-4 2.09E+02 1.25E+02 2.08E+02 C12H16O3 - - γ-Glutamyl-L-valine [M+H]+ Amino acids and derivatives Amino acids and derivatives - 2.47E+02 1.84E+02 2.46E+02 C10H18N2O5 - - Dehydrodiconiferyl alcohol* [M+H]+ Lignans and Coumarins Lignans 4263-87-0 3.59E+02 3.27E+02 3.58E+02 C20H22O6 - - N-[3-(4-Hydroxyphenyl)acryloyl]-L-tyrosine [M+H]+ Amino acids and derivatives Amino acids and derivatives 77201-66-2 3.28E+02 1.19E+02 3.27E+02 C18H17NO5 - - Pyridoxine-5'-O-glucoside [M+H]+ Others Vitamin - 3.32E+02 1.52E+02 3.31E+02 C14H21NO8 C03996 - 2,5-Dimethyl pyrazine [M+H]+ Alkaloids Alkaloids 123-32-0 1.09E+02 6.70E+01 1.08E+02 C6H8N2 - - Kaempferol-4'-O-glucoside [M+H]+ Flavonoids Flavonols - 4.49E+02 2.87E+02 4.48E+02 C21H20O11 - - Umbelliferone 7-O-Rutinoside [M+H]+ Lignans and Coumarins Coumarins - 4.71E+02 1.63E+02 4.70E+02 C21H26O12 - - antioxidant [M+H]+ Lignans and Coumarins Lignans - 4.05E+02 1.37E+02 4.04E+02 C22H28O7 - - Adenosine 5'-monophosphate [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 61-19-8 3.48E+02 1.36E+02 3.47E+02 C10H14N5O7P C00020 ko00230,ko00908,ko01060,ko01065,ko01070,ko01100,ko01110,ko01232,ko01240,ko01523,ko04022,ko04024,ko04068,ko04150,ko04151,ko04152,ko04211,ko04740,ko04742,ko04923,ko04924,ko04925,ko04927,ko04928,ko04934,ko05012,ko05022,ko05032 2-(Dimethylamino)guanosine* [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 2140-67-2 3.12E+02 1.80E+02 3.11E+02 C12H17N5O5 - - N6-(2-Hydroxyethyl)adenosine* [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 4338-48-1 3.12E+02 1.80E+02 3.11E+02 C12H17N5O5 - - Piperidine [M+H]+ Alkaloids Piperidine alkaloids 110-89-4 8.61E+01 6.91E+01 8.51E+01 C5H11N C01746 ko00960,ko04974 Chloranthatone [M+H]+ Terpenoids Sesquiterpenoids - 2.47E+02 1.45E+02 2.46E+02 C16H22O2 - - Trimethyllysine [M+H]+ Amino acids and derivatives Amino acids and derivatives 23284-33-5 1.89E+02 8.41E+01 1.88E+02 C9H20N2O2 C03793 ko00310,ko01100 LysoPE 16:0 [M+H]+ Lipids LPE 53862-35-4 4.54E+02 3.13E+02 4.53E+02 C21H44NO7P - - Arg-Gly [M+H]+ Amino acids and derivatives Amino acids and derivatives 108347-93-9 2.32E+02 7.01E+01 2.31E+02 C8H17N5O3 - - N-(4-Aminobutyl)benzamide [M+H]+ Alkaloids Alkaloids 5692-23-9 1.93E+02 1.05E+02 1.92E+02 C11H16N2O - - 11β-Hydroxy-8,15-isopimaradiene-4-one(ISO3) [M+H]+ Terpenoids Ditepenoids - 3.03E+02 2.57E+02 3.02E+02 C20H30O2 - - 3-(Allylsulphinyl)-L-alanine [M+H]+ Amino acids and derivatives Amino acids and derivatives 17795-26-5 1.78E+02 8.80E+01 1.77E+02 C6H11NO3S - - Apiosylskimmin (Adicardin) [M+H]+ Lignans and Coumarins Coumarins 103529-94-8 4.57E+02 1.63E+02 4.56E+02 C20H24O12 - - Pro-Asp [M+H]+ Amino acids and derivatives Amino acids and derivatives 85227-98-1 2.31E+02 7.01E+01 2.30E+02 C9H14N2O5 - - 3-(3-Hydroxyphenyl)-propionic acid [M+H]+ Phenolic acids Phenolic acids 621-54-5 1.67E+02 1.23E+02 1.66E+02 C9H10O3 C11457 ko00360,ko01100,ko01120,ko01220 Lariciresinol acetate [M+H]+ Lignans and Coumarins Lignans 79114-77-5 4.03E+02 1.93E+02 4.02E+02 C22H26O7 - - 2-AminoicoSane-1,6,18,19,20-pentaol [M+H]+ Lipids Sphingolipids - 3.78E+02 2.86E+02 3.77E+02 C20H43NO5 - - Triethyl citrate [M+H]+ Organic acids Organic acids 77-93-0 2.77E+02 1.15E+02 2.76E+02 C12H20O7 - - 4'-Methoxyacetophenone [M+H]+ Others Ketone compounds 100-06-1 1.51E+02 1.05E+02 1.50E+02 C9H10O2 - - Massoniresinol; Vladinol A [M+H]+ Lignans and Coumarins Lignans 96087-10-4 3.93E+02 1.51E+02 3.92E+02 C20H24O8 - - 5-Hydroxytryptophol [M+H]+ Alkaloids Plumerane 154-02-9 1.78E+02 1.60E+02 1.77E+02 C10H11NO2 - - Cycloolivil [M+H]+ Lignans and Coumarins Lignans 3064-05-9 3.77E+02 1.21E+02 3.76E+02 C20H24O7 - - N6-(4-hydroxybenzyl)adenine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 80054-30-4 2.42E+02 1.36E+02 2.41E+02 C12H11N5O - - (7'R,8'R)-7'8'-dihydro-7'-(5'-hydroxy-3'-methoxphenyl)-3-methoxy-8'-methyl-1-(E)-propenylbenzof-uran [M+H]+ Lignans and Coumarins Lignans - 3.27E+02 1.37E+02 3.26E+02 C20H22O4 - - Pro-Asn [M+H]+ Amino acids and derivatives Amino acids and derivatives 107856-82-6 2.30E+02 7.01E+01 2.29E+02 C9H15N3O4 - - L-Leucyl-L-Leucine [M+H]+ Amino acids and derivatives Amino acids and derivatives 3303-31-9 2.45E+02 8.61E+01 2.44E+02 C12H24N2O3 - - 3ξ-(1ξ-hydroxyethyl)-7-hydroxy-1-isobenzofuranone [M+H]+ Others Others - 1.95E+02 1.63E+02 1.94E+02 C10H10O4 - - 6-Hydroxypseudooxynicotine O-glucoside [M+H]+ Alkaloids Pyridine alkaloids - 3.57E+02 1.95E+02 3.56E+02 C16H24N2O7 - - Myrtucommulone B [M+H]+ Others Others 54247-23-3 4.15E+02 1.19E+02 4.14E+02 C24H30O6 - - 3-Hydroxy-L-phenylalanine* [M+H]+ Amino acids and derivatives Amino acids and derivatives 587-33-7 1.82E+02 1.36E+02 1.81E+02 C9H11NO3 - - 6,9-Dihydroxy-7-megastigmen-3-one [M+H]+ Terpenoids Sesquiterpenoids - 2.27E+02 1.21E+02 2.26E+02 C13H22O3 - - Elaidolinolenic acid [M+H]+ Phenolic acids Phenolic acids 28290-79-1 2.79E+02 8.11E+01 2.78E+02 C18H30O2 - - Cycloleucine [M+H]+ Amino acids and derivatives Amino acids and derivatives 52-52-8 1.30E+02 8.41E+01 1.29E+02 C6H11NO2 C03969 - 2-aminodocoSane-1,6,19,20,21-pentaol [M+H]+ Lipids Sphingolipids - 4.06E+02 3.00E+02 4.05E+02 C22H47NO5 - - Pyroglutamic acid [M+H]+ Amino acids and derivatives Amino acids and derivatives 4042-36-8 1.30E+02 8.41E+01 1.29E+02 C5H7NO3 - - 9-Oxooctadeca-10,12-Dienoic Acid [M+H]+ Lipids Free fatty acids - 2.95E+02 8.11E+01 2.94E+02 C18H30O3 - - Barbituric acid;Malonylurea;2,4,6-Pyrimidinetrione [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 67-52-7 1.29E+02 6.90E+01 1.28E+02 C4H4N2O3 C00813 ko00240,ko01100 Phe-Ser [M+H]+ Amino acids and derivatives Amino acids and derivatives 16053-39-7 2.53E+02 1.20E+02 2.52E+02 C12H16N2O4 - - 3,4,5-Trihydroxy-6-[1-(4-methoxyphenyl)pentan-3-yloxy]oxane-2-carboxylic acid* [M+H]+ Phenolic acids Phenolic acids - 3.71E+02 3.53E+02 3.70E+02 C18H26O8 - - L-Valine* [M+H]+ Amino acids and derivatives Amino acids and derivatives 72-18-4 1.18E+02 7.21E+01 1.17E+02 C5H11NO2 C00183 ko00280,ko00290,ko00311,ko00460,ko00770,ko00966,ko00970,ko01060,ko01063,ko01100,ko01110,ko01210,ko01230,ko01240,ko02010,ko04974,ko04978,ko05230 S-(Methyl)glutathione [M+H]+ Amino acids and derivatives Amino acids and derivatives 2922-56-7 3.22E+02 1.30E+02 3.21E+02 C11H19N3O6S C11347 - 2,3-Dihydroxyurs-12,18-dien-28-oic acid (Goreishic Acid I) [M+H]+ Terpenoids Triterpene - 4.71E+02 4.35E+02 4.70E+02 C30H46O4 - - LysoPC 17:2 [M+H]+ Lipids LPC - 5.06E+02 1.84E+02 5.05E+02 C25H48NO7P - - 2-Aminododecane-1,4-diol [M+H]+ Lipids Sphingolipids - 2.18E+02 8.81E+01 2.17E+02 C12H27NO2 - - Butyl beta-D-glucoside [M+H]+ Others Saccharides 5391-18-4 2.37E+02 9.90E+01 2.36E+02 C10H20O6 - - Xylocarpin I [M+H]+ Terpenoids Triterpene - 7.45E+02 3.87E+02 7.44E+02 C37H44O16 - - Isolariciresinol-9-O-glucoside [M+H]+ Lignans and Coumarins Lignans - 5.23E+02 1.37E+02 5.22E+02 C26H34O11 - - L-Phenylalaninol [M+H]+ Amino acids and derivatives Amino acids and derivatives 3182-95-4 1.52E+02 9.11E+01 1.51E+02 C9H13NO - - p-Coumaroylputrescine [M+H]+ Alkaloids Phenolamine 34136-53-3 2.35E+02 1.47E+02 2.34E+02 C13H18N2O2 C18326 ko00330,ko01100 Methyldopa [M+H]+ Amino acids and derivatives Amino acids and derivatives 555-30-6 2.12E+02 1.66E+02 2.11E+02 C10H13NO4 C07194 - 9,12-Octadecadien-6-Ynoic Acid [M+H]+ Lipids Free fatty acids 61481-29-6 2.77E+02 9.31E+01 2.76E+02 C18H28O2 - - 2-Methoxy-4-ethenylphenol [M+H]+ Phenolic acids Phenolic acids 7786-61-0 1.51E+02 9.11E+01 1.50E+02 C9H10O2 C17883 - 3-(4-methoxyphenyl)propyl methyl 4-O-methyl-alpha-d-glucopyranosiduronate* [M+H]+ Phenolic acids Phenolic acids - 3.71E+02 3.53E+02 3.70E+02 C18H26O8 - - 2,4-Hexadienoic acid [M+H]+ Organic acids Organic acids 110-44-1 1.13E+02 6.71E+01 1.12E+02 C6H8O2 - - D-Ornithine [M+H]+ Amino acids and derivatives Amino acids and derivatives 348-66-3 1.33E+02 7.01E+01 1.32E+02 C5H12N2O2 - - Ala-Ser [M+H]+ Amino acids and derivatives Amino acids and derivatives 3303-41-1 1.77E+02 1.06E+02 1.76E+02 C6H12N2O4 - - 3,4'-Dihydroxy-3',5'-dimethoxypropiophenone [M+H]+ Others Ketone compounds 136196-47-9 2.27E+02 1.81E+02 2.26E+02 C11H14O5 - - LysoPC 15:1 [M+H]+ Lipids LPC - 4.80E+02 1.84E+02 4.79E+02 C23H46NO7P - - 3'-Deoxy-4-O-methylsappanol [M+H]+ Others Alcohol compounds - 3.03E+02 1.23E+02 3.02E+02 C16H14O6 - - O-Acetyl-L-homoserine [M+H]+ Amino acids and derivatives Amino acids and derivatives 250736-84-6 1.62E+02 5.61E+01 1.61E+02 C6H11NO4 - - 4-Hydroxy-L-phenylglycine [M+H]+ Amino acids and derivatives Amino acids and derivatives 32462-30-9 1.68E+02 1.23E+02 1.67E+02 C8H9NO3 - - Thr-Thr [M+H]+ Amino acids and derivatives Amino acids and derivatives - 2.21E+02 7.41E+01 2.20E+02 C8H16N2O5 - - fragransin A2* [M+H]+ Lignans and Coumarins Lignans - 3.45E+02 1.37E+02 3.44E+02 C20H24O5 - - Octadeca-2,9,12,15-tetraen-1-ol [M+H]+ Others Others - 2.63E+02 8.11E+01 2.62E+02 C18H30O - - Alnusonol [M+H]+ Phenolic acids Phenolic acids 52330-12-8 3.13E+02 1.51E+02 3.12E+02 C19H20O4 - - Ser-HoPhe-OH [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.89E+02 3.71E+02 3.88E+02 C19H20N2O7 - - N-p-Coumaroyloctopamine [M+H]+ Alkaloids Phenolamine 66648-45-1 3.00E+02 2.82E+02 2.99E+02 C17H17NO4 - - (2S)-2-[(1R)-1-carboxyethoxy]propanoic acid [M+H]+ Organic acids Organic acids - 1.63E+02 6.90E+01 1.62E+02 C6H10O5 - - alpha-Asarone* [M+H]+ Phenolic acids Phenolic acids 2883-98-9 2.09E+02 1.79E+02 2.08E+02 C12H16O3 - - saikolignanoside D* [M+H]+ Lignans and Coumarins Lignans - 5.21E+02 1.31E+02 5.20E+02 C26H32O11 - - 2-Aminododecane-1,3,4-triol [M+H]+ Lipids Sphingolipids - 2.34E+02 8.81E+01 2.33E+02 C12H27NO3 - - γ-Glutamyltyrosine [M+H]+ Amino acids and derivatives Amino acids and derivatives 7432-23-7 3.11E+02 1.65E+02 3.10E+02 C14H18N2O6 - - Lys-Phe [M+H]+ Amino acids and derivatives Amino acids and derivatives 6235-35-4 2.94E+02 8.41E+01 2.93E+02 C15H23N3O3 - - LysoPC 18:3 [M+H]+ Lipids LPC - 5.18E+02 1.84E+02 5.17E+02 C26H48NO7P - - Riboprine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 7724-76-7 3.36E+02 1.48E+02 3.35E+02 C15H21N5O4 C16427 ko00908,ko01110 N-Methyltryptamine [M+H]+ Alkaloids Plumerane 61-49-4 1.75E+02 1.44E+02 1.74E+02 C11H14N2 C06213 ko00380,ko01100 3-hydroxybenzaldehyde [M+H]+ Phenolic acids Phenolic acids 100-83-4 1.23E+02 7.70E+01 1.22E+02 C7H6O2 C03067 ko00623,ko01120,ko01220 Chrysosplenoside C-O-glucoside [M+H]+ Flavonoids Flavones - 6.85E+02 5.23E+02 6.84E+02 C30H36O18 - - 1-α-Linolenoyl-glycerol* [M+H]+ Lipids Glycerol ester - 3.53E+02 2.61E+02 3.52E+02 C21H36O4 - - Allopurinol [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 315-30-0 1.37E+02 1.10E+02 1.36E+02 C5H4N4O - - Stearidonic acid [M+H]+ Lipids Free fatty acids 20290-75-9 2.77E+02 1.49E+02 2.76E+02 C18H28O2 C16300 ko00592,ko01110 Glu-Arg [M+H]+ Amino acids and derivatives Amino acids and derivatives 7219-59-2 3.04E+02 1.75E+02 3.03E+02 C11H21N5O5 - - 4-Hydroxymandelonitrile [M+H]+ Alkaloids Phenolamine 13093-65-7 1.50E+02 6.10E+01 1.49E+02 C8H7NO2 C00650 - sanshodiol [M+H]+ Lignans and Coumarins Lignans - 3.59E+02 1.37E+02 3.58E+02 C20H22O6 - - dehydroconiferyl alcohol [M+H]+ Others Others - 1.79E+02 9.11E+01 1.78E+02 C10H10O3 - - Pyridoxal [M+H]+ Others Vitamin 66-72-8 1.68E+02 1.50E+02 1.67E+02 C8H9NO3 C00250 ko00750,ko01100,ko01120,ko01240,ko04977 Chrysin [M+H]+ Flavonoids Flavones 480-40-0 2.55E+02 1.53E+02 2.54E+02 C15H10O4 C10028 ko00941 Methyl (6-O-4-hydroxybenzoyl)-α-D-glucoside [M+H]+ Phenolic acids Phenolic acids - 3.15E+02 1.63E+02 3.14E+02 C14H18O8 - - Isonicotinic acid [M+H]+ Others Vitamin 55-22-1 1.24E+02 8.01E+01 1.23E+02 C6H5NO2 C07446 ko00983 N7-Methylguanosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 20244-86-4 2.98E+02 1.66E+02 2.97E+02 C11H15N5O5 C20674 - Isocytosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 108-53-2 1.12E+02 7.00E+01 1.11E+02 C4H5N3O - - N,N'-Dimethylarginine;SDMA* [M+H]+ Amino acids and derivatives Amino acids and derivatives 30344-00-4 2.03E+02 7.01E+01 2.02E+02 C8H18N4O2 - - Gln-Ser-Tyr [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.97E+02 1.37E+02 3.96E+02 C17H24N4O7 - - L-Lysine [M+H]+ Amino acids and derivatives Amino acids and derivatives 56-87-1 1.47E+02 8.41E+01 1.46E+02 C6H14N2O2 C00047 ko00300,ko00310,ko00470,ko00780,ko00960,ko00970,ko00997,ko01060,ko01064,ko01100,ko01110,ko01120,ko01210,ko01230,ko02010,ko04974 Isopentenyladenine-7-N-glucoside [M+H]+ Nucleotides and derivatives Nucleotides and derivatives - 3.66E+02 2.04E+02 3.65E+02 C16H23N5O5 - - Glycyl-L-leucine [M+H]+ Amino acids and derivatives Amino acids and derivatives - 1.89E+02 8.61E+01 1.88E+02 C8H16N2O3 - - Grevilloside E [M+H]+ Phenolic acids Phenolic acids - 3.59E+02 1.79E+02 3.58E+02 C16H22O9 - - Lepadin D [M+H]+ Alkaloids Quinoline alkaloids - 2.98E+02 1.41E+02 2.97E+02 C18H35NO2 - - 3-Hydroxy-23-oxoolean-12-en-28-oic acid (Gypsogenin) [M+H]+ Terpenoids Triterpene - 4.71E+02 4.25E+02 4.70E+02 C30H46O4 - - Xanthurenate-8-O-beta-D-glucoside [M+H]+ Alkaloids Alkaloids - 3.68E+02 2.06E+02 3.67E+02 C16H17NO9 - - β-Nicotinamide mononucleotide [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 1094-61-7 3.35E+02 1.23E+02 3.34E+02 C11H15N2O8P C00455 ko00760,ko01100 Hedyotol C [M+H]+ Lignans and Coumarins Lignans - 5.85E+02 3.59E+02 5.84E+02 C31H36O11 - - (R)-Mandelamide [M+H]+ Alkaloids Alkaloids 24008-62-6 1.52E+02 1.06E+02 1.51E+02 C8H9NO2 C07301 ko00627,ko01120 3,4-Methylenedioxy cinnamyl alcohol* [M+H]+ Others Alcohol compounds 17581-86-1 1.79E+02 9.11E+01 1.78E+02 C10H10O3 - - O-benzyl-L-serine [M+H]+ Amino acids and derivatives Amino acids and derivatives 4726-96-9 1.96E+02 1.20E+02 1.95E+02 C10H13NO3 - - 2,4,6-Trihydroxybenzoic acid [M+H]+ Phenolic acids Phenolic acids 83-30-7 1.71E+02 8.10E+01 1.70E+02 C7H6O5 - - Dihydroisopelletierine [M+H]+ Alkaloids Piperidine alkaloids - 1.44E+02 8.41E+01 1.43E+02 C8H17NO - - 7-Hydroxycoumarin;Umbelliferone [M+H]+ Lignans and Coumarins Coumarins 93-35-6 1.63E+02 8.90E+01 1.62E+02 C9H6O3 C09315 ko00999,ko01061,ko01110 1-Methylhistidine [M+H]+ Amino acids and derivatives Amino acids and derivatives 332-80-9 1.70E+02 1.24E+02 1.69E+02 C7H11N3O2 - - (1-Acetyl-5-methoxyindoline-2-yl)acetonitrile [M+H]+ Alkaloids Alkaloids - 2.31E+02 2.16E+02 2.30E+02 C13H14N2O2 - - Nicotinic acid (Vitamin B3) [M+H]+ Others Vitamin 59-67-6 1.24E+02 7.80E+01 1.23E+02 C6H5NO2 C00253 ko00760,ko00960,ko01060,ko01064,ko01100,ko01110,ko01120,ko01240,ko05133 Fargesin* [M+H]+ Lignans and Coumarins Lignans 31008-19-2 3.71E+02 1.67E+02 3.70E+02 C21H22O6 C16957 - LysoPE 18:2 [M+H]+ Lipids LPE - 4.78E+02 3.37E+02 4.77E+02 C23H44NO7P - - 6-Methylnicotinamide [M+H]+ Alkaloids Pyridine alkaloids 6960-22-1 1.37E+02 6.50E+01 1.36E+02 C7H8N2O - - N,N-Dimethylformamide [M+H]+ Alkaloids Alkaloids 68-12-2 7.41E+01 4.60E+01 7.31E+01 C3H7NO C03134 - Hispanolone [M+H]+ Terpenoids Ditepenoids 18676-07-8 3.19E+02 3.01E+02 3.18E+02 C20H30O3 - - Monolinolenin* [M+H]+ Lipids Glycerol ester 75685-85-7 3.53E+02 2.61E+02 3.52E+02 C21H36O4 - - 5,8-Dihydroxy-1,4-naphthoquinone [M+H]+ Quinones Quinones 475-38-7 1.91E+02 1.21E+02 1.90E+02 C10H6O4 - - (S)-2-Phenyloxirane [M+H]+ Phenolic acids Phenolic acids 20780-54-5 1.21E+02 7.70E+01 1.20E+02 C8H8O C20782 ko00643,ko01100,ko01120 11,12-epoxy-13-hydroxy-3-Oxooleanane-28-oic acid gamma-lactone (Liquidambaric Lactone) [M+H]+ Terpenoids Triterpene 185051-75-6 4.69E+02 4.23E+02 4.68E+02 C30H44O4 - - α-Conidendrin [M+H]+ Others Others - 3.57E+02 1.37E+02 3.56E+02 C20H20O6 - - N-Acetylcadaverine [M+H]+ Alkaloids Alkaloids 32343-73-0 1.45E+02 8.61E+01 1.44E+02 C7H16N2O - - Magnolin [M+H]+ Lignans and Coumarins Lignans 31008-18-1 4.17E+02 1.67E+02 4.16E+02 C23H28O7 C06515 - N-Glucosyl-p-coumaroylputrescine [M+H]+ Alkaloids Phenolamine - 3.97E+02 1.47E+02 3.96E+02 C19H28N2O7 - - L-Seryl-L-Isoleucine [M+H]+ Amino acids and derivatives Amino acids and derivatives 91086-51-0 2.19E+02 6.00E+01 2.18E+02 C9H18N2O4 - - Putrescine [M+H]+ Alkaloids Alkaloids 110-60-1 8.91E+01 7.21E+01 8.81E+01 C4H12N2 C00134 ko00330,ko00470,ko00480,ko00960,ko01060,ko01064,ko01100,ko01110,ko02010,ko04974 Methyl 8,9-epoxypimaran-18-oate [M+H]+ Terpenoids Terpene 42855-38-9 3.35E+02 3.35E+02 3.34E+02 C21H34O3 - - 2-Phenylethy-1-O-β-D-glucoside [M+H]+ Phenolic acids Phenolic acids 18997-54-1 2.85E+02 1.23E+02 2.84E+02 C14H20O6 - - 4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid [M+H]+ Alkaloids Quinoline alkaloids 73776-24-6 2.06E+02 1.60E+02 2.05E+02 C10H7NO4 - - 3-amino-2-naphthoic acid* [M+H]+ Alkaloids Alkaloids - 1.88E+02 1.18E+02 1.87E+02 C11H9NO2 - - Dihydroferuloylputrescine [M+H]+ Alkaloids Phenolamine - 2.67E+02 1.79E+02 2.66E+02 C14H22N2O3 - - Dimethyl phthalate [M+H]+ Phenolic acids Phenolic acids 131-11-3 1.95E+02 1.63E+02 1.94E+02 C10H10O4 C11233 - 3,7-Dihydroxychromen-4-one [M+H]+ Others Chromone - 1.79E+02 7.70E+01 1.78E+02 C9H6O4 - - 5-Acetonyl-6-glucosyl-7-hydroxy-2,6-methylchromone [M+H]+ Others Chromone - 4.11E+02 2.49E+02 4.10E+02 C19H22O10 - - 3,5-Dimethoxy-4-hydroxybenzaldehyde [M+H]+ Others Aldehyde compounds - 1.83E+02 9.11E+01 1.82E+02 C9H10O4 - - 2,4,2',4'-tetrahydroxy-3'-prenylchalcone [M+H]+ Flavonoids Chalcones - 3.41E+02 1.37E+02 3.40E+02 C20H20O5 - - 3,4-Secodammara-4(28),20,24-trien-3,26-dioic acid [M+H]+ Terpenoids Triterpene - 4.71E+02 4.07E+02 4.70E+02 C30H46O4 - - 2-tert-Butyl-1,4-benzoquinone [M+H]+ Quinones Quinones - 1.65E+02 1.19E+02 1.64E+02 C10H12O2 - - Phe-Thr [M+H]+ Amino acids and derivatives Amino acids and derivatives 51352-44-4 2.67E+02 1.20E+02 2.66E+02 C13H18N2O4 - - saffloquinoside A [M+H]+ Flavonoids Chalcones - 5.95E+02 4.33E+02 5.94E+02 C27H30O15 - - Citroside A [M+H]+ Terpenoids Terpene 120330-44-1 3.87E+02 2.07E+02 3.86E+02 C19H30O8 - - Thr-Tyr [M+H]+ Amino acids and derivatives Amino acids and derivatives 145295-02-9 2.83E+02 1.36E+02 2.82E+02 C13H18N2O5 - - D-Panthenol [M+H]+ Others Alcohol compounds 81-13-0 2.06E+02 7.61E+01 2.05E+02 C9H19NO4 C05944 ko00770 Isosalipurposide-6''-O-p-coumaric acid [M+H]+ Flavonoids Chalcones - 5.81E+02 1.47E+02 5.80E+02 C30H28O12 - - osmanthuside F [M+H]+ Lignans and Coumarins Lignans - 3.17E+02 1.37E+02 3.16E+02 C14H20O8 - - Nicotinic acid adenine dinucleotide [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 53-84-9 6.64E+02 1.36E+02 6.63E+02 C21H27N7O14P2 C00003 ko00190,ko00730,ko00760,ko00983,ko01100,ko01240,ko04152,ko04211,ko04212,ko04925,ko04936,ko04977,ko05208 Scrophuside [M+H]+ Phenolic acids Phenolic acids 1621720-38-4 6.39E+02 3.39E+02 6.38E+02 C30H38O15 - - 5,7-dihydroxy-6-methyl-3-(2',4'-dihydroxybenzyl)-chroman-4-one [M+H]+ Flavonoids Other Flavonoids - 3.17E+02 1.23E+02 3.16E+02 C17H16O6 - - 8-Hydroxycoumarin [M+H]+ Lignans and Coumarins Coumarins 2442-31-1 1.63E+02 8.90E+01 1.62E+02 C9H6O3 - - 3-Hydroxy-beta-ionol 3-(6''-Malonyl)Glucoside [M+H]+ Others Others - 4.59E+02 2.11E+02 4.58E+02 C22H34O10 - - Ethyl phenylacetate [M+H]+ Phenolic acids Phenolic acids 101-97-3 1.65E+02 9.11E+01 1.64E+02 C10H12O2 - - Piperonal [M+H]+ Others Aldehyde compounds 120-57-0 1.51E+02 9.30E+01 1.50E+02 C8H6O3 C10812 - 3,4,5-Trihydroxy-6-[4-(4-methyl-3-oxopentyl)phenoxy]oxane-2-carboxylic acid [M+H]+ Phenolic acids Phenolic acids - 3.69E+02 2.07E+02 3.68E+02 C18H24O8 - - 5-Acetylsalicylic acid [M+H]+ Phenolic acids Phenolic acids 13110-96-8 1.81E+02 1.07E+02 1.80E+02 C9H8O4 - - 7-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-6-methoxychromen-2-one [M+H]+ Lignans and Coumarins Coumarins - 3.13E+02 1.89E+02 3.12E+02 C20H24O3 - - Hordenine [M+H]+ Alkaloids Phenolamine 539-15-1 1.66E+02 1.21E+02 1.65E+02 C10H15NO C06199 ko00350,ko01100 S-(5'-Adenosy)-L-homocysteine [M+H]+ Amino acids and derivatives Amino acids and derivatives 979-92-0 3.85E+02 2.50E+02 3.84E+02 C14H20N6O5S C00021 ko00270,ko01100,ko01230,ko01240,ko05208 Guanosine 5'-monophosphate [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 85-32-5 3.64E+02 1.52E+02 3.63E+02 C10H14N5O8P C00144 ko00230,ko01060,ko01065,ko01100,ko01232,ko01523,ko04022,ko04740,ko04742,ko04744 3-Methylxanthine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 1076-22-8 1.67E+02 1.24E+02 1.66E+02 C6H6N4O2 C16357 ko00232,ko01100,ko01110,ko01120 Grevilloside C [M+H]+ Phenolic acids Phenolic acids 1094004-47-3 3.73E+02 1.37E+02 3.72E+02 C17H24O9 - - Phellodendroside* [M+H]+ Flavonoids Flavanonols 40451-69-2 5.19E+02 3.57E+02 5.18E+02 C26H30O11 - - Isosakuranetin-7-O-glucoside (Isosakuranin) [M+H]+ Flavonoids Flavonols 491-69-0 4.49E+02 2.87E+02 4.48E+02 C22H24O10 - - Fragransin B1* [M+H]+ Lignans and Coumarins Lignans - 4.05E+02 1.67E+02 4.04E+02 C22H28O7 - - LysoPE 18:3 [M+H]+ Lipids LPE - 4.76E+02 3.35E+02 4.75E+02 C23H42NO7P - - Met-His [M+H]+ Amino acids and derivatives Amino acids and derivatives 14486-12-5 2.87E+02 1.86E+02 2.86E+02 C11H18N4O3S - - 3,4-Dimethoxybenzoic acid; Veratric acid [M+H]+ Phenolic acids Phenolic acids 93-07-2 1.83E+02 1.65E+02 1.82E+02 C9H10O4 - - Thr-Asn-Tyr [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.97E+02 1.19E+02 3.96E+02 C17H24N4O7 - - 8-Azaguanine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 134-58-7 1.53E+02 1.36E+02 1.52E+02 C4H4N6O - - mudanoside A [M+H]+ Phenolic acids Phenolic acids - 3.31E+02 1.25E+02 3.30E+02 C14H18O9 - - (R)-Citronellol [M+H]+ Others Alcohol compounds 1117-61-9 1.57E+02 5.51E+01 1.56E+02 C10H20O - - L-Alanyl-L-Phenylalanine [M+H]+ Amino acids and derivatives Amino acids and derivatives 3061-90-3 2.37E+02 1.20E+02 2.36E+02 C12H16N2O3 - - Comazaphilone D [M+H]+ Others Others - 3.87E+02 1.91E+02 3.86E+02 C21H22O7 - - Caffeyl fraxin [M+H]+ Lignans and Coumarins Coumarins - 5.33E+02 1.63E+02 5.32E+02 C25H24O13 - - Isorhamnetin-3-O-arabinoside [M+H]+ Flavonoids Flavonols - 4.49E+02 3.17E+02 4.48E+02 C21H20O11 - - Dihydroxy-dimethoxyflavone-7-O-glucoside* [M+H]+ Flavonoids Flavones - 4.77E+02 3.15E+02 4.76E+02 C23H24O11 - - Histidinol [M+H]+ Alkaloids Alkaloids 501-28-0 1.42E+02 1.24E+02 1.41E+02 C6H11N3O C00860 ko00340,ko01100,ko01110,ko01230 5-Methoxysalicylic acid [M+H]+ Phenolic acids Phenolic acids 2612-02-4 1.69E+02 9.51E+01 1.68E+02 C8H8O4 - - Nicotinic Acid Methyl Ester(Methyl Nicotinate) [M+H]+ Alkaloids Pyridine alkaloids 93-60-7 1.38E+02 7.80E+01 1.37E+02 C7H7NO2 - - Spermine [M+H]+ Alkaloids Alkaloids 71-44-3 2.03E+02 8.41E+01 2.02E+02 C10H26N4 C00750 ko00330,ko00410,ko00480,ko00770,ko01100,ko01240,ko04976 Trigonelline [M+H]+ Alkaloids Pyridine alkaloids 535-83-1 1.38E+02 9.41E+01 1.37E+02 C7H7NO2 C01004 ko00960 acetophenone [M+H]+ Others Others 98-86-2 1.21E+02 1.03E+02 1.20E+02 C8H8O C07113 ko00642,ko01120,ko01220 Inosine 5'-monophosphate [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 131-99-7 3.49E+02 1.37E+02 3.48E+02 C10H13N4O8P C00130 ko00230,ko01060,ko01065,ko01070,ko01100,ko01110,ko01232,ko01240,ko01523,ko04742 N1,N10-Dihydrocaffeoylspermidine [M+H]+ Alkaloids Phenolamine - 4.74E+02 2.22E+02 4.73E+02 C25H35O6N3 - - 2-Methyl-3-hydroxyindan-1-one [M+H]+ Others Others - 1.63E+02 1.03E+02 1.62E+02 C10H10O2 - - 4-Ethoxyphenol [M+H]+ Phenolic acids Phenolic acids 622-62-8 1.39E+02 6.50E+01 1.38E+02 C8H10O2 - - LysoPE 16:1(2n isomer)* [M+H]+ Lipids LPE - 4.52E+02 3.11E+02 4.51E+02 C21H42NO7P - - 14-Nor-β-patchoulane-1(5)-ene-2,4-dione [M+H]+ Terpenoids Sesquiterpenoids - 2.19E+02 1.59E+02 2.18E+02 C14H18O2 - - 2,4,6-Trihydroxybenzophenone [M+H]+ Others Others 3555-86-0 2.31E+02 1.53E+02 2.30E+02 C13H10O4 C06356 - S-(2-Carboxypropyl)cysteine [M+H]+ Amino acids and derivatives Amino acids and derivatives 6852-42-2 2.08E+02 1.19E+02 2.07E+02 C7H13NO4S - - L-Homocystine [M+H]+ Amino acids and derivatives Amino acids and derivatives 626-72-2 2.69E+02 1.36E+02 2.68E+02 C8H16N2O4S2 C01817 ko00270 L-Tyramine [M+H]+ Alkaloids Alkaloids 51-67-2 1.38E+02 7.70E+01 1.37E+02 C8H11NO C00483 ko00350,ko00680,ko00950,ko01060,ko01063,ko01100,ko01110,ko01240,ko04080,ko04974 Gardenin A glucoside [M+H]+ Flavonoids Flavones - 5.81E+02 4.19E+02 5.80E+02 C27H32O14 - - Acitretin [M+H]+ Others Vitamin 55079-83-9 3.27E+02 1.59E+02 3.26E+02 C21H26O3 - - coumarin [M+H]+ Lignans and Coumarins Coumarins - 1.47E+02 9.11E+01 1.46E+02 C9H6O2 - - 7-Methoxycoumarin [M+H]+ Lignans and Coumarins Coumarins 531-59-9 1.77E+02 1.21E+02 1.76E+02 C10H8O3 C09268 - N-Isobutyl-4,5-epoxy-2E-decaenamide [M+H]+ Alkaloids Alkaloids - 2.40E+02 5.71E+01 2.39E+02 C14H25NO2 - - Hydroxymethyl coumarin glucoside [M+H]+ Lignans and Coumarins Coumarins - 3.39E+02 1.77E+02 3.38E+02 C16H18O8 - - 2'-Deoxyadenosine-5'-monophosphate [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 653-63-4 3.32E+02 1.36E+02 3.31E+02 C10H14N5O6P C00360 ko00230,ko01100,ko01232 6-Hydroxy-lupane-20(29)-en-3-one-28-oic acid [M+H]+ Terpenoids Triterpene - 4.71E+02 4.07E+02 4.70E+02 C30H46O4 - - 4-Pyridoxic acid-O-glucoside [M+H]+ Others Vitamin - 3.46E+02 1.84E+02 3.45E+02 C14H19NO9 - - Jaceosidin-7-O-Glucoside [M+H]+ Flavonoids Flavones 25474-11-7 4.93E+02 3.31E+02 4.92E+02 C23H24O12 - - S-(5'-Adenosyl)-L-methionine [M+H]+ Amino acids and derivatives Amino acids and derivatives 29908-03-0 3.99E+02 2.50E+02 3.98E+02 C15H22N6O5S C00019 ko00261,ko00270,ko00330,ko00908,ko00999,ko01060,ko01070,ko01100,ko01110,ko01230,ko01240,ko04122,ko05208 Comazaphilone E [M+H]+ Others Others - 4.17E+02 1.91E+02 4.16E+02 C22H24O8 - - 1-phenyl-7-(4-hydroxyphenyl)-4-ene-3-heptanone [M+H]+ Others Ketone compounds - 2.81E+02 1.07E+02 2.80E+02 C19H20O2 - - Coumarin-3-carboxylic Acid [M+H]+ Lignans and Coumarins Coumarins 531-81-7 1.91E+02 1.73E+02 1.90E+02 C10H6O4 - - Cytosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 71-30-7 1.12E+02 9.50E+01 1.11E+02 C4H5N3O C00380 ko00240,ko01100,ko01232 5,6-Dihydro-5-methyluracil [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 696-04-8 1.29E+02 8.40E+01 1.28E+02 C5H8N2O2 C00906 - (2R)-4',7-dihydroxy-5-methoxy-8-methylflavanone [M+H]+ Flavonoids Flavanones - 3.01E+02 1.81E+02 3.00E+02 C17H16O5 - - L-Tyrosine methyl ester [M+H]+ Amino acids and derivatives Amino acids and derivatives 1080-06-4 1.96E+02 9.11E+01 1.95E+02 C10H13NO3 C03404 - 2-Palmitoylglycerol* [M+H]+ Lipids Glycerol ester 23470-00-0 3.31E+02 3.13E+02 3.30E+02 C19H38O4 - - Monopalmitin* [M+H]+ Lipids Glycerol ester 542-44-9 3.31E+02 3.13E+02 3.30E+02 C19H38O4 - - 6-hydroxy-2-[2-(3-hydroxy-4-methoxyphenyl)ethyl]chromone [M+H]+ Others Chromone - 3.13E+02 1.37E+02 3.12E+02 C18H16O5 - - LysoPC 19:2(2n isomer) [M+H]+ Lipids LPC - 5.34E+02 1.84E+02 5.33E+02 C27H52NO7P - - δ-Tocotrienol [M+H]+ Others Vitamin 25612-59-3 3.97E+02 1.47E+02 3.96E+02 C27H40O2 C14156 ko00130,ko01100,ko01110 Coniferaldehyde* [M+H]+ Others Aldehyde compounds 20649-42-7 1.79E+02 9.11E+01 1.78E+02 C10H10O3 C02666 ko00940,ko01061,ko01100,ko01110 Nopaline [M+H]+ Amino acids and derivatives Amino acids and derivatives 22350-70-5 3.05E+02 2.00E+02 3.04E+02 C11H20N4O6 C01682 ko00330,ko01100,ko02010 Mequinol [M+H]+ Phenolic acids Phenolic acids 150-76-5 1.25E+02 1.10E+02 1.24E+02 C7H8O2 - - 1-beta-D-Arabinofuranosyluracil [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 3083-77-0 2.45E+02 1.13E+02 2.44E+02 C9H12N2O6 - - 6-O-methylguanine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 20535-83-5 1.66E+02 1.24E+02 1.65E+02 C6H7N5O - - 1-(2,4,5-Trimethoxyphenyl)propan-1-one [M+H]+ Phenolic acids Phenolic acids 3904-18-5 2.25E+02 1.67E+02 2.24E+02 C12H16O4 - - 3,12-Dihydroxyoleanan-28,13-olide (Oleanderolide) [M+H]+ Terpenoids Triterpene - 4.73E+02 4.55E+02 4.72E+02 C30H48O4 - - Tectochrysin [M+H]+ Flavonoids Flavones 520-28-5 2.69E+02 2.26E+02 2.68E+02 C16H12O4 C11621 - Olean-12-ene-3,16-dione (Maniladione) [M+H]+ Terpenoids Triterpene - 4.39E+02 2.03E+02 4.38E+02 C30H46O2 - - N-(2-Hydroxy-4-methoxyphenyl)acetamide [M+H]+ Alkaloids Phenolamine 58469-06-0 1.82E+02 9.11E+01 1.81E+02 C9H11NO3 - - 3α,20β,21β-trihydroxy-16-oxo-serrat-14-en-24-oic acid [M+H]+ Terpenoids Triterpene - 5.03E+02 4.85E+02 5.02E+02 C30H46O6 - - L-Isoleucyl-L-Aspartate [M+H]+ Amino acids and derivatives Amino acids and derivatives - 2.47E+02 8.61E+01 2.46E+02 C10H18N2O5 - - Anthranilic Acid [M+H]+ Phenolic acids Phenolic acids 118-92-3 1.38E+02 9.21E+01 1.37E+02 C7H7NO2 C00108 ko00380,ko00400,ko00405,ko00621,ko00627,ko00996,ko00997,ko00998,ko00999,ko01060,ko01061,ko01063,ko01070,ko01100,ko01110,ko01120,ko01220,ko01230,ko07110 19-Hydroxy-3-oxo-24-norolean-12-en-28-oic acid [M+H]+ Terpenoids Triterpene - 4.71E+02 2.05E+02 4.70E+02 C30H46O4 - - L-Allo-isoleucine [M+H]+ Amino acids and derivatives Amino acids and derivatives 1509-34-8 1.32E+02 8.61E+01 1.31E+02 C6H13NO2 C21096 - (5-Methoxy-1,3-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetonitrile [M+H]+ Alkaloids Alkaloids - 2.31E+02 2.16E+02 2.30E+02 C13H14N2O2 - - 3-Hydroxy-1-methoxy-9,10-anthraquinone [M+H]+ Quinones Anthraquinone 28504-24-7 2.55E+02 1.81E+02 2.54E+02 C15H10O4 - - 3,4'-Dihydroxypropiophenone glucoside [M+H]+ Phenolic acids Phenolic acids - 3.29E+02 1.21E+02 3.28E+02 C15H20O8 - - N',N''-Diferuloylspermidine [M+H]+ Alkaloids Phenolamine - 4.98E+02 1.77E+02 4.97E+02 C27H35N3O6 - - davidioside B [M+H]+ Lignans and Coumarins Lignans - 4.93E+02 3.31E+02 4.92E+02 C25H32O10 - - 5-Hydroxy-DL-tryptophan(5-HTP) [M+H]+ Amino acids and derivatives Amino acids and derivatives 56-69-9 2.21E+02 1.30E+02 2.20E+02 C11H12N2O3 C01017 - Hovenic acid [M+H]+ Terpenoids Triterpene - 4.89E+02 2.01E+02 4.88E+02 C30H48O5 - - 4-((6S)-6-(furan-3-yl)-3-(hydroxymethyl)piperidin-2-yl)-2-methylbutan-2-ol [M+H]+ Alkaloids Terpenoid alkaloids - 2.68E+02 2.22E+02 2.67E+02 C15H25NO3 - - 4-hydroxyphenyl acrylaldehyde [M+H]+ Others Aldehyde compounds - 1.65E+02 1.19E+02 1.64E+02 C9H8O3 - - Scopoletin-7-O-glucoside (Scopolin) [M+H]+ Lignans and Coumarins Coumarins 531-44-2 3.55E+02 1.93E+02 3.54E+02 C16H18O9 C01527 ko00999,ko01061,ko01110 Tutin diacetate [M+H]+ Terpenoids Terpene 21416-52-4 3.79E+02 2.07E+02 3.78E+02 C19H22O8 - - Helicide [M+H]+ Phenolic acids Phenolic acids 80154-34-3 2.85E+02 1.23E+02 2.84E+02 C13H16O7 - - Isorhamnetin-3,7-O-diglucoside [M+H]+ Flavonoids Flavonols 6758-51-6 6.41E+02 4.79E+02 6.40E+02 C28H32O17 - - Bakuchicin [M+H]+ Lignans and Coumarins Coumarins 4412-93-5 1.87E+02 1.31E+02 1.86E+02 C11H6O3 - - 1-O-Caffeoylglycerol [M+H]+ Phenolic acids Phenolic acids - 2.55E+02 1.63E+02 2.54E+02 C12H14O6 - - N,N-cinnamoylbutanediamine* [M+H]+ Alkaloids Phenolamine - 2.19E+02 1.31E+02 2.18E+02 C13H18N2O - - LysoPC 20:2(2n isomer) [M+H]+ Lipids LPC - 5.48E+02 1.84E+02 5.47E+02 C28H54NO7P - - N-Trans-Cinnamoylputrescine [M+H]+ Alkaloids Phenolamine - 2.19E+02 1.31E+02 2.18E+02 C13H18N2O - - Pyridoxine [M+H]+ Others Vitamin 65-23-6 1.70E+02 1.34E+02 1.69E+02 C8H11NO3 C00314 ko00750,ko01100,ko01120,ko01240 6-C-MethylKaempferol-3-glucoside* [M+H]+ Flavonoids Flavones - 4.63E+02 3.01E+02 4.62E+02 C22H22O11 - - Secoisolariciresinol [M+H]+ Lignans and Coumarins Lignans 29388-59-8 3.63E+02 1.37E+02 3.62E+02 C20H26O6 C18167 ko00999,ko01061,ko01100,ko01110 Cimifugin [M+H]+ Others Chromone 37921-38-3 3.07E+02 2.35E+02 3.06E+02 C16H18O6 C09000 - Malonyl oleuropein [M+H]+ Terpenoids Monoterpenoids - 6.27E+02 1.37E+02 6.26E+02 C28H34O16 - - Ovafolinin E [M+H]+ Lignans and Coumarins Lignans - 4.17E+02 1.67E+02 4.16E+02 C22H24O8 - - Methyl Syringate [M+H]+ Phenolic acids Phenolic acids 884-35-5 2.13E+02 1.51E+02 2.12E+02 C10H12O5 - - Pyridoxine-5'-O-diglucoside [M+H]+ Others Vitamin - 4.94E+02 3.33E+02 4.93E+02 C20H31NO13 - - Pectolinarigenin-7-O-glucoside [M+H]+ Flavonoids Flavones - 4.77E+02 3.15E+02 4.76E+02 C23H24O11 - - 5-Aminolevulinic Acid* [M+H]+ Alkaloids Alkaloids 106-60-5 1.32E+02 8.61E+01 1.31E+02 C5H9NO3 C00430 ko00260,ko00860,ko01060,ko01100,ko01110,ko01120,ko01240,ko02010 Cytarabine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 147-94-4 2.44E+02 1.12E+02 2.43E+02 C9H13N3O5 C02961 - (4R)-4,5-dihydroxy-alpha-tetralone [M+H]+ Quinones Quinones - 1.79E+02 1.33E+02 1.78E+02 C10H10O3 - - Phloroglucinol; 1,3,5-Benzenetriol [M+H]+ Phenolic acids Phenolic acids 108-73-6 1.27E+02 8.10E+01 1.26E+02 C6H6O3 C02183 ko00627,ko00946,ko01100,ko01120 Guanine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 73-40-5 1.52E+02 1.35E+02 1.51E+02 C5H5N5O C00242 ko00230,ko01100,ko01232 N-Acetyl-D-mannosamine [M+H]+ Others Saccharides 7772-94-3 2.22E+02 1.38E+02 2.21E+02 C8H15NO6 C00645 ko00520,ko00541,ko01100,ko01250 Sakuraresinol [M+H]+ Lignans and Coumarins Lignans - 4.65E+02 3.61E+02 4.64E+02 C24H32O9 - - Glu-Ser [M+H]+ Amino acids and derivatives Amino acids and derivatives 5875-38-7 2.35E+02 1.18E+02 2.34E+02 C8H14N2O6 - - D-Glucosamine [M+H]+ Others Saccharides 3416-24-8 1.80E+02 1.63E+02 1.79E+02 C6H13NO5 C00329 ko00520,ko01100,ko01250,ko02060 Planteose [M+H]+ Others Saccharides 470-57-5 5.05E+02 1.27E+02 5.04E+02 C18H32O16 C03848 - Cytidine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 65-46-3 2.44E+02 1.12E+02 2.43E+02 C9H13N3O5 C00475 ko00240,ko01100,ko01232,ko02010 Ser-Val-Leu [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.18E+02 1.59E+02 3.17E+02 C14H27N3O5 - - S-Methyl-L-cysteine [M+H]+ Amino acids and derivatives Amino acids and derivatives 1187-84-4 1.36E+02 9.11E+01 1.35E+02 C4H9NO2S C22040 ko02010 Olivil Monoacetate [M+H]+ Lignans and Coumarins Lignans 1016974-78-9 4.19E+02 2.05E+02 4.18E+02 C22H26O8 - - 5,6,3',4'-Tetrahydroxy-3,7-dimethoxyflavone-6-O-glucoside [M+H]+ Flavonoids Flavones - 5.09E+02 3.47E+02 5.08E+02 C23H24O13 - - Isoguanine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 3373-53-3 1.52E+02 1.35E+02 1.51E+02 C5H5N5O - - 1-Oleoyl-Sn-Glycerol [M+H]+ Lipids Glycerol ester 129784-87-8 3.57E+02 2.65E+02 3.56E+02 C21H40O4 - - 5,2'-Dihydroxy-7,8-dimethoxyflavone glycoside* [M+H]+ Flavonoids Flavones - 4.77E+02 3.15E+02 4.76E+02 C23H24O11 - - 1-Cis-5-cis-germacrone [M+H]+ Terpenoids Sesquiterpenoids - 2.19E+02 1.59E+02 2.18E+02 C15H22O - - trachelosiaside [M+H]+ Others Others - 5.21E+02 3.11E+02 5.20E+02 C26H32O11 - - 2,5-Dimethoxybenzoquinone* [M+H]+ Quinones Quinones 3117-03-1 1.69E+02 6.50E+01 1.68E+02 C8H8O4 - - α-D-glucosyl-(1→1')-3'-amino-3'-deoxy-β-D-glucoside [M+H]+ Others Saccharides - 3.42E+02 1.62E+02 3.41E+02 C12H23NO10 - - 1-Methylxanthine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 6136-37-4 1.67E+02 1.10E+02 1.66E+02 C6H6N4O2 C16358 ko00232,ko01100,ko01110,ko01120 Galangin-7-O-glucoside [M+H]+ Flavonoids Flavones - 4.33E+02 2.71E+02 4.32E+02 C21H20O10 - - Dhurrin-6'-O-Glucoside [M+H]+ Alkaloids Phenolamine - 4.74E+02 3.12E+02 4.73E+02 C20H27NO12 - - Lys-Leu [M+H]+ Amino acids and derivatives Amino acids and derivatives 7369-79-1 2.60E+02 1.30E+02 2.59E+02 C12H25N3O3 - - N-Propionyl nornicotine [M+H]+ Alkaloids Pyridine alkaloids - 2.05E+02 1.49E+02 2.04E+02 C12H16N2O - - 5-Methylcytosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 554-01-8 1.26E+02 1.09E+02 1.25E+02 C5H7N3O C02376 ko00240,ko01100 Adenine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 73-24-5 1.36E+02 1.19E+02 1.35E+02 C5H5N5 C00147 ko00230,ko00908,ko01100,ko01110,ko01232 3,5-Dimethyl-2,3-dihydrobenzofuran [M+H]+ Others Others - 1.49E+02 1.21E+02 1.48E+02 C10H12O - - trans-Aconitic acid [M+H]+ Organic acids Organic acids 4023-65-8 1.75E+02 9.90E+01 1.74E+02 C6H6O6 C02341 ko00660,ko01100 4,8-Dihydroxy Naphthol-1-O-glucoside [M+H]+ Quinones Quinones - 3.39E+02 1.77E+02 3.38E+02 C16H18O8 - - 3,4-O-Dicaffeoylquinic Acid Methyl Ester* [M+H]+ Phenolic acids Phenolic acids - 5.31E+02 1.77E+02 5.30E+02 C26H26O12 - - 3,5-O-Dicaffeoylquinic Acid Methyl Ester* [M+H]+ Phenolic acids Phenolic acids 159934-13-1 5.31E+02 1.77E+02 5.30E+02 C26H26O12 - - p-Coumaric acid [M+H]+ Phenolic acids Phenolic acids 501-98-4 1.65E+02 1.19E+02 1.64E+02 C9H8O3 C00811 ko00130,ko00350,ko00940,ko00950,ko01061,ko01100,ko01110,ko01220 Thr-Asn-Asp [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.49E+02 1.51E+02 3.48E+02 C12H20N4O8 - - Balanophonin D glucoside [M+H]+ Lignans and Coumarins Lignans - 5.65E+02 1.67E+02 5.64E+02 C28H36O12 - - LysoPE 18:3(2n isomer) [M+H]+ Lipids LPE - 4.76E+02 3.35E+02 4.75E+02 C23H42NO7P - - Senkyunolide A [M+H]+ Others Lactones 63038-10-8 1.93E+02 9.11E+01 1.92E+02 C12H16O2 C17853 - Isorhamnetin-3-O-rhamnoside [M+H]+ Flavonoids Flavonols - 4.63E+02 3.17E+02 4.62E+02 C22H22O11 - - Octadeca-11E,13E,15Z-trienoic acid [M+H]+ Lipids Free fatty acids 25575-00-2 2.79E+02 1.49E+02 2.78E+02 C18H30O2 - - 3-(4-hydroxyphenyl)-3-oxopropyl beta-D-glucopyranoside [M+H]+ Phenolic acids Phenolic acids 53170-92-6 3.29E+02 1.21E+02 3.28E+02 C15H20O8 - - Chrysoeriol-5,7-di-O-glucoside [M+H]+ Flavonoids Flavones - 6.25E+02 3.01E+02 6.24E+02 C28H32O16 - - Elaeocarpucin F [M+H]+ Terpenoids Triterpene - 4.89E+02 2.05E+02 4.88E+02 C30H48O5 - - 2,6-Dimethyl-6-hydroxy-2,7-octadienyl-β-D-glucoside (Betulalbuside A; Betulabuside A) [M+H]+ Terpenoids Monoterpenoids 64776-96-1 3.33E+02 2.87E+02 3.32E+02 C16H28O7 - - 4-Aminoindole [M+H]+ Alkaloids Plumerane 5192-23-4 1.33E+02 1.16E+02 1.32E+02 C8H8N2 - - L-Aspartyl-L-Phenylalanine [M+H]+ Amino acids and derivatives Amino acids and derivatives 13433-09-5 2.81E+02 1.66E+02 2.80E+02 C13H16N2O5 - - Ditartaroyl-hydroxycoumarin [M+H]+ Lignans and Coumarins Coumarins - 4.27E+02 2.95E+02 4.26E+02 C17H14O13 - - 3,5,7,4'-Tetrahydroxy-Coumaronochromone [M+H]+ Others Chromone - 3.03E+02 2.57E+02 3.02E+02 C15H10O7 - - Centaurein [M+H]+ Flavonoids Flavones 35595-03-0 5.23E+02 3.61E+02 5.22E+02 C24H26O13 - - 6-Hydroxy-7-methoxycoumarin* [M+H]+ Lignans and Coumarins Coumarins - 1.93E+02 1.33E+02 1.92E+02 C10H8O4 - - (14-Ethyl-4,6,19-trimethoxy-9,11-dioxa-14-azaheptacyclo[10.7.2.12,5.01,13.03,8.08,12.016,20]docosan-21-yl)acetate [M+H]+ Alkaloids Alkaloids - 4.78E+02 3.37E+02 4.77E+02 C26H39NO7 - - N-Monomethyl-L-arginine* [M+H]+ Amino acids and derivatives Amino acids and derivatives 17035-90-4 1.89E+02 7.01E+01 1.88E+02 C7H16N4O2 C03884 - Asp-Glu [M+H]+ Amino acids and derivatives Amino acids and derivatives 6157-06-8 2.63E+02 1.36E+02 2.62E+02 C9H14N2O7 - - Wogonin-7-O-Glucuronide (Wogonoside) [M+H]+ Flavonoids Flavones 51059-44-0 4.61E+02 2.85E+02 4.60E+02 C22H20O11 - - Guaiacol [M+H]+ Phenolic acids Phenolic acids 90-05-1 1.25E+02 9.30E+01 1.24E+02 C7H8O2 C15572 - L-α-Glutamyl-L-Glutamic Acid [M+H]+ Amino acids and derivatives Amino acids and derivatives 3929-61-1 2.77E+02 1.48E+02 2.76E+02 C10H16N2O7 C01425 - Antiarol; 3,4,5-Trimethoxyphenol [M+H]+ Phenolic acids Phenolic acids 642-71-7 1.85E+02 1.25E+02 1.84E+02 C9H12O4 C10765 - Isoamericanin A [M+H]+ Phenolic acids Phenolic acids 109063-85-6 3.29E+02 1.47E+02 3.28E+02 C18H16O6 - - Ethylsalicylate [M+H]+ Phenolic acids Phenolic acids 118-61-6 1.67E+02 1.21E+02 1.66E+02 C9H10O3 - - 3-Indoleacrylic acid* [M+H]+ Alkaloids Plumerane 1204-06-4 1.88E+02 1.18E+02 1.87E+02 C11H9NO2 C21283 - Mudanpinoic acid A [M+H]+ Terpenoids Triterpene 203511-36-8 4.55E+02 2.03E+02 4.54E+02 C30H46O3 - - Gln-Cys-Gln [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.78E+02 1.81E+02 3.77E+02 C13H23N5O6S1 - - Isovanillin [M+H]+ Others Aldehyde compounds 621-59-0 1.53E+02 6.50E+01 1.52E+02 C8H8O3 - - Inosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 58-63-9 2.69E+02 1.37E+02 2.68E+02 C10H12N4O5 C00294 ko00230,ko01100,ko01232,ko02010 Avicennin [M+H]+ Lignans and Coumarins Coumarins 53258-71-2 3.25E+02 2.94E+02 3.24E+02 C20H20O4 - - Anacardic acid [M+H]+ Organic acids Organic acids 16611-84-0 3.49E+02 1.23E+02 3.48E+02 C22H36O3 C10759 - Horsfieldin glucose* [M+H]+ Lignans and Coumarins Lignans - 5.19E+02 3.57E+02 5.18E+02 C26H30O11 - - 2'-Deoxyadenosine* [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 958-09-8 2.52E+02 1.36E+02 2.51E+02 C10H13N5O3 C00559 ko00230,ko01100,ko01232,ko02010 Butyl isobutyl phthalate* [M+H]+ Phenolic acids Phenolic acids 17851-53-5 2.79E+02 1.49E+02 2.78E+02 C16H22O4 - - Diosmetin-7-O-galactoside* [M+H]+ Flavonoids Flavones - 4.63E+02 3.01E+02 4.62E+02 C22H22O11 - - Vitexdoin C [M+H]+ Lignans and Coumarins Lignans - 3.25E+02 1.63E+02 3.24E+02 C19H16O5 - - N-(p-Coumaroyl)serotonin Glucoside [M+H]+ Alkaloids Plumerane 76423-56-8 4.85E+02 3.23E+02 4.84E+02 C25H28N2O8 - - Senkyunolide M [M+H]+ Others Lactones 146986-60-9 2.79E+02 1.21E+02 2.78E+02 C16H22O4 - - Urinatetralin [M+H]+ Lignans and Coumarins Lignans - 3.85E+02 1.67E+02 3.84E+02 C22H24O6 - - Secoxyloganin [M+H]+ Terpenoids Monoterpenoids 58822-47-2 4.05E+02 1.65E+02 4.04E+02 C17H24O11 - - Anisic acid-O-feruloyl glucoside [M+H]+ Phenolic acids Phenolic acids - 4.91E+02 3.29E+02 4.90E+02 C24H26O11 - - 3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-ol [M+H]+ Lignans and Coumarins Lignans 51670-40-7 4.17E+02 1.67E+02 4.16E+02 C22H24O8 - - 7-Methylguanine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 578-76-7 1.66E+02 1.49E+02 1.65E+02 C6H7N5O C02242 - Cinnamoylglycine [M+H]+ Amino acids and derivatives Amino acids and derivatives 16534-24-0 2.06E+02 1.31E+02 2.05E+02 C11H11NO3 - - Isorhamnetin-7-O-glucoside (Brassicin) [M+H]+ Flavonoids Flavonols 6743-96-0 4.79E+02 3.17E+02 4.78E+02 C22H22O12 - - 1-Methyladenine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 5142-22-3 1.50E+02 1.33E+02 1.49E+02 C6H7N5 C02216 - N-Monocinnamoylputrescine* [M+H]+ Alkaloids Phenolamine - 2.19E+02 1.31E+02 2.18E+02 C13H18N2O - - Ladanetin-6-O-β-D-glucosid* [M+H]+ Flavonoids Flavones - 4.63E+02 3.01E+02 4.62E+02 C22H22O11 - - 5'-Methoxylariciresinol [M+H]+ Lignans and Coumarins Lignans 105256-12-0 3.91E+02 1.49E+02 3.90E+02 C21H26O7 - - Indole [M+H]+ Alkaloids Plumerane 120-72-9 1.18E+02 9.11E+01 1.17E+02 C8H7N C00463 ko00380,ko00400,ko00402,ko00999,ko01100,ko01110,ko04974 N6-Acetyl-L-lysine [M+H]+ Amino acids and derivatives Amino acids and derivatives 692-04-6 1.89E+02 1.26E+02 1.88E+02 C8H16N2O3 C02727 ko00310,ko01100 L-Tyrosine* [M+H]+ Amino acids and derivatives Amino acids and derivatives 60-18-4 1.82E+02 1.36E+02 1.81E+02 C9H11NO3 C00082 ko00130,ko00261,ko00350,ko00360,ko00400,ko00401,ko00460,ko00680,ko00730,ko00940,ko00950,ko00965,ko00966,ko00970,ko00997,ko00998,ko00999,ko01055,ko01059,ko01060,ko01063,ko01100,ko01110,ko01210,ko01230,ko01240,ko04728,ko04916,ko04917,ko04974,ko05012,ko05030,ko05031,ko05034,ko05230 Sinapoylagmatine [M+H]+ Alkaloids Phenolamine - 3.37E+02 2.07E+02 3.36E+02 C16H24N4O4 - - 1β-hydroxy-β-cyperone [M+H]+ Terpenoids Sesquiterpenoids - 2.35E+02 1.33E+02 2.34E+02 C15H22O2 - - LysoPE 18:2(2n isomer) [M+H]+ Lipids LPE - 4.78E+02 3.37E+02 4.77E+02 C23H44NO7P - - 19-Hydroxy-2-(hydroxymethyl)-A(1)-norursa-2,12-dien-28-oic acid (Coleonolic acid) [M+H]+ Terpenoids Triterpene - 4.71E+02 2.05E+02 4.70E+02 C30H46O4 - - Reseoside* [M+H]+ Terpenoids Monoterpenoids - 3.71E+02 1.91E+02 3.70E+02 C19H30O7 - - Tyrosylleucine [M+H]+ Amino acids and derivatives Amino acids and derivatives 17355-10-1 2.95E+02 1.36E+02 2.94E+02 C15H22N2O4 - - Crenatoside [M+H]+ Phenolic acids Phenolic acids 61276-16-2 6.23E+02 1.63E+02 6.22E+02 C29H34O15 C10481 - 3-Hydroxyurs-5(6),12,18(19)-trien-28-oic acid (Uncargenin B) [M+H]+ Terpenoids Triterpene - 4.53E+02 4.35E+02 4.52E+02 C30H44O3 - - Asn-Arg [M+H]+ Amino acids and derivatives Amino acids and derivatives 2478-01-5 2.89E+02 1.75E+02 2.88E+02 C10H20N6O4 - - Methylpicraquassioside A [M+H]+ Lignans and Coumarins Coumarins - 4.13E+02 1.36E+02 4.12E+02 C19H24O10 - - L-Tyrosinamide [M+H]+ Amino acids and derivatives Amino acids and derivatives 4985-46-0 1.81E+02 1.36E+02 1.80E+02 C9H12N2O2 - - Suspenolic acid [M+H]+ Others Others - 1.99E+02 9.31E+01 1.98E+02 C10H14O4 - - 2,19-Dihydroxy-3-oxo-24-norolean-12-en-28-oic acid* [M+H]+ Terpenoids Triterpene - 4.87E+02 4.05E+02 4.86E+02 C30H46O5 - - LysoPC 19:2 [M+H]+ Lipids LPC - 5.34E+02 1.84E+02 5.33E+02 C27H52NO7P - - 30-Hydroxyfraxinellone [M+H]+ Terpenoids Sesquiterpenoids - 2.49E+02 1.59E+02 2.48E+02 C14H16O4 - - Ethyl maltol [M+H]+ Phenolic acids Phenolic acids 4940-11-8 1.41E+02 1.26E+02 1.40E+02 C7H8O3 C20362 - Symplocosin* [M+H]+ Lignans and Coumarins Lignans 11042-30-1 5.21E+02 1.31E+02 5.20E+02 C26H32O11 - - Dehydrodiconiferyl alcohol-gamma'-O-glucoside* [M+H]+ Lignans and Coumarins Lignans - 5.21E+02 1.31E+02 5.20E+02 C26H32O11 - - 2,5-Dimethyl-7-hydroxychromone [M+H]+ Others Chromone 38412-47-4 1.91E+02 1.76E+02 1.90E+02 C11H10O3 - - Aquilegiolide [M+H]+ Others Ketone compounds 94481-79-5 1.53E+02 7.70E+01 1.52E+02 C8H8O3 - - 3-Indolepropionic acid [M+H]+ Alkaloids Plumerane 830-96-6 1.90E+02 1.18E+02 1.89E+02 C11H11NO2 - - N-p-Coumaroylhydroxyputrescine [M+H]+ Alkaloids Phenolamine - 2.51E+02 1.47E+02 2.50E+02 C13H18N2O3 - - D-Allo-Isoleucine* [M+H]+ Amino acids and derivatives Amino acids and derivatives 1509-35-9 1.32E+02 8.61E+01 1.31E+02 C6H13NO2 - - 8-Hydroxy-5,5-dimethylpeltogynan [M+H]+ Flavonoids Flavones - 3.31E+02 1.21E+02 3.30E+02 C18H18O6 - - Ethyl cinnamate [M+H]+ Phenolic acids Phenolic acids 103-36-6 1.77E+02 1.31E+02 1.76E+02 C11H12O2 C06359 - p-menth-3-ene-1,2-diol [M+H]+ Terpenoids Monoterpenoids - 1.71E+02 8.11E+01 1.70E+02 C10H18O2 - - 2'-Deoxycytidine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 951-77-9 2.28E+02 1.12E+02 2.27E+02 C9H13N3O4 C00881 ko00240,ko01100,ko01232,ko02010 6-Methoxyquercetin-3-O-Xyloside [M+H]+ Flavonoids Flavonols - 4.65E+02 3.33E+02 4.64E+02 C21H20O12 - - flavanthrinin [M+H]+ Others Others - 2.41E+02 1.81E+02 2.40E+02 C15H12O3 - - Byzantionoside A* [M+H]+ Others Ketone compounds 189109-41-9 3.71E+02 1.33E+02 3.70E+02 C19H30O7 - - Fisetin [M+H]+ Flavonoids Flavonols 528-48-3 2.87E+02 1.37E+02 2.86E+02 C15H10O6 C10041 - Ligstral [M+H]+ Terpenoids Monoterpenoids - 3.63E+02 1.21E+02 3.62E+02 C19H22O7 - - Citicoline [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 987-78-0 4.89E+02 2.64E+02 4.88E+02 C14H26N4O11P2 C00307 ko00552,ko00564,ko01100,ko05231 Myrisfragransin [M+H]+ Lignans and Coumarins Lignans - 3.27E+02 1.51E+02 3.26E+02 C20H22O4 - - Ciwujiatone [M+H]+ Lignans and Coumarins Lignans - 4.35E+02 1.81E+02 4.34E+02 C22H26O9 - - Ser-Leu-Leu [M+H]+ Amino acids and derivatives Amino acids and derivatives 10329-74-5 3.32E+02 1.73E+02 3.31E+02 C15H29N3O5 - - Leu-Arg [M+H]+ Amino acids and derivatives Amino acids and derivatives 26607-15-8 2.88E+02 1.75E+02 2.87E+02 C12H25N5O3 - - 5,7-dihydroxy-3-(4'-hydroxybenzyl)-chroman-4-one [M+H]+ Flavonoids Other Flavonoids - 2.87E+02 1.67E+02 2.86E+02 C16H14O5 - - Kingiside [M+H]+ Lignans and Coumarins Lignans - 4.05E+02 1.65E+02 4.04E+02 C17H24O11 - - Vitexin-2''-O-galactoside [M+H]+ Flavonoids Flavones - 5.95E+02 4.33E+02 5.94E+02 C27H30O15 - - 1,1'-(6-hydroxy-2,3-dihydro-1H-indene-2,5-diyl)bis(ethan-1-one) [M+H]+ Terpenoids Sesquiterpenoids - 2.19E+02 1.89E+02 2.18E+02 C13H14O3 - - Tranexamic Acid [M+H]+ Organic acids Organic acids 1197-18-8 1.58E+02 9.51E+01 1.57E+02 C8H15NO2 - - N-Acetyl-D-glucosamine [M+H]+ Others Saccharides 7512-17-6 2.22E+02 1.38E+02 2.21E+02 C8H15NO6 C00140 ko00520,ko01100,ko01250,ko02010,ko02060 5-Methoxy-DL-tryptophan [M+H]+ Amino acids and derivatives Amino acids and derivatives 28052-84-8 2.35E+02 1.76E+02 2.34E+02 C12H14N2O3 - - Dihydropyrocurzerenone [M+H]+ Terpenoids Sesquiterpenoids 59462-26-9 2.15E+02 1.45E+02 2.14E+02 C15H18O - - Arginine methyl ester* [M+H]+ Amino acids and derivatives Amino acids and derivatives - 1.89E+02 7.01E+01 1.88E+02 C7H16N4O2 - - Robinetin [M+H]+ Flavonoids Flavonols 490-31-3 3.03E+02 2.57E+02 3.02E+02 C15H10O7 C10177 - 6-hydroxycoumarin [M+H]+ Lignans and Coumarins Coumarins 6093-68-1 1.63E+02 8.90E+01 1.62E+02 C9H6O3 - - Calceolarioside B* [M+H]+ Phenolic acids Phenolic acids 105471-98-5 4.79E+02 1.63E+02 4.78E+02 C23H26O11 - - 2,3-Dihydroxyurs-12-en-29-oic acid (Maslinic acid) [M+H]+ Terpenoids Triterpene 4373-41-5 4.73E+02 1.87E+02 4.72E+02 C30H48O4 C16939 - Biotin [M+H]+ Others Vitamin 58-85-5 2.45E+02 2.27E+02 2.44E+02 C10H16N2O3S C00120 ko00780,ko01100,ko01240,ko02010,ko04977 2-Phenylaminoadenosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 53296-10-9 3.59E+02 1.31E+02 3.58E+02 C16H18N6O4 - - Methyl dioxindole-3-acetate [M+H]+ Alkaloids Plumerane 57061-18-4 2.22E+02 1.30E+02 2.21E+02 C11H11NO4 - - Gardnerol A [M+H]+ Lignans and Coumarins Coumarins - 3.57E+02 1.37E+02 3.56E+02 C19H16O7 - - Dopamine [M+H]+ Alkaloids Phenolamine 51-61-6 1.54E+02 1.37E+02 1.53E+02 C8H11NO2 C03758 ko00350,ko00950,ko00965,ko01060,ko01063,ko01100,ko01110,ko04024,ko04080,ko04540,ko04721,ko04728,ko04917,ko04976,ko05012,ko05030,ko05031,ko05032,ko05034 (R)-3-ethyl-7-hydroxy-6-methoxyphthalide [M+H]+ Others Others - 2.09E+02 1.21E+02 2.08E+02 C11H12O4 - - Fraxetin (7,8-Dihydroxy-6-methoxycoumarin) [M+H]+ Lignans and Coumarins Coumarins 574-84-5 2.09E+02 1.49E+02 2.08E+02 C10H8O5 C09265 ko00999,ko01110 Phe-Ile [M+H]+ Amino acids and derivatives Amino acids and derivatives 22951-94-6 2.79E+02 1.20E+02 2.78E+02 C15H22N2O3 - - Hyp-Val [M+H]+ Amino acids and derivatives Amino acids and derivatives - 2.31E+02 8.61E+01 2.30E+02 C10H18N2O4 - - Maohuoside A [M+H]+ Flavonoids Flavonols 128988-55-6 5.49E+02 3.87E+02 5.48E+02 C27H32O12 - - Syringetin-3-O-(6''-Acetyl)glucoside [M+H]+ Flavonoids Flavonols - 5.51E+02 3.47E+02 5.50E+02 C25H26O14 - - Strictamine [M+H]+ Alkaloids Alkaloids 6475-05-4 3.23E+02 2.91E+02 3.22E+02 C20H22N2O2 - - 9-Oxo-10,12-Octadecadienoic Acid [M+H]+ Lipids Free fatty acids 54665-32-6 2.95E+02 1.51E+02 2.94E+02 C18H30O3 - - 7-Hydroxy-4-chromone [M+H]+ Others Chromone 59887-89-7 1.63E+02 1.07E+02 1.62E+02 C9H6O3 - - Triethylamine [M+H]+ Alkaloids Alkaloids 121-44-8 1.02E+02 5.81E+01 1.01E+02 C6H15N C14691 - Val-Trp [M+H]+ Amino acids and derivatives Amino acids and derivatives 24587-37-9 3.04E+02 1.88E+02 3.03E+02 C16H21N3O3 - - 2,3,4-Trihydroxybutyl 6-O-(E)-caffeoyl-β-D-glucopyranoside [M+H]+ Phenolic acids Phenolic acids - 4.47E+02 1.63E+02 4.46E+02 C19H26O12 - - Lys-Ala [M+H]+ Amino acids and derivatives Amino acids and derivatives 17043-71-9 2.18E+02 8.41E+01 2.17E+02 C9H19N3O3 - - Cyclo(L-Phe-trans-4-hydroxy-L-Pro) [M+H]+ Amino acids and derivatives Amino acids and derivatives 118477-06-8 2.61E+02 1.20E+02 2.60E+02 C14H16N2O3 - - 2-(Acetylamino)-3-phenyl-2-propenoic acid [M+H]+ Alkaloids Alkaloids 5469-45-4 2.06E+02 1.18E+02 2.05E+02 C11H11NO3 - - Bursehernin* [M+H]+ Lignans and Coumarins Lignans - 3.71E+02 1.67E+02 3.70E+02 C21H22O6 - - L-Cystathionine [M+H]+ Amino acids and derivatives Amino acids and derivatives 56-88-2 2.23E+02 1.34E+02 2.22E+02 C7H14N2O4S C02291 ko00260,ko00270,ko01100,ko01110,ko01230,ko01240 (3R,4S,6R)-p-Menth-1-ene-3,6-diol-3-O-β-D-glucoside* [M+H]+ Terpenoids Monoterpenoids - 3.33E+02 1.53E+02 3.32E+02 C16H28O7 - - Met-Met [M+H]+ Amino acids and derivatives Amino acids and derivatives 7349-78-2 2.81E+02 1.04E+02 2.80E+02 C10H20N2O3S2 - - Gln-Asp-Val [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.61E+02 1.81E+02 3.60E+02 C14H24N4O7 - - 3-(4-hydroxybenzene)-5,7-dihydroxy-6-methoxychroman-4-one malonyl glucoside [M+H]+ Flavonoids Other Flavonoids - 5.63E+02 3.15E+02 5.62E+02 C26H26O14 - - N6-Isopentenyladenine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 2365-40-4 2.04E+02 1.36E+02 2.03E+02 C10H13N5 C04083 ko00908,ko01110,ko04075 1,3-O-Dicaffeoylglycerol [M+H]+ Phenolic acids Phenolic acids - 4.17E+02 1.63E+02 4.16E+02 C21H20O9 - - 6-Hydroxy-3-oxooleana-11,13(18)-dien-28-oic acid [M+H]+ Terpenoids Triterpene - 4.69E+02 4.07E+02 4.68E+02 C30H44O4 - - 3-O-caffeoyl quininyl arabinoside [M+H]+ Others Others - 4.87E+02 3.55E+02 4.86E+02 C21H26O13 - - Malonyltryptophan [M+H]+ Amino acids and derivatives Amino acids and derivatives - 2.91E+02 2.45E+02 2.90E+02 C14H14N2O5 - - Fraxetin glucuronide [M+H]+ Lignans and Coumarins Coumarins - 3.85E+02 2.09E+02 3.84E+02 C16H16O11 - - Glycidyl Linoleate [M+H]+ Lipids Glycerol ester 24305-63-3 3.37E+02 2.63E+02 3.36E+02 C21H36O3 - - Isorhamnetin-3-O-sophoroside-7-O-rhamnoside* [M+H]+ Flavonoids Flavonols 41328-75-0 7.87E+02 3.17E+02 7.86E+02 C34H42O21 - - Rhodionidin [M+H]+ Flavonoids Flavonols - 6.11E+02 3.03E+02 6.10E+02 C27H30O16 - - Scopoletin-7-O-xylosyl(1→6)glucoside [M+H]+ Lignans and Coumarins Coumarins - 4.87E+02 1.93E+02 4.86E+02 C21H26O13 - - Quercetin-3-O-glucoside-7-O-rhamnoside* [M+H]+ Flavonoids Flavonols - 6.11E+02 3.03E+02 6.10E+02 C27H30O16 - - 3-hydroxylup-12(13),20(29)-diene [M+H]+ Terpenoids Triterpene - 4.25E+02 1.77E+02 4.24E+02 C30H48O - - Forsythoside H* [M+H]+ Phenolic acids Phenolic acids - 6.25E+02 1.63E+02 6.24E+02 C29H36O15 - - Met-Asp [M+H]+ Amino acids and derivatives Amino acids and derivatives 14595-65-4 2.65E+02 6.90E+01 2.64E+02 C9H16N2O5S - - 5,7-Dihydroxy-4-methylcoumarin [M+H]+ Lignans and Coumarins Coumarins 2107-76-8 1.93E+02 9.11E+01 1.92E+02 C10H8O4 - - Medioresinol B [M+H]+ Lignans and Coumarins Lignans - 3.89E+02 3.27E+02 3.88E+02 C21H24O7 - - 2-amino-3-(1H-pyrazol-1-yl)propanoic acid [M+H]+ Organic acids Organic acids 2734-48-7 1.56E+02 1.10E+02 1.55E+02 C6H9N3O2 - - Methoxyindoleacetic acid [M+H]+ Alkaloids Plumerane 3471-31-6 2.06E+02 1.45E+02 2.05E+02 C11H11NO3 C05660 ko00380 (2E)-3-(1-Hydroxy-2,6,6-trimethyl-4-oxo-2-cyclohexen-1-yl)-2-propenoic acid [M+H]+ Others Others 26690-86-8 2.25E+02 1.23E+02 2.24E+02 C12H16O4 - - Elaeocarpucin A* [M+H]+ Terpenoids Triterpene - 4.87E+02 4.23E+02 4.86E+02 C30H46O5 - - (S)-Peucedanol [M+H]+ Lignans and Coumarins Coumarins - 2.65E+02 1.73E+02 2.64E+02 C14H16O5 - - Epimedoside A [M+H]+ Flavonoids Flavonols 39012-04-9 6.63E+02 5.01E+02 6.62E+02 C32H38O15 - - Anisic acid; 4-Methoxybenzoic acid [M+H]+ Phenolic acids Phenolic acids 100-09-4 1.53E+02 1.09E+02 1.52E+02 C8H8O3 C02519 ko00362,ko01120,ko01220 Tryptamine [M+H]+ Alkaloids Plumerane 61-54-1 1.61E+02 1.44E+02 1.60E+02 C10H12N2 C00398 ko00380,ko00901,ko01060,ko01063,ko01100,ko01110,ko04080 Met-Thr [M+H]+ Amino acids and derivatives Amino acids and derivatives 40883-16-7 2.51E+02 1.04E+02 2.50E+02 C9H18N2O4S - - Tyr-Ala [M+H]+ Amino acids and derivatives Amino acids and derivatives 730-08-5 2.53E+02 1.36E+02 2.52E+02 C12H16N2O4 - - 3-Hydroxyanthranilic acid [M+H]+ Alkaloids Phenolamine 548-93-6 1.54E+02 1.36E+02 1.53E+02 C7H7NO3 C00632 ko00380,ko00627,ko01100,ko01120,ko01240 6β-Hydroxy-8α-methoxyeremophila-1(10),7(11)-dien-12,8β-olide* [M+H]+ Terpenoids Sesquiterpenoids - 2.79E+02 1.49E+02 2.78E+02 C16H22O4 - - Sinapyl fraxin [M+H]+ Lignans and Coumarins Coumarins - 5.77E+02 1.65E+02 5.76E+02 C27H28O14 - - Dehydrodiconiferyl alcohol-4-O-glucoside* [M+H]+ Lignans and Coumarins Lignans 107870-88-2 5.21E+02 1.31E+02 5.20E+02 C26H32O11 - - Dihydrokaempferol-3-O-glucoside* [M+H]+ Flavonoids Flavanonols 31049-08-8 4.51E+02 2.89E+02 4.50E+02 C21H22O11 - - Met-Ser [M+H]+ Amino acids and derivatives Amino acids and derivatives 14517-43-2 2.37E+02 1.04E+02 2.36E+02 C8H16N2O4S - - 2,4-Dihydroxy-6-methoxyacetophenone [M+H]+ Others Ketone compounds 3602-54-8 1.83E+02 7.70E+01 1.82E+02 C9H10O4 - - Bartsioside [M+H]+ Terpenoids Monoterpenoids 62133-72-6 3.31E+02 1.51E+02 3.30E+02 C15H22O8 - - Multifidol Glucoside [M+H]+ Phenolic acids Phenolic acids - 3.73E+02 1.63E+02 3.72E+02 C17H24O9 - - Plantarenaloside [M+H]+ Terpenoids Monoterpenoids 72396-01-1 3.61E+02 1.81E+02 3.60E+02 C16H24O9 - - Rhodiolgin [M+H]+ Flavonoids Flavonols 94696-39-6 4.65E+02 3.03E+02 4.64E+02 C21H20O12 - - Stellarin [M+H]+ Phenolic acids Phenolic acids - 3.33E+02 1.71E+02 3.32E+02 C13H16O10 - - L-Lysine-Butanoic Acid [M+H]+ Amino acids and derivatives Amino acids and derivatives 80407-71-2 2.35E+02 1.18E+02 2.34E+02 C10H22N2O4 - - Caffeic aldehyde [M+H]+ Phenolic acids Phenolic acids 141632-15-7 1.65E+02 9.11E+01 1.64E+02 C9H8O3 C10945 ko00940,ko01110 Byzantionoside B [M+H]+ Others Others 189109-45-3 3.73E+02 1.35E+02 3.72E+02 C19H32O7 - - Met-Pro-Gln [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.75E+02 1.77E+02 3.74E+02 C15H26N4O5S1 - - Machilin H [M+H]+ Lignans and Coumarins Lignans - 3.75E+02 1.77E+02 3.74E+02 C21H26O6 - - (2R)-3-(3',4',5'-trimethoxyphenyl)-1,2-propanediol [M+H]+ Phenolic acids Phenolic acids - 2.43E+02 1.81E+02 2.42E+02 C12H18O5 - - Fraxidin-8-O-glucoside* [M+H]+ Lignans and Coumarins Coumarins - 3.85E+02 2.23E+02 3.84E+02 C17H20O10 - - Rosmarinic acid [M+H]+ Phenolic acids Phenolic acids 537-15-5 3.61E+02 1.63E+02 3.60E+02 C18H16O8 C01850 ko00350,ko01100 Luteolin-4'-O-glucoside [M+H]+ Flavonoids Flavones 6920-38-3 4.49E+02 2.87E+02 4.48E+02 C21H20O11 - - Gardenin C glucoside [M+H]+ Flavonoids Flavones - 5.67E+02 4.05E+02 5.66E+02 C26H30O14 - - LysoPE 18:1(2n isomer)* [M+H]+ Lipids LPE - 4.80E+02 3.39E+02 4.79E+02 C23H46NO7P - - Isofraxidin [M+H]+ Lignans and Coumarins Coumarins 486-21-5 2.23E+02 1.90E+02 2.22E+02 C11H10O5 C17480 - 5,7-Dihydroxychromone glucoside [M+H]+ Others Chromone - 3.41E+02 1.79E+02 3.40E+02 C15H16O9 - - Ligustroflavone(Nuezhenoside) [M+H]+ Flavonoids Flavones 260413-62-5 7.25E+02 5.79E+02 7.24E+02 C33H40O18 - - Cuneataside E* [M+H]+ Others Others - 5.05E+02 2.11E+02 5.04E+02 C24H40O11 - - γ-glutamylmethionine [M+H]+ Amino acids and derivatives Amino acids and derivatives 17663-87-5 2.79E+02 1.33E+02 2.78E+02 C10H18N2O5S - - 13,28-Epoxyolean-11-en-3-one [M+H]+ Terpenoids Triterpene - 4.39E+02 2.03E+02 4.38E+02 C30H46O2 - - 2-Feruloyl-sn-glycerol [M+H]+ Phenolic acids Phenolic acids - 2.69E+02 1.77E+02 2.68E+02 C13H16O6 - - (1R,2R)-2-hydroxy-1-methyl-2,3-dihydro-1H-indene-5-carboxylic acid [M+H]+ Others Others - 1.93E+02 1.05E+02 1.92E+02 C11H12O3 - - Quinidine [M+H]+ Alkaloids Quinoline alkaloids 56-54-2 3.25E+02 3.07E+02 3.24E+02 C20H24N2O2 C06527 ko01063 Euoniside* [M+H]+ Lignans and Coumarins Coumarins - 3.85E+02 2.23E+02 3.84E+02 C17H20O10 - - Eleutheroside B1* [M+H]+ Lignans and Coumarins Coumarins 16845-16-2 3.85E+02 2.23E+02 3.84E+02 C17H20O10 - - Scopoletin (7-Hydroxy-6-methoxycoumarin)* [M+H]+ Lignans and Coumarins Coumarins 92-61-5 1.93E+02 1.33E+02 1.92E+02 C10H8O4 C01752 ko00999,ko01061,ko01110 Oleoside* [M+H]+ Terpenoids Monoterpenoids 178600-68-5 3.91E+02 2.11E+02 3.90E+02 C16H22O11 - - Taxiresinol [M+H]+ Lignans and Coumarins Lignans 40951-69-7 3.47E+02 1.21E+02 3.46E+02 C19H22O6 - - Hispidulin-8-C-glucoside [M+H]+ Flavonoids Flavones - 4.63E+02 3.43E+02 4.62E+02 C22H22O11 - - 2-Aminophenol [M+H]+ Alkaloids Phenolamine 95-55-6 1.10E+02 6.50E+01 1.09E+02 C6H7NO C01987 ko00380,ko00627,ko01100,ko01120 Isofraxetin [M+H]+ Lignans and Coumarins Coumarins 50656-75-2 2.09E+02 1.94E+02 2.08E+02 C10H8O5 - - 11-O-Syringoylbergenin [M+H]+ Lignans and Coumarins Coumarins - 5.09E+02 1.81E+02 5.08E+02 C23H24O13 - - Leu-Asp [M+H]+ Amino acids and derivatives Amino acids and derivatives 32949-40-9 2.47E+02 8.61E+01 2.46E+02 C10H18N2O5 - - N1,N8-Bis(sinapoyl)spermidine [M+H]+ Alkaloids Phenolamine - 5.58E+02 2.07E+02 5.57E+02 C29H39N3O8 C21170 - 1,7-Dimethylxanthine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 611-59-6 1.81E+02 1.24E+02 1.80E+02 C7H8N4O2 C13747 ko00232,ko01060,ko01100,ko01110,ko01120 Foliasalacioside B1* [M+H]+ Terpenoids Monoterpenoids - 5.05E+02 2.11E+02 5.04E+02 C24H40O11 - - 3-Oxo-α-ionol-β-D-glucoside* [M+H]+ Others Alcohol compounds - 3.71E+02 1.91E+02 3.70E+02 C19H30O7 - - 2-Hydroxymethyl-A(1)-nor-19,24-dihydroxyurs-2,12-dien-28-oic acid (Rosamultic acid)* [M+H]+ Terpenoids Triterpene 214285-76-4 4.87E+02 4.05E+02 4.86E+02 C30H46O5 - - Liriodendrin [M+H]+ Lignans and Coumarins Lignans - 7.43E+02 2.65E+02 7.42E+02 C34H46O18 - - Gallic acid [M+H]+ Phenolic acids Phenolic acids 149-91-7 1.71E+02 1.07E+02 1.70E+02 C7H6O5 C01424 ko00627,ko00999,ko01061,ko01120 Maltopentaose [M+H]+ Others Saccharides 34620-76-3 8.29E+02 3.25E+02 8.28E+02 C30H52O26 - - 3-Oxooleana-11,13(18)-dien-28-oic acid [M+H]+ Terpenoids Triterpene - 4.53E+02 2.01E+02 4.52E+02 C30H44O3 - - (2s)-2-[(5s)-5-hydroxyhexa-1,3-dien-1-yl]-5-methoxy-4-[(3r)-3-methoxybutanoyl]-2-methylfuran-3-one [M+H]+ Others Ketone compounds - 3.25E+02 1.91E+02 3.24E+02 C17H24O6 - - Isoquinoline [M+H]+ Alkaloids Isoquinoline alkaloids 119-65-3 1.30E+02 1.03E+02 1.29E+02 C9H7N C06323 - Suberylglycine [M+H]+ Amino acids and derivatives Amino acids and derivatives 60317-54-6 2.32E+02 1.57E+02 2.31E+02 C10H17NO5 - - N'-p-Coumaroylagmatine-glucoside [M+H]+ Alkaloids Phenolamine - 4.39E+02 2.77E+02 4.38E+02 C20H30O7N4 - - Phthalic anhydride [M+H]+ Phenolic acids Phenolic acids 85-44-9 1.49E+02 6.50E+01 1.48E+02 C8H4O3 - - 4-O-Sinapoylquinic acid [M+H]+ Phenolic acids Phenolic acids - 3.99E+02 2.07E+02 3.98E+02 C18H22O10 - - Tricin-5-O-Glucoside [M+H]+ Flavonoids Flavones 32769-00-9 4.93E+02 3.31E+02 4.92E+02 C23H24O12 - - Evofolin B glucoside [M+H]+ Phenolic acids Phenolic acids - 4.81E+02 1.77E+02 4.80E+02 C23H28O11 - - 10-Acetoxyligustroside [M+H]+ Terpenoids Monoterpenoids - 5.83E+02 1.21E+02 5.82E+02 C27H34O14 - - γ-L-Glutamyl-L-[S-(4-hydroxyphenylbenzyl)]cysteine glycine [M+H]+ Amino acids and derivatives Amino acids and derivatives - 4.14E+02 1.79E+02 4.13E+02 C17H23N3O7S - - LysoPE 17:1 [M+H]+ Lipids LPE - 4.66E+02 3.25E+02 4.65E+02 C22H44NO7P - - LysoPC 15:0* [M+H]+ Lipids LPC 108273-89-8 4.82E+02 1.84E+02 4.81E+02 C23H48NO7P - - LysoPC 15:0(2n isomer)* [M+H]+ Lipids LPC - 4.82E+02 1.84E+02 4.81E+02 C23H48NO7P - - Met-Asn [M+H]+ Amino acids and derivatives Amino acids and derivatives 36261-61-7 2.64E+02 1.04E+02 2.63E+02 C9H17N3O4S - - Isorhamnetin-3-O-glucuronide-7-O-rhamnoside [M+H]+ Flavonoids Flavonols - 6.39E+02 4.93E+02 6.38E+02 C28H30O17 - - 3,3'-Bis(3,4-dihydro-4-hydroxy-6,8-dimethoxy-2H-1-benzopyran) [M+H]+ Others Others - 4.17E+02 1.81E+02 4.18E+02 C22H26O8 - - 2-Aminoadenosine [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 2096-10-8 2.83E+02 1.81E+02 2.82E+02 C10H14N6O4 C00939 - Ile-Trp [M+H]+ Amino acids and derivatives Amino acids and derivatives 13589-06-5 3.18E+02 1.88E+02 3.17E+02 C17H23N3O3 - - N1-Dihydrocaffeoyl-N10-coumaroylspermidine [M+H]+ Alkaloids Phenolamine - 4.56E+02 3.10E+02 4.55E+02 C25H33N3O5 - - N(6),N(6)-Dimethyl-L-lysine [M+H]+ Amino acids and derivatives Amino acids and derivatives 2259-86-1 1.75E+02 7.01E+01 1.74E+02 C8H18N2O2 - - N1-Caffeoyl-N10-dihydrocaffeoylspermidine [M+H]+ Alkaloids Phenolamine - 4.72E+02 2.20E+02 4.71E+02 C25H33N3O6 - - 2,6-Dimethoxypydroquinone-1-O-glucoside [M+H]+ Flavonoids Other Flavonoids - 3.33E+02 1.71E+02 3.32E+02 C14H20O9 - - secologanoside* [M+H]+ Terpenoids Monoterpenoids - 3.91E+02 2.11E+02 3.90E+02 C16H22O11 - - 3,4-Dihydroxy-L-phenylalanine (L-Dopa) [M+H]+ Amino acids and derivatives Amino acids and derivatives 59-92-7 1.98E+02 1.52E+02 1.97E+02 C9H11NO4 C00355 ko00350,ko00950,ko00965,ko01060,ko01063,ko01100,ko01110,ko04728,ko04917,ko05012,ko05030,ko05031,ko05034 Ser-Abu-OH [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.13E+02 1.21E+02 3.12E+02 C13H16N2O7 - - 2-(4-Methoxyphenethyl)-5,6:7,8-Diepoxy-5,6,7,8-Tetrahydrochromone [M+H]+ Others Chromone - 3.13E+02 1.21E+02 3.12E+02 C18H16O5 - - (3R,4R)-p-Menth-1-ene-3,4-diol-3-O-β-D-glucoside* [M+H]+ Terpenoids Monoterpenoids - 3.33E+02 1.53E+02 3.32E+02 C16H28O7 - - Luteolin-3'-O-glucoside [M+H]+ Flavonoids Flavones - 4.49E+02 2.87E+02 4.48E+02 C21H20O11 - - 2,3-Dihydroxylup-20(29)-en-28-oic acid [M+H]+ Terpenoids Triterpene - 4.71E+02 2.01E+02 4.70E+02 C30H46O4 - - Cordycepin (3'-Deoxyadenosine)* [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 73-03-0 2.52E+02 1.36E+02 2.51E+02 C10H13N5O3 C08431 - 1-((Pentanoyl)phloroglucinyl]-β-D-glucopyranoside [M+H]+ Others Others - 3.73E+02 1.61E+02 3.72E+02 C17H24O9 - - Isocrenatoside [M+H]+ Phenolic acids Phenolic acids 221895-09-6 6.23E+02 1.63E+02 6.22E+02 C29H34O15 - - Isorhamnetin-3-O-rutinoside-4'-O-glucoside* [M+H]+ Flavonoids Flavonols 111393-97-6 7.87E+02 3.17E+02 7.86E+02 C34H42O21 - - Pro-Pro-Asn [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.27E+02 1.37E+02 3.26E+02 C14H22N4O5 - - N,N-Dimethyl-5-methoxytryptamine [M+H]+ Alkaloids Plumerane 1019-45-0 2.19E+02 1.74E+02 2.18E+02 C13H18N2O C08309 - L-Norleucine* [M+H]+ Amino acids and derivatives Amino acids and derivatives 327-57-1 1.32E+02 8.61E+01 1.31E+02 C6H13NO2 C01933 - Galloylisorhamnetin [M+H]+ Flavonoids Flavonols - 4.69E+02 3.17E+02 4.68E+02 C23H16O11 - - 3-O-Cinnamoyl-4,6-(S)-HHDP-β-D-glucose [M+H]+ Phenolic acids Phenolic acids - 6.13E+02 1.47E+02 6.12E+02 C29H24O15 - - 2-(4-((6,7-dihydroxy-5-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl)phenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol [M+H]+ Alkaloids Alkaloids - 4.64E+02 3.02E+02 4.63E+02 C23H29NO9 - - Elaeocarpucin B [M+H]+ Terpenoids Triterpene - 4.87E+02 4.23E+02 4.86E+02 C30H46O5 - - Chrysoeriol-6,8-di-C-glucoside-4'-O-glucoside [M+H]+ Flavonoids Flavones - 7.87E+02 6.25E+02 7.86E+02 C34H42O21 - - 2,6-Dimethoxy-1,4-benzoquinone* [M+H]+ Quinones Quinones 530-55-2 1.69E+02 6.50E+01 1.68E+02 C8H8O4 C10331 - N-Caffeoylphenylalanine [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.28E+02 1.66E+02 3.27E+02 C18H17NO5 - - 3-(3'-Hydroxybutyl)-2,4,4-trimethylcyclohexa-2,5-dienone glucoside* [M+H]+ Terpenoids Sesquiterpenoids - 3.71E+02 1.33E+02 3.70E+02 C19H30O7 - - Isorhamnetin-3-O-rutinoside (Narcissin) [M+H]+ Flavonoids Flavonols 604-80-8 6.25E+02 3.17E+02 6.24E+02 C28H32O16 - - Frambinone [M+H]+ Others Ketone compounds - 1.65E+02 9.11E+01 1.64E+02 C10H12O2 - - 1-(3,4-dihydroxy-S-methoxypheny)-7-(4-hydroxyphenyl)hept-1-ene-3,5-diol [M+H]+ Phenolic acids Phenolic acids - 3.61E+02 1.37E+02 3.60E+02 C20H24O6 - - Isobavachalcone glucoside [M+H]+ Flavonoids Chalcones - 4.87E+02 3.25E+02 4.86E+02 C26H30O9 - - Eriodictyol-7-O-glucoside* [M+H]+ Flavonoids Flavanones 38965-51-4 4.51E+02 2.89E+02 4.50E+02 C21H22O11 - - Afzelechin (3,5,7,4'-Tetrahydroxyflavan) [M+H]+ Flavonoids Flavanols 2545-00-8 2.75E+02 1.39E+02 2.74E+02 C15H14O5 C09320 ko00941,ko01110 catechin-3-O-α-L-rhamnopyranoside [M+H]+ Flavonoids Flavanols 103630-03-1 4.37E+02 1.39E+02 4.36E+02 C21H24O10 - - Gallocatechin gallate [M+H]+ Flavonoids Flavanols 4233-96-9 4.59E+02 1.39E+02 4.58E+02 C22H18O11 - - Isochlorogenic acid C [M+H]+ Phenolic acids Phenolic acids 57378-72-0 5.17E+02 1.63E+02 5.16E+02 C25H24O12 - - His-Tyr [M+H]+ Amino acids and derivatives Amino acids and derivatives 35979-00-1 3.19E+02 1.10E+02 3.18E+02 C15H18N4O4 - - (7R,8S)-9-acetyl-dehydrodiconiferyl alcohol [M+H]+ Lignans and Coumarins Lignans - 4.01E+02 2.17E+02 4.00E+02 C22H24O7 - - Desrhamnosylisoacteoside* [M+H]+ Phenolic acids Phenolic acids - 4.79E+02 1.63E+02 4.78E+02 C23H26O11 - - 3',5,5',7-Tetrahydroxyflavanone-7-O-glucoside* [M+H]+ Flavonoids Flavanones - 4.51E+02 2.89E+02 4.50E+02 C21H22O11 - - Okanin-4'-O-glucoside(Marein)* [M+H]+ Flavonoids Chalcones 535-96-6 4.51E+02 2.89E+02 4.50E+02 C21H22O11 - - Leucosceptoside A [M+H]+ Phenolic acids Phenolic acids 83529-62-8 6.39E+02 1.77E+02 6.38E+02 C30H38O15 - - Pyridoxine-5'-O-(6''-feruloyl)glucoside [M+H]+ Others Vitamin - 5.08E+02 1.52E+02 5.07E+02 C24H29NO11 - - 3-(4-hydroxy-2,6-dimethoxyphenyl)-1-(4-methoxyphenyl)propan-1-one [M+H]+ Flavonoids Chalcones - 3.17E+02 1.51E+02 3.16E+02 C18H20O5 - - 11-methoxy viburtinal [M+H]+ Terpenoids Monoterpenoids - 1.77E+02 1.34E+02 1.76E+02 C10H8O3 - - Excelsioside [M+H]+ Terpenoids Monoterpenoids 148139-95-1 5.25E+02 1.21E+02 5.24E+02 C25H32O12 - - Integracide H [M+H]+ Terpenoids Triterpene - 5.99E+02 3.37E+02 5.98E+02 C36H54O7 - - Quercetin-3-O-neohesperidoside* [M+H]+ Flavonoids Flavonols 29662-79-1 6.11E+02 3.03E+02 6.10E+02 C27H30O16 - - Cirsimaritin-8-C-glucoside [M+H]+ Flavonoids Flavones - 4.77E+02 3.57E+02 4.76E+02 C23H24O11 - - Carambolaside A [M+H]+ Flavonoids Chalcones - 4.21E+02 1.07E+02 4.20E+02 C21H24O9 - - Tanegoside [M+H]+ Lignans and Coumarins Lignans - 5.39E+02 3.41E+02 5.38E+02 C26H34O12 - - N-Feruloyltyramine 4'-glucoside [M+H]+ Alkaloids Phenolamine - 4.76E+02 1.77E+02 4.75E+02 C24H29NO9 - - Pinolenic acid [M+H]+ Lipids Free fatty acids 16833-54-8 2.79E+02 1.49E+02 2.78E+02 C18H30O2 - - Desrhamnosylacteoside [M+H]+ Phenolic acids Phenolic acids - 4.79E+02 1.63E+02 4.78E+02 C23H26O11 - - 1-Monomyristin [M+H]+ Lipids Glycerol ester 589-68-4 3.03E+02 5.71E+01 3.02E+02 C17H34O4 - - Acteoside; Verbascoside* [M+H]+ Phenolic acids Phenolic acids 61276-17-3 6.25E+02 1.63E+02 6.24E+02 C29H36O15 C10501 - 3-Prenyl-4,2',4'-Trihydroxychalcone [M+H]+ Flavonoids Chalcones 202815-28-9 3.25E+02 1.75E+02 3.24E+02 C20H20O4 - - L-Cysteinyl-L-glycine [M+H]+ Amino acids and derivatives Amino acids and derivatives 19246-18-5 1.79E+02 7.60E+01 1.78E+02 C5H10N2O3S C01419 ko00480,ko01100 3-Hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)propan-1-one [M+H]+ Others Ketone compounds - 2.27E+02 1.81E+02 2.26E+02 C11H14O5 - - Avicularin(Quercetin-3-O-α-L-arabinofuranoside) [M+H]+ Flavonoids Flavonols 572-30-5 4.35E+02 3.03E+02 4.34E+02 C20H18O11 - - (5R,6S,7R)-5-(3,4,5-Trimethoxyphenyl)-7-methyl-8-oxo-5,6,7,8-tetrahydronaphtho[2,3-d]-1,3-dioxole-6-carboxylic acidethylester [M+H]+ Lignans and Coumarins Lignans - 4.43E+02 3.39E+02 4.42E+02 C24H26O8 - - 9-O-β-D-Glucoside of 3-hydroxy-7,8-didehydro-β-ionol [M+H]+ Terpenoids Sesquiterpenoids - 3.71E+02 2.09E+02 3.70E+02 C19H30O7 - - Guettardionoside* [M+H]+ Terpenoids Monoterpenoids - 5.05E+02 2.11E+02 5.04E+02 C24H40O11 - - Mucic acid-dimethyl-2-O-gallate [M+H]+ Phenolic acids Phenolic acids - 3.91E+02 1.53E+02 3.90E+02 C15H18O12 - - 1,7-Bis-(3,4-dihydroxyphenyl)-5-methoxy-3-heptanone [M+H]+ Others Others - 3.61E+02 1.81E+02 3.60E+02 C20H24O6 - - Okanin-3',4'-di-O-glucoside [M+H]+ Flavonoids Chalcones - 6.13E+02 2.89E+02 6.12E+02 C27H32O16 - - Dimethyllimettin [M+H]+ Lignans and Coumarins Coumarins - 2.35E+02 1.75E+02 2.34E+02 C13H14O4 - - N-(3-Indolylacetyl)-L-alanine [M+H]+ Amino acids and derivatives Amino acids and derivatives 57105-39-2 2.47E+02 1.30E+02 2.46E+02 C13H14N2O3 - - Met-Ala-Glu [M+H]+ Amino acids and derivatives Amino acids and derivatives - 3.50E+02 1.71E+02 3.49E+02 C13H23N3O6S1 - - 5'-Deoxyadenosine* [M+H]+ Nucleotides and derivatives Nucleotides and derivatives 4754-39-6 2.52E+02 1.36E+02 2.51E+02 C10H13N5O3 C05198 - 3-Hydroxyolean-12-ene-28,29-dioic acid (Serratagenic Acid)* [M+H]+ Terpenoids Triterpene 6488-64-8 4.87E+02 4.23E+02 4.86E+02 C30H46O5 - - Gallacetophenone [M+H]+ Phenolic acids Phenolic acids 528-21-2 1.69E+02 6.50E+01 1.68E+02 C8H8O4 - - 2,3,19-Trihydroxyolean-12-en-28-oic acid (Arjunic acid) [M+H]+ Terpenoids Triterpene 31298-06-3 4.89E+02 4.07E+02 4.88E+02 C30H48O5 - - 10-Dehydrogeniposide [M+H]+ Terpenoids Sesquiterpenoids - 3.87E+02 1.47E+02 3.86E+02 C17H22O10 - - Rel-(5R,6S,7R)-5,6,7,8-Tetrahydro-5,6,7-trihydroxy-2-[2-(4-methoxyphenyl)ethyl]-4H-1-benzopyran-4-one [M+H]+ Others Chromone - 3.33E+02 1.37E+02 3.32E+02 C18H20O6 - - 3-Deaza-2'-deoxyadenosine [M+Na]+ Nucleotides and derivatives Nucleotides and derivatives 78582-17-9 2.73E+02 1.53E+02 2.50E+02 C11H14N4O3 - - 12S-HHT [M+Na]+ Lipids Free fatty acids 54397-84-1 3.03E+02 1.49E+02 2.80E+02 C17H28O3 C20388 - Comolactone A [M+Na]+ Others Others - 1.93E+02 1.05E+02 1.70E+02 C9H14O3 - - Ala-Lys [M+Na]+ Amino acids and derivatives Amino acids and derivatives 6366-77-4 2.40E+02 1.94E+02 2.17E+02 C9H19N3O3 - - Pro-ala [M+Na]+ Amino acids and derivatives Amino acids and derivatives 6422-36-2 2.09E+02 1.49E+02 1.86E+02 C8H14N2O3 - - Thr-Ala-Gln [M+Na]+ Amino acids and derivatives Amino acids and derivatives - 3.41E+02 1.37E+02 3.18E+02 C12H22N4O6 - - Maltotriose [M+Na]+ Others Saccharides 1109-28-0 5.27E+02 3.65E+02 5.04E+02 C18H32O16 C01835 ko02010,ko04973 Nonic acid [M+Na]+ Lipids Free fatty acids - 2.11E+02 1.67E+02 1.88E+02 C9H16O4 - - Asn-Asn-Ala [M+Na]+ Amino acids and derivatives Amino acids and derivatives - 3.40E+02 1.71E+02 3.17E+02 C11H19N5O6 - - Matairesinol-4'-O-glucoside (Matairesinoside) [M+NH4]+ Lignans and Coumarins Lignans 23202-85-9 5.38E+02 3.59E+02 5.20E+02 C26H32O11 - - METABOLITES_END #END