#METABOLOMICS WORKBENCH ZX18875090280_20231105_000850 DATATRACK_ID:4440 STUDY_ID:ST002966 ANALYSIS_ID:AN004874 PROJECT_ID:PR001845
VERSION             	1
CREATED_ON             	November 5, 2023, 6:38 pm
#PROJECT
PR:PROJECT_TITLE                 	Widely targeted metabolomics of Corydalis yanhusuo bulbs
PR:PROJECT_TYPE                  	MS quantitative analysis
PR:PROJECT_SUMMARY               	Distribution and accumulation patterns of benzylisoquinoline alkaloids in bulbs
PR:PROJECT_SUMMARY               	of different developmental stages and sub organ parts of Corydalis yanhusuo
PR:INSTITUTE                     	Chongqing Academy of Chinese Materia Medica, Chongqing, China
PR:LABORATORY                    	Department of Traditional Chinese Medicine
PR:LAST_NAME                     	Zhao
PR:FIRST_NAME                    	Xiao
PR:ADDRESS                       	Nanshan stree, Chongqing, Nanan District, 400065, China
PR:EMAIL                         	321427953@qq.com
PR:PHONE                         	02389029062
#STUDY
ST:STUDY_TITLE                   	Metabolomics reveal the pathway of benzylisoquinoline alkaloids in Corydalis
ST:STUDY_TITLE                   	yanhusuo bulbs
ST:STUDY_TYPE                    	spatial and temporal distribution
ST:STUDY_SUMMARY                 	In general, bulbs of Corydalis yanhusuo can be divided into "mother-bulb (MB)"
ST:STUDY_SUMMARY                 	and "son-bulb (SB)" according to different parts. The mother bulbs are formed by
ST:STUDY_SUMMARY                 	the degeneration and re-expansion of their original stem and are used as
ST:STUDY_SUMMARY                 	medicinal material in production. Son bulbs emerge from axillary buds on
ST:STUDY_SUMMARY                 	horizontally elongated rhizomes, of which the larger bulb can also be used as
ST:STUDY_SUMMARY                 	medicine, while the smaller bulb is reserved as a seed stem for "seed". In this
ST:STUDY_SUMMARY                 	study, materials of C. yanhusuo bulbs were cultivated in the field, which was
ST:STUDY_SUMMARY                 	proposed and identified by Professor Da-xia Chen. Widely targeted metabolome
ST:STUDY_SUMMARY                 	sequencing of C. yanhusuo bulbs was performed by UPLC-ESI MS/MS system, and its
ST:STUDY_SUMMARY                 	metabolites were successfully identified and annotated in self-built database
ST:STUDY_SUMMARY                 	(the MetWare database). A total of 702 metabolites were identified in all
ST:STUDY_SUMMARY                 	samples, including 216 alkaloids, 120 lipids, 67 amino acids and their
ST:STUDY_SUMMARY                 	derivatives, 59 organic acids, 63 phenolic acids, 19 terpenoids, 28 flavonoids,
ST:STUDY_SUMMARY                 	4 lignin and coumarins, 43 nucleotides and their derivatives, 1 tannin, 3
ST:STUDY_SUMMARY                 	quinones and 79 other substances. The numbers of up-accumulated and
ST:STUDY_SUMMARY                 	down-accumulated metabolites in MB-A vs MB-C and SB-A vs SB-C were 135 and 148,
ST:STUDY_SUMMARY                 	90 and 210, respectively. There were 184 kinds of DAMs between SB-A and MB-A
ST:STUDY_SUMMARY                 	(including 144 down-accumulated and 40 up-accumulated compounds in the MB-A
ST:STUDY_SUMMARY                 	samples) and 127 kinds of DAMs between SB-C and MB-C (including 57
ST:STUDY_SUMMARY                 	down-accumulated and 40 up-accumulated compounds in the MB-C samples) .
ST:INSTITUTE                     	Chongqing Academy of Chinese Materia Medica, Chongqing, China
ST:LABORATORY                    	Department of Traditional Chinese Medicine
ST:LAST_NAME                     	Zhao
ST:FIRST_NAME                    	Xiao
ST:ADDRESS                       	Nanshan stree, Chongqing, Nanan District, 400065, China
ST:EMAIL                         	321427953@qq.com
ST:PHONE                         	02389029062
#SUBJECT
SU:SUBJECT_TYPE                  	Plant
SU:SUBJECT_SPECIES               	Corydalis yanhusuo
#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           	-	MB-A1	Treatment:mother-bulb expansion period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226382b_N.mzML; RAW_FILE_NAME=A21226382b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	MB-A2	Treatment:mother-bulb expansion period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226383b_N.mzML; RAW_FILE_NAME=A21226383b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	MB-A3	Treatment:mother-bulb expansion period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226384b_N.mzML; RAW_FILE_NAME=A21226384b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	SB-A1	Treatment:son-bulb expansion period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226388b_N.mzML; RAW_FILE_NAME=A21226388b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	SB-A2	Treatment:son-bulb expansion period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226389b_N.mzML; RAW_FILE_NAME=A21226389b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	SB-A3	Treatment:son-bulb expansion period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226390b_N.mzML; RAW_FILE_NAME=A21226390b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	MB-C1	Treatment:mother-bulb maturity period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226394b_N.mzML; RAW_FILE_NAME=A21226394b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	MB-C2	Treatment:mother-bulb maturity period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226395b_N.mzML; RAW_FILE_NAME=A21226395b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	MB-C3	Treatment:mother-bulb maturity period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226396b_N.mzML; RAW_FILE_NAME=A21226396b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	SB-C1	Treatment:son-bulb maturity period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226400b_N.mzML; RAW_FILE_NAME=A21226400b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	SB-C2	Treatment:son-bulb maturity period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226401b_N.mzML; RAW_FILE_NAME=A21226401b_P.mzML
SUBJECT_SAMPLE_FACTORS           	-	SB-C3	Treatment:son-bulb maturity period	Genotype=Cultivated type; Compounds=Level 3; RAW_FILE_NAME=A21226402b_N.mzML; RAW_FILE_NAME=A21226402b_P.mzML
#COLLECTION
CO:COLLECTION_SUMMARY            	In this study, materials of C. yanhusuo bulbs were cultivated in the field,
CO:COLLECTION_SUMMARY            	which was proposed and identified by Professor Da-xia Chen. On April 6th
CO:COLLECTION_SUMMARY            	(expansion period) and April 26th (maturity period), samples of the "mother
CO:COLLECTION_SUMMARY            	bulb" and "son bulb" of C. yanhusuo were collected. After washing, the samples
CO:COLLECTION_SUMMARY            	were immediately placed into liquid nitrogen for quick freezing and then
CO:COLLECTION_SUMMARY            	transferred to an ultralow temperature refrigerator for storage
CO:SAMPLE_TYPE                   	Plant
#TREATMENT
TR:TREATMENT_SUMMARY             	Different suborgan parts and development periods of C. yanhusuo bulb. MB-A:
TR:TREATMENT_SUMMARY             	mother-bulb expansion period, SB-A: son-bulb expansion period, MB-C: mother-bulb
TR:TREATMENT_SUMMARY             	maturity period, SB-C: son-bulb maturity period.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	After vacuum freeze-drying, the biological sample was crushed at 30 Hz for 1.5
SP:SAMPLEPREP_SUMMARY            	minutes using a mixer (MM 400, Retsch) with zirconia beads. One hundred
SP:SAMPLEPREP_SUMMARY            	milligrams of lyophilized powder was accurately weighed, dissolved in 1.2 ml of
SP:SAMPLEPREP_SUMMARY            	70% methanol solution, rotated every 30 minutes for 30 seconds, repeated 6
SP:SAMPLEPREP_SUMMARY            	times, and placed in a refrigerator at 4 °C for 12 h. Finally, after
SP:SAMPLEPREP_SUMMARY            	centrifuging the solution at 12 000 rpm for 10 minutes, the extract was filtered
SP:SAMPLEPREP_SUMMARY            	(SCAA-104, 0.22 μm pore size; ANPEL, Shanghai, China, http://www.anpel.com.cn/)
SP:SAMPLEPREP_SUMMARY            	to perform UPLC‒MS/MS analysis.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	HILIC
CH:INSTRUMENT_NAME               	SHIMADZU Nexera X2
CH:COLUMN_NAME                   	Agilent SB-C18 (1.8 µm, 2.1 mm * 100 mm)
CH:SOLVENT_A                     	pure water with 0.1% formic acid
CH:SOLVENT_B                     	acetonitrile with 0.1% formic acid
CH:FLOW_GRADIENT                 	95% A, 5% B. Within 9 min, a linear gradient to 5% A, 95% B was programmed, and
CH:FLOW_GRADIENT                 	a composition of 5% A, 95% B was kept for 1 min. Subsequently, a composition of
CH:FLOW_GRADIENT                 	95% A, 5.0% B was adjusted within 1.1 min and kept for 2.9 min
CH:FLOW_RATE                     	0.35 mL/min
CH:COLUMN_TEMPERATURE            	40°C
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	ABI Sciex API 4000 QTrap
MS:INSTRUMENT_TYPE               	QTRAP
MS:MS_TYPE                       	APCI
MS:ION_MODE                      	NEGATIVE
MS:MS_COMMENTS                   	LIT and triple quadrupole (QQQ) scans were acquired on a triple
MS:MS_COMMENTS                   	quadrupole-linear ion trap mass spectrometer (Q TRAP), AB4500 Q TRAP UPLC/MS/MS
MS:MS_COMMENTS                   	System, equipped with an ESI Turbo Ion-Spray interface, operating in positive
MS:MS_COMMENTS                   	and negative ion mode and controlled by Analyst 1.6.3 software (AB Sciex). The
MS:MS_COMMENTS                   	ESI source operation parameters were as follows: ion source, turbo spray; source
MS:MS_COMMENTS                   	temperature 550°C; ion spray voltage (IS) 5500 V (positive ion mode)/-4500 V
MS:MS_COMMENTS                   	(negative ion mode); ion source gas I (GSI), gas II(GSII), curtain gas (CUR)
MS:MS_COMMENTS                   	were set at 50, 60, and 25.0 psi, respectively; the collision-activated
MS:MS_COMMENTS                   	dissociation(CAD) was high. Instrument tuning and mass calibration were
MS:MS_COMMENTS                   	performed with 10 and 100 μmol/L polypropylene glycol solutions in QQQ and LIT
MS:MS_COMMENTS                   	modes, respectively. QQQ scans were acquired as MRM experiments with collision
MS:MS_COMMENTS                   	gas (nitrogen) set to medium. DP and CE for individual MRM transitions was done
MS:MS_COMMENTS                   	with further DP and CE optimization. A specific set of MRM transitions were
MS:MS_COMMENTS                   	monitored for each period according to the metabolites eluted within this
MS:MS_COMMENTS                   	period.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	peak area
MS_METABOLITE_DATA_START
Samples	MB-A1	MB-A2	MB-A3	SB-A1	SB-A2	SB-A3	MB-C1	MB-C2	MB-C3	SB-C1	SB-C2	SB-C3
Factors	Treatment:mother-bulb expansion period	Treatment:mother-bulb expansion period	Treatment:mother-bulb expansion period	Treatment:son-bulb expansion period	Treatment:son-bulb expansion period	Treatment:son-bulb expansion period	Treatment:mother-bulb maturity period	Treatment:mother-bulb maturity period	Treatment:mother-bulb maturity period	Treatment:son-bulb maturity period	Treatment:son-bulb maturity period	Treatment:son-bulb maturity period
N-Methylglycine	8.44E+03	8.57E+03	8.31E+03	9.73E+03	1.23E+04	1.10E+04	1.18E+04	1.16E+04	1.17E+04	1.23E+04	9.49E+03	9.76E+03
3-Hydroxybutyric acid	1.74E+05	1.65E+05	1.82E+05	4.25E+05	3.31E+05	3.78E+05	4.08E+05	2.70E+05	3.39E+05	3.66E+05	3.70E+05	3.23E+05
Malonic acid	1.58E+05	1.51E+05	1.66E+05	4.14E+05	2.98E+05	3.56E+05	3.48E+05	2.69E+05	3.08E+05	3.20E+05	3.50E+05	3.21E+05
Uracil	2.95E+04	3.77E+04	2.13E+04	5.07E+04	3.73E+04	4.40E+04	2.61E+04	2.12E+04	2.37E+04	2.66E+04	1.79E+04	2.77E+04
Fumaric acid	5.73E+06	7.39E+06	4.07E+06	6.11E+06	5.91E+06	6.01E+06	8.88E+05	1.06E+06	9.74E+05	3.51E+06	2.33E+06	1.71E+06
D-Erythronolactone	3.29E+04	3.07E+04	3.50E+04	2.30E+04	3.60E+04	2.95E+04	2.78E+04	2.85E+04	2.81E+04	3.36E+04	4.68E+04	2.56E+04
Methylmalonic acid*	6.07E+07	6.32E+07	5.82E+07	3.34E+07	4.57E+07	3.95E+07	1.76E+07	2.38E+07	2.07E+07	2.37E+07	2.31E+07	2.41E+07
Succinic acid*	5.79E+07	6.05E+07	5.53E+07	3.33E+07	4.58E+07	3.95E+07	1.73E+07	2.37E+07	2.05E+07	2.31E+07	2.28E+07	2.49E+07
β-Hydroxyisovaleric acid	9.58E+04	9.85E+04	9.30E+04	8.68E+05	4.90E+05	6.79E+05	2.21E+05	1.11E+05	1.66E+05	2.64E+05	3.14E+05	3.38E+05
Aminomalonic acid	1.70E+06	1.76E+06	1.65E+06	9.49E+05	1.31E+06	1.13E+06	5.17E+05	6.46E+05	5.81E+05	6.30E+05	5.98E+05	6.07E+05
L-Cysteine	1.61E+04	1.30E+04	1.92E+04	2.02E+04	1.63E+04	1.83E+04	1.31E+04	1.65E+04	1.48E+04	1.48E+04	1.78E+04	1.31E+04
4-Hydroxybenzaldehyde	1.97E+05	1.89E+05	2.05E+05	4.29E+05	3.28E+05	3.78E+05	2.68E+05	3.28E+05	2.98E+05	4.76E+05	4.51E+05	3.45E+05
2-Picolinic acid	5.92E+04	7.16E+04	4.69E+04	1.53E+05	1.24E+05	1.38E+05	1.89E+04	1.92E+04	1.90E+04	9.60E+03	1.70E+04	2.22E+04
Methylenesuccinic acid	9.12E+04	7.00E+04	1.12E+05	9.22E+04	7.59E+04	8.40E+04	1.32E+05	1.53E+05	1.43E+05	1.26E+05	1.19E+05	1.01E+05
3-Guanidinopropionic acid	9.75E+04	8.77E+04	1.07E+05	1.52E+05	1.26E+05	1.39E+05	2.67E+05	1.12E+05	1.89E+05	1.06E+05	9.58E+04	1.02E+05
Glutaric acid*	6.11E+05	6.65E+05	5.57E+05	7.63E+05	6.18E+05	6.90E+05	8.14E+05	5.57E+05	6.85E+05	1.28E+06	1.03E+06	1.03E+06
2-Methylsuccinic acid*	6.01E+05	4.97E+05	7.04E+05	7.00E+05	7.34E+05	7.17E+05	8.10E+05	5.01E+05	6.55E+05	9.07E+05	7.90E+05	7.02E+05
Dimethylmalonic acid*	3.32E+04	2.91E+04	3.73E+04	4.61E+04	4.28E+04	4.44E+04	4.73E+04	2.80E+04	3.77E+04	5.56E+04	4.40E+04	3.53E+04
Ethylmalonic acid	2.22E+04	2.66E+04	1.79E+04	2.92E+04	1.92E+04	2.42E+04	2.40E+04	1.35E+04	1.87E+04	5.71E+04	4.35E+04	4.71E+04
4-Hydroxy-2-Oxopentanoic Acid*	3.77E+04	3.67E+04	3.86E+04	5.95E+04	6.13E+04	6.04E+04	5.76E+04	3.55E+04	4.65E+04	4.88E+04	5.81E+04	4.19E+04
3-Ureidopropionic Acid	4.49E+04	4.89E+04	4.09E+04	6.71E+04	6.55E+04	6.63E+04	3.67E+04	3.91E+04	3.79E+04	2.16E+04	4.24E+04	2.84E+04
2-Hydroxyisocaproic acid*	7.94E+04	9.45E+04	6.43E+04	5.19E+04	7.64E+04	6.41E+04	9.00E+00	9.00E+00	9.00E+00	9.00E+00	9.00E+00	9.00E+00
2-Hydroxy-4-methylpentanoic acid*	3.19E+04	1.85E+04	4.54E+04	9.00E+00	9.00E+00	9.00E+00	5.21E+04	4.69E+04	4.95E+04	1.76E+04	2.93E+04	3.37E+04
Iminodiacetic acid	1.52E+06	1.56E+06	1.48E+06	1.90E+06	1.46E+06	1.68E+06	2.10E+06	2.65E+06	2.37E+06	1.77E+06	2.06E+06	2.12E+06
L-Aspartic Acid	1.34E+07	1.41E+07	1.27E+07	1.73E+07	1.35E+07	1.54E+07	2.07E+07	2.49E+07	2.28E+07	1.69E+07	1.82E+07	1.94E+07
3-Dehydro-L-Threonic Acid	1.93E+07	2.42E+07	1.44E+07	1.51E+07	1.68E+07	1.59E+07	7.25E+06	1.02E+07	8.72E+06	1.49E+07	1.81E+07	1.09E+07
L-Malic acid	6.04E+07	7.21E+07	4.87E+07	5.07E+07	5.38E+07	5.22E+07	2.70E+07	3.50E+07	3.10E+07	4.99E+07	5.89E+07	3.76E+07
2,3-Dihydroxy-3-Methylbutanoic Acid	1.41E+07	1.79E+07	1.04E+07	9.48E+06	1.10E+07	1.02E+07	4.78E+06	7.11E+06	5.94E+06	9.30E+06	1.23E+07	7.77E+06
D-Threonic Acid	8.60E+05	4.95E+05	1.23E+06	2.67E+05	6.33E+05	4.50E+05	4.72E+05	4.80E+05	4.76E+05	7.07E+05	7.43E+05	9.60E+05
Phenyl acetate*	1.21E+06	1.39E+06	1.03E+06	1.85E+06	1.48E+06	1.66E+06	3.87E+04	5.44E+04	4.66E+04	9.55E+04	8.24E+04	5.68E+05
4'-Hydroxyacetophenone*	1.05E+06	1.29E+06	8.20E+05	1.64E+06	1.32E+06	1.48E+06	3.87E+04	3.89E+04	3.88E+04	1.05E+05	6.58E+04	4.24E+05
2,5-Dihydroxybenzaldehyde*	1.78E+05	2.16E+05	1.40E+05	2.83E+05	2.20E+05	2.52E+05	1.16E+05	8.17E+04	9.88E+04	2.49E+05	1.64E+05	1.63E+05
3-Hydroxybenzoic Acid	1.12E+05	9.54E+04	1.29E+05	1.50E+05	1.07E+05	1.28E+05	4.61E+04	2.77E+04	3.69E+04	2.88E+04	2.82E+04	1.59E+04
Protocatechualdehyde	1.73E+05	1.90E+05	1.56E+05	2.47E+05	2.30E+05	2.39E+05	1.37E+05	1.28E+05	1.32E+05	1.37E+05	1.36E+05	1.24E+05
Salicylic acid	1.53E+05	7.54E+04	2.30E+05	3.23E+05	2.96E+05	3.10E+05	1.31E+05	3.85E+04	8.47E+04	5.13E+04	6.11E+04	4.12E+04
4-Hydroxybenzoic acid*	2.59E+05	2.82E+05	2.36E+05	4.18E+05	3.62E+05	3.90E+05	1.44E+05	2.02E+05	1.73E+05	1.57E+05	2.84E+05	2.40E+05
O-Phosphorylethanolamine	8.14E+04	7.08E+04	9.21E+04	2.98E+05	2.18E+05	2.58E+05	7.04E+04	6.27E+04	6.65E+04	7.34E+04	6.08E+04	5.55E+04
Valproic Acid	5.48E+05	5.31E+05	5.66E+05	7.55E+05	6.77E+05	7.16E+05	5.17E+05	5.51E+05	5.34E+05	5.28E+05	5.35E+05	5.51E+05
α-Ketoglutaric acid	7.48E+05	8.94E+05	6.02E+05	7.22E+05	8.96E+05	8.09E+05	2.01E+05	2.01E+05	2.01E+05	2.48E+05	2.32E+05	2.18E+05
2-Methylglutaric acid*	1.60E+05	1.79E+05	1.42E+05	3.51E+05	2.82E+05	3.16E+05	3.33E+05	2.29E+05	2.81E+05	3.80E+05	4.66E+05	3.84E+05
2,2-Dimethylsuccinic acid	4.23E+05	4.68E+05	3.78E+05	5.58E+05	5.57E+05	5.58E+05	3.74E+04	2.77E+04	3.25E+04	1.94E+04	2.02E+04	2.38E+04
Adipic Acid*	3.01E+05	2.92E+05	3.10E+05	8.55E+05	5.68E+05	7.11E+05	2.11E+05	1.87E+05	1.99E+05	3.00E+05	2.31E+05	2.63E+05
2-Acetyl-2-Hydroxybutanoic Acid	3.73E+04	2.86E+04	4.61E+04	1.04E+05	6.74E+04	8.55E+04	2.09E+04	1.80E+04	1.95E+04	2.76E+04	3.52E+04	1.96E+04
L-threo-3-Methylaspartate	5.89E+06	4.55E+06	7.24E+06	4.69E+06	5.19E+06	4.94E+06	6.17E+06	5.66E+06	5.92E+06	4.88E+06	4.85E+06	5.46E+06
3-Methylmalic acid	3.16E+05	3.08E+05	3.23E+05	4.01E+05	3.69E+05	3.85E+05	3.45E+05	3.21E+05	3.33E+05	3.37E+05	3.43E+05	3.22E+05
L-Citramalic acid	2.89E+05	3.17E+05	2.61E+05	2.11E+05	2.74E+05	2.42E+05	1.05E+05	1.72E+05	1.39E+05	1.91E+05	2.15E+05	1.39E+05
D-Arabinono-1,4-lactone	6.61E+04	8.08E+04	5.13E+04	6.38E+04	7.05E+04	6.72E+04	2.82E+04	2.47E+04	2.65E+04	1.66E+04	3.11E+04	2.52E+04
L-Tartaric acid	2.57E+04	2.90E+04	2.23E+04	4.77E+04	4.48E+04	4.62E+04	3.64E+03	7.58E+03	5.61E+03	2.66E+04	1.93E+04	5.96E+03
D-Ribose	2.23E+04	3.35E+04	1.11E+04	2.07E+04	3.10E+04	2.58E+04	6.00E+03	4.87E+03	5.44E+03	8.77E+03	1.14E+04	3.78E+03
D-Arabinose	3.93E+04	5.37E+04	2.49E+04	2.56E+04	2.98E+04	2.77E+04	1.43E+04	1.61E+04	1.52E+04	7.28E+04	6.60E+04	3.51E+04
2(3H)-Benzothiazolone	1.97E+04	1.86E+04	2.07E+04	5.21E+04	4.30E+04	4.75E+04	1.70E+04	1.53E+04	1.61E+04	2.29E+04	1.75E+04	2.32E+04
Vanillin	4.19E+05	3.62E+05	4.76E+05	1.65E+06	1.11E+06	1.38E+06	7.17E+05	5.17E+05	6.17E+05	6.56E+05	6.27E+05	5.43E+05
Ribitol	4.21E+04	4.95E+04	3.46E+04	9.12E+04	6.93E+04	8.02E+04	1.02E+04	1.51E+04	1.26E+04	5.46E+04	3.45E+04	1.07E+04
Xylitol	1.77E+04	1.36E+04	2.17E+04	3.52E+03	1.96E+04	1.16E+04	1.58E+04	1.75E+04	1.66E+04	2.76E+04	2.04E+04	2.50E+04
5-Acetamidopentanoic Acid	1.24E+05	1.20E+05	1.27E+05	1.32E+05	1.12E+05	1.22E+05	3.02E+05	1.30E+05	2.16E+05	6.12E+04	1.12E+05	7.71E+04
Pimelic acid*	6.12E+04	7.69E+04	4.56E+04	1.27E+05	1.05E+05	1.16E+05	6.93E+04	5.48E+04	6.21E+04	1.34E+05	1.19E+05	1.02E+05
2-Propylsuccinic acid*	1.17E+05	1.19E+05	1.14E+05	1.76E+05	1.44E+05	1.60E+05	1.14E+05	7.23E+04	9.32E+04	1.72E+05	1.75E+05	2.08E+05
L-Alanyl-L-Alanine	2.62E+04	2.25E+04	2.99E+04	1.19E+04	1.59E+04	1.39E+04	4.30E+04	1.76E+04	3.03E+04	1.53E+04	1.63E+04	1.53E+04
Indole-3-carboxylic acid	3.06E+04	2.91E+04	3.21E+04	3.40E+04	3.33E+04	3.37E+04	2.78E+04	1.70E+04	2.24E+04	3.23E+04	3.41E+04	3.07E+04
N-Acetyl-L-threonine	9.01E+04	7.70E+04	1.03E+05	2.41E+05	1.92E+05	2.16E+05	2.05E+05	1.21E+05	1.63E+05	1.12E+05	1.15E+05	1.37E+05
4-Hydroxy-2-oxoglutaric acid	2.80E+04	2.23E+04	3.37E+04	3.94E+04	4.28E+04	4.11E+04	2.63E+04	2.27E+04	2.45E+04	3.42E+04	3.08E+04	2.31E+04
3-Hydroxy-3-methylpentane-1,5-dioic acid	4.26E+06	2.95E+06	5.56E+06	1.08E+07	9.05E+06	9.93E+06	6.61E+06	3.22E+06	4.91E+06	4.28E+06	5.81E+06	4.26E+06
4-Hydroxy-L-glutamic acid	9.03E+04	8.56E+04	9.50E+04	1.30E+05	1.15E+05	1.22E+05	1.23E+05	1.53E+05	1.38E+05	1.35E+05	1.41E+05	1.76E+05
Terephthalic acid	5.66E+05	5.10E+05	6.21E+05	5.27E+05	4.70E+05	4.99E+05	4.70E+05	5.54E+05	5.12E+05	5.02E+05	5.43E+05	4.13E+05
D-Xylonic acid	3.76E+06	3.79E+06	3.73E+06	3.73E+06	3.98E+06	3.85E+06	3.69E+06	3.08E+06	3.39E+06	4.70E+06	5.47E+06	4.37E+06
9-Oxononanoic acid	8.64E+03	1.09E+04	6.37E+03	1.65E+04	1.43E+04	1.54E+04	3.76E+04	2.11E+04	2.93E+04	5.40E+04	6.43E+04	1.03E+05
Dehydroascorbic acid	6.56E+05	7.30E+05	5.82E+05	7.37E+05	8.00E+05	7.69E+05	5.77E+05	5.71E+05	5.74E+05	5.43E+05	5.16E+05	4.87E+05
N-Alpha-Acetyl-L-Asparagine	3.36E+06	3.00E+06	3.72E+06	3.20E+06	2.90E+06	3.05E+06	6.04E+06	5.86E+06	5.95E+06	7.01E+06	6.70E+06	7.02E+06
Suberic Acid	3.25E+04	1.54E+04	4.96E+04	1.05E+05	8.22E+04	9.35E+04	1.21E+05	1.07E+05	1.14E+05	1.20E+05	1.40E+05	1.52E+05
N-α-Acetyl-L-ornithine	2.72E+07	2.30E+07	3.13E+07	2.89E+07	2.70E+07	2.79E+07	2.55E+07	2.89E+07	2.72E+07	2.12E+07	1.99E+07	2.38E+07
N-Acetyl-L-Aspartic Acid	1.14E+05	1.16E+05	1.12E+05	2.31E+05	1.89E+05	2.10E+05	4.25E+05	1.14E+05	2.70E+05	6.41E+04	7.46E+04	9.32E+04
2-Isopropylmalic Acid*	1.47E+06	1.30E+06	1.64E+06	1.01E+06	1.01E+06	1.01E+06	1.18E+06	1.15E+06	1.16E+06	6.11E+05	7.37E+05	7.17E+05
3-Isopropylmalic Acid*	1.32E+06	1.19E+06	1.46E+06	9.83E+05	9.75E+05	9.79E+05	1.11E+06	8.09E+05	9.60E+05	5.38E+05	6.99E+05	7.69E+05
Isoxanthopterin	3.41E+04	3.08E+04	3.73E+04	5.25E+04	4.37E+04	4.81E+04	7.23E+04	4.95E+04	6.09E+04	6.30E+04	4.23E+04	5.55E+04
D-Fructose*	9.20E+05	1.50E+06	3.44E+05	1.07E+06	1.09E+06	1.08E+06	2.60E+05	3.93E+05	3.26E+05	4.72E+05	5.70E+05	3.69E+05
D-Glucose*	9.35E+05	1.47E+06	4.00E+05	1.06E+06	1.07E+06	1.06E+06	3.14E+05	3.84E+05	3.49E+05	5.11E+05	6.17E+05	3.66E+05
Inositol	1.11E+06	1.67E+06	5.45E+05	1.92E+05	6.52E+05	4.22E+05	1.05E+05	1.16E+05	1.10E+05	2.34E+05	2.42E+05	1.31E+05
Syringaldehyde; 4-Hydroxy-3,5-Dimethoxybenzaldehyde	2.82E+04	3.60E+04	2.04E+04	1.70E+05	1.25E+05	1.48E+05	4.28E+04	2.99E+04	3.63E+04	2.57E+04	4.30E+04	4.85E+04
Dulcitol*	4.12E+04	5.47E+04	2.77E+04	3.16E+04	3.70E+04	3.43E+04	8.82E+04	5.97E+04	7.39E+04	1.56E+05	9.02E+04	7.76E+04
D-Sorbitol	2.65E+04	2.84E+04	2.47E+04	2.05E+04	2.69E+04	2.37E+04	5.62E+04	3.56E+04	4.59E+04	1.08E+05	7.53E+04	4.66E+04
Mannitol*	1.10E+04	1.40E+04	8.11E+03	8.28E+03	1.37E+04	1.10E+04	2.05E+04	1.26E+04	1.65E+04	3.01E+04	3.08E+04	1.62E+04
Oleuropeic acid	5.94E+03	7.33E+03	4.54E+03	1.39E+04	1.13E+04	1.26E+04	4.39E+03	1.88E+03	3.13E+03	6.13E+03	4.56E+03	8.27E+03
Undecylic Acid	2.89E+05	2.85E+05	2.92E+05	3.54E+05	3.36E+05	3.45E+05	3.12E+05	2.76E+05	2.94E+05	2.98E+05	2.90E+05	2.56E+05
Ayapin	8.42E+04	1.06E+05	6.29E+04	1.47E+05	1.08E+05	1.28E+05	1.75E+05	1.42E+05	1.58E+05	2.35E+05	2.85E+05	3.62E+05
N-Acetyl-L-Glutamine	2.60E+04	2.68E+04	2.52E+04	8.88E+04	5.90E+04	7.39E+04	8.74E+03	8.01E+03	8.37E+03	5.91E+03	6.70E+03	5.10E+03
Eucommiol	1.95E+05	2.74E+05	1.15E+05	3.45E+05	2.71E+05	3.08E+05	5.03E+05	3.70E+05	4.37E+05	5.56E+05	6.60E+05	9.40E+05
Azelaic acid	2.58E+06	3.69E+06	1.46E+06	4.18E+06	3.27E+06	3.73E+06	6.11E+06	4.21E+06	5.16E+06	7.33E+06	8.07E+06	1.10E+07
N-Acetyl-L-glutamic acid	5.43E+05	5.03E+05	5.83E+05	7.54E+05	6.02E+05	6.78E+05	1.36E+06	1.17E+06	1.26E+06	1.52E+06	1.15E+06	1.17E+06
N-Acetyl-L-methionine	8.26E+04	8.24E+04	8.28E+04	1.77E+05	1.65E+05	1.71E+05	1.70E+05	1.22E+05	1.46E+05	5.32E+04	6.22E+04	5.38E+04
Citric Acid*	3.54E+07	2.89E+07	4.19E+07	3.22E+07	3.02E+07	3.12E+07	5.50E+07	5.19E+07	5.34E+07	5.81E+07	5.01E+07	5.19E+07
Isocitric Acid*	1.66E+07	1.45E+07	1.87E+07	1.50E+07	1.51E+07	1.50E+07	2.23E+07	2.43E+07	2.33E+07	2.42E+07	2.22E+07	2.37E+07
Quinic Acid	6.00E+05	4.78E+05	7.22E+05	5.85E+05	5.73E+05	5.79E+05	8.70E+05	8.64E+05	8.67E+05	8.99E+05	8.13E+05	8.80E+05
D-Galacturonic acid	8.05E+04	8.69E+04	7.41E+04	8.70E+04	7.50E+04	8.10E+04	8.02E+04	6.67E+04	7.34E+04	7.81E+04	4.55E+04	5.67E+04
D-Glucoronic acid	9.32E+04	1.09E+05	7.79E+04	1.09E+05	1.08E+05	1.08E+05	8.85E+04	9.79E+04	9.32E+04	9.46E+04	5.93E+04	8.70E+04
Ferulic acid	3.19E+04	1.64E+04	4.75E+04	2.92E+05	2.02E+05	2.47E+05	1.02E+05	4.12E+04	7.17E+04	4.74E+04	4.81E+04	4.39E+04
D-Pinitol	1.53E+04	1.41E+04	1.65E+04	4.37E+04	3.41E+04	3.89E+04	1.26E+04	1.08E+04	1.17E+04	1.17E+04	8.21E+03	8.16E+03
Gluconic acid	1.64E+06	1.62E+06	1.66E+06	2.28E+06	2.15E+06	2.21E+06	1.74E+06	1.59E+06	1.67E+06	2.19E+06	2.22E+06	2.12E+06
D-Erythrose-4-phosphate	9.43E+04	9.20E+04	9.66E+04	1.08E+05	1.05E+05	1.07E+05	7.47E+04	6.93E+04	7.20E+04	5.45E+04	5.86E+04	6.26E+04
Dodecanoic acid (Lauric acid)	6.22E+04	5.37E+04	7.08E+04	1.29E+05	1.19E+05	1.24E+05	7.78E+04	7.40E+04	7.59E+04	7.22E+04	7.45E+04	6.12E+04
L-Tryptophan	2.35E+06	2.99E+06	1.71E+06	4.25E+06	3.98E+06	4.11E+06	9.95E+06	7.54E+06	8.75E+06	4.82E+06	7.21E+06	7.94E+06
2,6-Di-tert-butylphenol*	4.44E+05	4.32E+05	4.57E+05	4.73E+05	4.77E+05	4.75E+05	5.05E+05	4.75E+05	4.90E+05	4.78E+05	5.26E+05	4.45E+05
2,4-Di-Tert-Butylphenol*	4.63E+05	4.43E+05	4.82E+05	4.97E+05	4.85E+05	4.91E+05	5.24E+05	4.79E+05	5.02E+05	4.79E+05	4.76E+05	4.77E+05
N-Acetyl-L-phenylalanine	1.04E+05	1.00E+05	1.07E+05	1.25E+05	1.77E+05	1.51E+05	3.96E+05	1.15E+05	2.55E+05	6.47E+04	1.47E+05	8.59E+04
Sinapinaldehyde	9.20E+04	1.40E+05	4.36E+04	9.38E+04	6.56E+04	7.97E+04	1.52E+05	2.21E+05	1.87E+05	1.81E+05	1.87E+05	9.70E+04
3,4-Dimethoxycinnamic acid	2.87E+03	2.28E+03	3.46E+03	2.73E+04	1.72E+04	2.22E+04	1.07E+04	2.45E+03	6.59E+03	6.28E+03	4.00E+03	4.46E+03
D-Galactaric acid*	1.43E+06	1.58E+06	1.28E+06	1.43E+06	1.45E+06	1.44E+06	1.84E+06	1.31E+06	1.57E+06	2.49E+06	2.54E+06	2.23E+06
D-Saccharic acid*	1.31E+06	1.42E+06	1.21E+06	1.37E+06	1.40E+06	1.39E+06	1.80E+06	1.41E+06	1.60E+06	2.12E+06	2.51E+06	2.24E+06
Sedoheptulose	6.12E+05	6.16E+05	6.09E+05	5.76E+05	6.08E+05	5.92E+05	7.34E+05	6.58E+05	6.96E+05	1.01E+06	1.03E+06	8.49E+05
2-Deoxyribose-1-phosphate*	1.15E+07	1.67E+07	6.22E+06	2.14E+07	1.66E+07	1.90E+07	2.69E+06	2.39E+06	2.54E+06	8.06E+06	8.15E+06	4.02E+06
2-Deoxyribose-5'-phosphate*	5.47E+05	7.43E+05	3.51E+05	7.19E+05	6.59E+05	6.89E+05	7.26E+04	1.19E+05	9.58E+04	3.85E+05	2.61E+05	1.84E+05
5-L-Glutamyl-L-amino acid	8.74E+03	8.40E+03	9.08E+03	1.57E+04	1.32E+04	1.44E+04	1.08E+04	1.35E+04	1.22E+04	1.30E+04	1.41E+04	1.61E+04
Myristic Acid	1.12E+07	1.05E+07	1.18E+07	1.36E+07	1.36E+07	1.36E+07	1.13E+07	9.58E+06	1.05E+07	1.03E+07	1.08E+07	1.05E+07
Ribulose-5-phosphate	4.34E+05	4.64E+05	4.04E+05	3.39E+05	3.77E+05	3.58E+05	6.53E+04	1.02E+05	8.37E+04	8.09E+04	1.24E+05	1.19E+05
Confertifoline	1.90E+06	1.89E+06	1.91E+06	2.04E+06	1.93E+06	1.98E+06	2.01E+06	1.98E+06	2.00E+06	2.07E+06	1.76E+06	2.06E+06
Chrysophanol-9-anthrone	1.93E+05	2.14E+05	1.73E+05	2.87E+05	2.71E+05	2.79E+05	2.52E+05	2.42E+05	2.47E+05	3.11E+05	2.71E+05	2.45E+05
Cis-10-Pentadecenoic Acid(C15: 1)	1.96E+05	2.08E+05	1.84E+05	2.87E+05	2.56E+05	2.71E+05	2.43E+05	2.02E+05	2.22E+05	2.13E+05	2.23E+05	2.24E+05
Pentadecanoic Acid	1.74E+05	1.72E+05	1.76E+05	2.76E+05	2.62E+05	2.69E+05	1.34E+05	1.32E+05	1.33E+05	1.30E+05	1.62E+05	1.57E+05
Uridine	4.95E+04	5.21E+04	4.69E+04	5.31E+04	9.07E+04	7.19E+04	5.05E+04	6.86E+04	5.96E+04	4.31E+04	3.64E+04	4.94E+04
Tridecanedioic acid	7.54E+04	8.41E+04	6.67E+04	1.27E+05	9.82E+04	1.12E+05	8.04E+04	6.39E+04	7.22E+04	6.35E+04	6.78E+04	7.40E+04
N-Acetyl-L-Tryptophan	2.09E+05	1.88E+05	2.30E+05	2.22E+05	2.22E+05	2.22E+05	3.31E+05	1.80E+05	2.56E+05	1.34E+05	1.88E+05	1.13E+05
Anhydroglycinol	1.10E+04	1.49E+04	7.08E+03	1.24E+05	6.67E+04	9.52E+04	5.91E+03	2.91E+03	4.41E+03	1.03E+04	9.01E+03	1.09E+04
1-hydroxy-6-hydroxymethyl-anthraquinone	1.11E+04	1.42E+04	8.00E+03	1.09E+05	5.93E+04	8.40E+04	3.83E+03	2.63E+03	3.23E+03	1.16E+04	9.80E+03	6.74E+03
Palmitic acid	6.30E+04	5.83E+04	6.78E+04	6.55E+04	6.48E+04	6.51E+04	5.71E+04	6.39E+04	6.05E+04	5.96E+04	5.26E+04	6.23E+04
D-Glucosamine 1-phosphate	1.39E+04	1.43E+04	1.34E+04	2.68E+04	2.09E+04	2.39E+04	1.01E+04	7.34E+03	8.73E+03	9.20E+03	1.02E+04	9.29E+03
D-Fructose 6-Phosphate*	1.23E+07	1.10E+07	1.36E+07	9.37E+06	9.92E+06	9.65E+06	6.56E+06	7.07E+06	6.82E+06	6.13E+06	6.83E+06	6.23E+06
Glucose-1-phosphate*	1.82E+07	1.66E+07	1.98E+07	1.43E+07	1.50E+07	1.46E+07	9.15E+06	1.07E+07	9.94E+06	1.00E+07	1.09E+07	1.05E+07
D-Glucose 6-phosphate*	1.87E+07	1.75E+07	2.00E+07	1.43E+07	1.53E+07	1.48E+07	9.98E+06	1.03E+07	1.01E+07	9.61E+06	1.05E+07	1.12E+07
Sorbitol-6-phosphate	9.09E+04	9.16E+04	9.02E+04	6.06E+04	6.70E+04	6.38E+04	3.59E+04	5.51E+04	4.55E+04	3.99E+04	4.49E+04	4.76E+04
Abscisic acid	3.71E+04	3.33E+04	4.09E+04	1.27E+05	9.16E+04	1.09E+05	5.08E+04	3.52E+04	4.30E+04	3.43E+04	3.76E+04	4.26E+04
9-(Arabinosyl)hypoxanthine	5.59E+04	9.26E+04	1.91E+04	1.42E+05	2.58E+05	2.00E+05	1.58E+04	8.85E+03	1.23E+04	8.13E+03	1.36E+04	1.10E+04
10-Heptadecenoic Acid	1.23E+06	1.19E+06	1.28E+06	1.89E+06	1.93E+06	1.91E+06	8.56E+05	6.32E+05	7.44E+05	7.93E+05	8.33E+05	8.90E+05
Emodin	3.29E+03	2.73E+03	3.85E+03	4.07E+03	3.95E+03	4.01E+03	4.29E+03	4.23E+03	4.26E+03	4.34E+03	3.70E+03	5.18E+03
1-Octadecanol	1.05E+05	1.08E+05	1.02E+05	1.04E+05	9.97E+04	1.02E+05	1.00E+05	9.62E+04	9.83E+04	9.71E+04	9.79E+04	9.18E+04
Arbutin	2.21E+04	2.84E+04	1.58E+04	1.84E+04	2.46E+04	2.15E+04	1.64E+04	3.98E+04	2.81E+04	9.91E+04	4.63E+04	4.12E+04
2-Hydroxyhexadecanoic acid	1.56E+05	1.75E+05	1.37E+05	4.81E+05	3.71E+05	4.26E+05	9.43E+05	7.70E+05	8.57E+05	1.73E+06	2.19E+06	2.25E+06
Pantetheine	8.48E+04	1.11E+05	5.81E+04	1.22E+05	1.21E+05	1.22E+05	7.20E+03	9.92E+03	8.56E+03	1.04E+04	1.43E+04	8.89E+03
α-Linolenic Acid	8.29E+06	8.53E+06	8.06E+06	9.18E+06	1.20E+07	1.06E+07	6.28E+06	4.07E+06	5.17E+06	4.24E+06	3.16E+06	5.28E+06
γ-Linolenic Acid	4.69E+07	4.74E+07	4.65E+07	5.07E+07	6.13E+07	5.60E+07	3.53E+07	2.43E+07	2.98E+07	2.67E+07	1.96E+07	3.31E+07
Crepenynic acid	9.63E+04	1.04E+05	8.88E+04	1.19E+05	1.53E+05	1.36E+05	7.66E+04	4.46E+04	6.06E+04	5.34E+04	3.83E+04	6.55E+04
p-Coumaroylmalic acid	3.33E+04	4.92E+04	1.75E+04	4.35E+04	3.00E+04	3.67E+04	1.45E+04	6.17E+04	3.81E+04	6.67E+04	9.85E+04	4.22E+04
Linoleic acid	7.45E+07	7.19E+07	7.70E+07	8.41E+07	9.88E+07	9.15E+07	7.68E+07	6.58E+07	7.13E+07	7.40E+07	5.73E+07	7.79E+07
(9Z,11E)-Octadecadienoic acid	3.39E+04	3.45E+04	3.34E+04	3.51E+04	4.52E+04	4.02E+04	3.03E+04	2.77E+04	2.90E+04	2.84E+04	2.22E+04	3.56E+04
Elaidic Acid	2.46E+07	2.75E+07	2.16E+07	3.23E+07	3.77E+07	3.50E+07	2.83E+07	2.02E+07	2.43E+07	2.32E+07	2.03E+07	2.66E+07
11-Octadecanoic acid(Vaccenic acid)	7.20E+06	8.09E+06	6.32E+06	9.98E+06	1.16E+07	1.08E+07	8.25E+06	6.31E+06	7.28E+06	6.71E+06	6.17E+06	7.98E+06
Petroselinic acid	7.27E+06	8.10E+06	6.43E+06	9.70E+06	1.15E+07	1.06E+07	8.38E+06	6.26E+06	7.32E+06	7.04E+06	6.06E+06	8.17E+06
Xanthosine	2.05E+05	2.37E+05	1.72E+05	3.73E+05	4.36E+05	4.05E+05	3.99E+05	4.04E+05	4.01E+05	4.22E+05	3.28E+05	3.41E+05
Stearic Acid	7.43E+07	7.90E+07	6.96E+07	8.55E+07	8.13E+07	8.34E+07	7.10E+07	7.94E+07	7.52E+07	8.85E+07	8.12E+07	1.01E+08
Hexadecanedioic acid	2.37E+04	2.53E+04	2.20E+04	3.60E+04	2.92E+04	3.26E+04	9.96E+04	5.48E+04	7.72E+04	6.40E+04	1.18E+05	1.05E+05
Glucarate O-Phosphoric acid	5.06E+05	5.13E+05	4.99E+05	6.39E+05	5.59E+05	5.99E+05	6.39E+05	6.56E+05	6.48E+05	5.66E+05	5.45E+05	5.39E+05
D-Sedoheptuiose 7-phosphate	9.49E+06	9.22E+06	9.76E+06	1.27E+07	1.10E+07	1.19E+07	1.24E+07	1.19E+07	1.22E+07	1.41E+07	1.07E+07	1.14E+07
Nordihydrocapsiate	8.98E+05	8.57E+05	9.40E+05	9.23E+05	9.26E+05	9.24E+05	9.37E+05	9.70E+05	9.53E+05	9.63E+05	9.89E+05	9.31E+05
2R-hydroxy-9Z,12Z,15Z-octadecatrienoic acid	3.51E+04	3.91E+04	3.11E+04	1.19E+05	8.88E+04	1.04E+05	9.68E+04	5.59E+04	7.64E+04	6.90E+04	1.37E+05	1.31E+05
13-Hydroxy-6,9,11-octadecatrienoic acid	1.15E+05	1.09E+05	1.20E+05	1.23E+05	1.30E+05	1.27E+05	1.12E+05	1.20E+05	1.16E+05	1.43E+05	1.23E+05	1.32E+05
17-Hydroxylinolenic acid	5.00E+04	4.85E+04	5.15E+04	7.14E+04	6.27E+04	6.71E+04	1.04E+05	9.47E+04	9.93E+04	9.80E+04	1.24E+05	1.16E+05
Machilusolide D	5.01E+04	5.81E+04	4.21E+04	1.83E+05	1.35E+05	1.59E+05	1.38E+05	7.07E+04	1.04E+05	8.81E+04	1.91E+05	1.74E+05
9(10)-EpOME;(9R,10S)-(12Z)-9,10-Epoxyoctadecenoic acid	2.11E+04	2.16E+04	2.06E+04	7.85E+04	5.40E+04	6.62E+04	7.43E+04	8.01E+04	7.72E+04	1.02E+05	1.14E+05	1.31E+05
13(S)-HODE;13(S)-Hydroxyoctadeca-9Z,11E-dienoic acid	7.07E+04	7.09E+04	7.06E+04	1.20E+05	1.20E+05	1.20E+05	1.32E+05	1.39E+05	1.36E+05	1.52E+05	1.63E+05	1.93E+05
9S-Hydroxy-10E,12Z-octadecadienoic acid	7.09E+04	7.43E+04	6.76E+04	1.26E+05	1.21E+05	1.23E+05	1.17E+05	1.34E+05	1.26E+05	1.63E+05	1.63E+05	1.91E+05
12,13-Epoxy-9-Octadecenoic Acid	8.86E+03	7.62E+03	1.01E+04	3.15E+04	2.28E+04	2.71E+04	2.49E+04	3.41E+04	2.95E+04	3.67E+04	3.89E+04	4.24E+04
Ricinoleic acid	2.96E+04	3.46E+04	2.46E+04	4.08E+04	4.46E+04	4.27E+04	9.74E+03	1.00E+04	9.89E+03	9.49E+03	9.62E+03	9.49E+03
1-Eicosanol	3.23E+04	3.65E+04	2.81E+04	3.89E+04	4.54E+04	4.22E+04	1.10E+04	9.72E+03	1.04E+04	1.03E+04	1.39E+04	1.23E+04
8-Hydroxyguanosine	5.72E+04	4.07E+04	7.37E+04	5.49E+04	4.92E+04	5.21E+04	1.20E+05	1.08E+05	1.14E+05	1.09E+05	8.57E+04	9.95E+04
1-O-Salicyl-D-glucose*	3.92E+05	2.69E+05	5.16E+05	2.01E+05	2.77E+05	2.39E+05	1.33E+06	2.36E+05	7.81E+05	5.12E+04	1.97E+05	6.92E+04
Salicylic acid-2-O-glucoside*	1.85E+05	1.24E+05	2.47E+05	4.14E+05	3.26E+05	3.70E+05	1.90E+05	1.31E+05	1.61E+05	1.18E+05	1.61E+05	8.84E+04
Glucosyloxybenzoic acid*	3.81E+05	2.57E+05	5.04E+05	2.33E+05	2.95E+05	2.64E+05	1.28E+06	2.56E+05	7.67E+05	6.42E+04	1.79E+05	6.32E+04
4'-Hydroxy-5,7-dimethoxyflavanone	3.37E+06	3.14E+06	3.60E+06	3.29E+06	3.51E+06	3.40E+06	2.73E+06	3.57E+06	3.15E+06	3.74E+06	3.09E+06	3.64E+06
Salidroside	2.02E+04	3.10E+04	9.38E+03	7.57E+04	6.84E+04	7.21E+04	7.31E+03	9.72E+03	8.51E+03	9.74E+03	1.27E+04	6.32E+03
Doitungbiphenyl A	2.50E+04	3.89E+04	1.12E+04	8.62E+04	7.22E+04	7.92E+04	9.44E+03	1.05E+04	9.95E+03	2.07E+04	7.69E+03	9.81E+03
Dehydroabietic acid	1.96E+05	1.92E+05	1.99E+05	2.36E+05	2.68E+05	2.52E+05	2.42E+05	2.07E+05	2.25E+05	2.71E+05	2.45E+05	2.39E+05
2R-Hydroxyoctadecanoic Acid	1.80E+04	1.62E+04	1.98E+04	2.43E+04	2.15E+04	2.29E+04	1.76E+04	1.86E+04	1.81E+04	1.93E+04	2.27E+04	1.97E+04
3-Hydroxyoctadecanoic Acid	2.04E+05	2.01E+05	2.06E+05	2.46E+05	2.72E+05	2.59E+05	2.46E+05	2.02E+05	2.24E+05	2.77E+05	1.84E+05	2.39E+05
N-Acetyl-D-glucosamine-1-phosphate	2.34E+05	2.23E+05	2.46E+05	1.83E+05	1.91E+05	1.87E+05	1.55E+05	1.55E+05	1.55E+05	1.91E+05	1.79E+05	1.98E+05
Tachioside	1.26E+05	1.10E+05	1.42E+05	4.54E+05	3.11E+05	3.82E+05	1.08E+05	1.20E+05	1.14E+05	1.69E+05	1.02E+05	6.43E+04
Pimaric acid	9.00E+00	9.00E+00	9.00E+00	1.06E+05	1.20E+05	1.13E+05	6.22E+04	5.43E+04	5.83E+04	2.44E+05	1.59E+05	1.52E+05
Arachidonic Acid	3.08E+03	1.17E+03	4.98E+03	4.29E+03	1.38E+04	9.04E+03	5.08E+03	2.07E+03	3.58E+03	2.52E+03	5.20E+03	5.50E+03
2'-Deoxycytidine-5'-monophosphate	2.49E+05	1.56E+05	3.43E+05	1.68E+04	9.00E+03	1.29E+04	1.58E+06	3.23E+05	9.53E+05	6.65E+04	2.20E+05	6.33E+04
Glutathione reduced form	9.00E+00	9.00E+00	9.00E+00	1.10E+04	1.23E+04	1.17E+04	2.98E+03	5.01E+05	2.52E+05	5.34E+05	6.45E+05	6.98E+05
Eicosadienoic acid	1.77E+05	1.81E+05	1.73E+05	2.23E+05	3.01E+05	2.62E+05	1.67E+05	1.19E+05	1.43E+05	1.68E+05	1.33E+05	1.60E+05
L-Glutamic acid-O-glycoside	1.75E+04	1.89E+04	1.61E+04	2.81E+04	2.23E+04	2.52E+04	1.75E+04	1.35E+04	1.55E+04	2.01E+04	1.80E+04	2.08E+04
Feruloylmalic acid	6.31E+05	8.11E+05	4.51E+05	9.57E+05	7.35E+05	8.46E+05	5.26E+05	5.77E+05	5.51E+05	5.06E+05	5.69E+05	5.32E+05
9-Hydroperoxy-10E,12,15Z-octadecatrienoic acid	1.44E+04	1.24E+04	1.64E+04	1.70E+04	1.71E+04	1.70E+04	1.69E+04	1.49E+04	1.59E+04	1.45E+04	1.68E+04	1.45E+04
9-Hydroxy-12-oxo-10(E),15(Z)-octadecadienoic acid	3.43E+03	4.36E+03	2.51E+03	8.13E+03	6.98E+03	7.56E+03	4.20E+03	3.60E+03	3.90E+03	3.76E+03	4.77E+03	4.27E+03
13(s)-hydroperoxy-(9z,11e,15z)-octadecatrienoic acid	1.32E+05	1.30E+05	1.33E+05	1.69E+05	1.68E+05	1.69E+05	1.17E+05	1.08E+05	1.12E+05	1.13E+05	1.26E+05	9.84E+04
9-Hydroxy-13-oxo-10-octadecenoic Acid	1.60E+04	1.64E+04	1.56E+04	5.88E+04	4.24E+04	5.06E+04	2.47E+04	3.69E+04	3.08E+04	2.76E+04	3.00E+04	2.52E+04
9-Hydroperoxy-9Z,11E-Octadecadienoic Acid	9.00E+00	9.00E+00	9.00E+00	1.62E+05	8.12E+04	1.22E+05	6.82E+04	3.33E+04	5.08E+04	6.55E+04	1.02E+05	1.14E+05
13-Hydroperoxy-9Z,11E-octadecadienoic acid	5.71E+03	6.88E+03	4.53E+03	3.67E+05	1.85E+05	2.76E+05	1.49E+05	7.35E+04	1.11E+05	1.52E+05	2.26E+05	2.45E+05
5S,8R-DiHODE; (5S,8R,9Z,12Z)-5,8-Dihydroxyoctadeca-9,12-dienoate	2.08E+04	1.78E+04	2.37E+04	2.19E+04	2.44E+04	2.31E+04	1.79E+04	2.09E+04	1.94E+04	2.62E+04	2.07E+04	2.04E+04
7S,8S-DiHODE; (9Z,12Z)-(7S,8S)-Dihydroxyoctadeca-9,12-dienoic acid	5.19E+03	6.25E+03	4.13E+03	3.99E+05	2.01E+05	3.00E+05	1.68E+05	7.89E+04	1.24E+05	1.62E+05	2.39E+05	2.59E+05
13S-Hydroperoxy-9Z,11E-octadecadienoic acid	2.40E+04	2.91E+04	1.88E+04	6.49E+04	4.75E+04	5.62E+04	4.16E+04	2.64E+04	3.40E+04	3.26E+04	3.86E+04	5.19E+04
Methyl salicylate-2-O-glucoside	8.99E+04	8.37E+04	9.60E+04	2.60E+05	2.79E+05	2.70E+05	4.98E+04	2.24E+04	3.61E+04	4.63E+04	5.93E+04	2.87E+04
12,13-DHOME; (9Z)-12,13-Dihydroxyoctadec-9-enoic acid	8.24E+03	7.84E+03	8.64E+03	5.88E+04	3.43E+04	4.65E+04	4.48E+04	2.39E+04	3.44E+04	3.28E+04	5.14E+04	4.16E+04
1-O-Gentisoyl-D-glucoside*	4.36E+06	4.25E+06	4.47E+06	1.54E+06	2.40E+06	1.97E+06	4.92E+06	2.97E+06	3.94E+06	8.66E+05	1.34E+06	1.05E+06
Protocatechuic acid-4-O-glucoside*	4.41E+06	4.23E+06	4.58E+06	1.97E+06	3.39E+06	2.68E+06	4.49E+06	3.12E+06	3.80E+06	8.66E+05	1.28E+06	1.04E+06
3,4-dihydroxyphenylethanol-β-D-glucopyranoside	3.77E+04	6.35E+04	1.19E+04	2.18E+05	1.81E+05	1.99E+05	4.09E+04	4.17E+04	4.13E+04	3.77E+04	5.86E+04	2.04E+04
(-)-Jasmonoyl-L-Isoleucine	8.90E+02	1.28E+03	5.03E+02	4.92E+03	3.34E+03	4.13E+03	3.77E+02	9.00E+00	1.93E+02	4.73E+02	9.00E+00	9.00E+00
Uridine 5'-monophosphate	4.22E+04	4.72E+04	3.73E+04	8.32E+04	7.89E+04	8.11E+04	3.40E+04	2.60E+04	3.00E+04	3.26E+04	3.49E+04	3.09E+04
p-Coumaric acid-4-O-glucoside*	1.40E+04	1.47E+04	1.34E+04	1.99E+04	1.58E+04	1.78E+04	8.89E+03	5.88E+03	7.38E+03	5.92E+03	8.98E+03	4.40E+03
Phenylpropionic acid-O-β-D-glucopyranoside	1.99E+04	1.68E+04	2.29E+04	2.49E+04	1.70E+04	2.10E+04	8.41E+03	1.14E+04	9.88E+03	5.37E+03	7.80E+03	7.35E+03
1-O-[(E)-p-Cumaroyl]-D-glucose*	3.39E+04	3.11E+04	3.67E+04	4.35E+04	3.21E+04	3.78E+04	1.67E+04	1.58E+04	1.62E+04	1.22E+04	1.31E+04	1.26E+04
Raspberryketone glucoside	1.50E+07	2.35E+07	6.57E+06	1.47E+07	1.66E+07	1.57E+07	2.96E+05	4.16E+05	3.56E+05	3.81E+05	5.29E+05	3.29E+05
Cyclic 3',5'-Adenylic acid	3.16E+04	3.30E+04	3.02E+04	9.98E+04	6.99E+04	8.49E+04	2.22E+04	2.72E+04	2.47E+04	1.87E+04	1.45E+04	1.42E+04
N-Feruloyloctopamine	3.97E+05	3.65E+05	4.29E+05	2.63E+06	2.41E+06	2.52E+06	1.71E+06	1.52E+06	1.62E+06	2.89E+05	1.10E+06	3.79E+05
3-O-Acetylhamayne	4.97E+04	3.33E+04	6.60E+04	2.98E+05	2.51E+05	2.74E+05	2.05E+05	1.71E+05	1.88E+05	2.61E+04	1.12E+05	3.17E+04
3,4,5-Trimethoxyphenyl-1-O-Glucoside	1.64E+05	1.20E+05	2.08E+05	4.58E+05	2.92E+05	3.75E+05	2.65E+05	9.28E+04	1.79E+05	1.05E+05	8.36E+04	5.00E+04
9,10,11-Trihydroxy-12-octadecenoic acid	6.26E+03	6.86E+03	5.66E+03	2.59E+04	1.63E+04	2.11E+04	1.11E+04	1.27E+04	1.19E+04	1.21E+04	1.72E+04	1.78E+04
9,10,13-Trihydroxy-11-Octadecenoic Acid	1.07E+05	1.20E+05	9.31E+04	3.97E+05	2.50E+05	3.24E+05	1.38E+05	1.59E+05	1.48E+05	1.44E+05	1.89E+05	1.88E+05
9,10-Dihydroxy-12,13-epoxyoctadecanoic acid	7.10E+03	7.27E+03	6.93E+03	9.97E+03	9.21E+03	9.59E+03	8.91E+03	7.98E+03	8.44E+03	1.05E+04	8.63E+03	8.66E+03
1-O-Galloyl-D-glucose	1.65E+05	1.39E+05	1.91E+05	8.37E+04	8.30E+04	8.34E+04	1.67E+05	1.05E+05	1.36E+05	4.91E+04	4.84E+04	3.55E+04
Koaburaside*	3.67E+05	4.13E+05	3.20E+05	5.81E+05	5.25E+05	5.53E+05	2.87E+05	3.55E+05	3.21E+05	3.36E+05	2.63E+05	2.32E+05
2-(3,4-dihydroxyphenyl)ethanediol 1-O-β-D-glucopyranoside*	3.63E+05	3.83E+05	3.42E+05	6.23E+05	5.47E+05	5.85E+05	2.84E+05	3.76E+05	3.30E+05	3.44E+05	2.69E+05	1.99E+05
1-(sn-Glycero-3-phospho)-1D-myo-inositol	2.50E+05	3.48E+05	1.52E+05	4.54E+05	3.68E+05	4.11E+05	4.45E+04	8.44E+04	6.44E+04	6.90E+04	1.22E+05	8.53E+04
D-Fructose-1,6-biphosphate	2.92E+05	3.40E+05	2.45E+05	3.08E+05	4.55E+05	3.81E+05	2.00E+05	1.18E+05	1.59E+05	1.63E+05	2.62E+05	1.35E+05
D-Glucose 1,6-bisphosphate	4.11E+05	4.82E+05	3.40E+05	8.61E+05	6.42E+05	7.51E+05	7.81E+05	4.20E+05	6.00E+05	6.21E+05	1.14E+06	5.55E+05
Docosanoic acid (Behenic acid)	1.50E+04	1.62E+04	1.37E+04	1.02E+04	8.87E+03	9.51E+03	8.20E+03	1.08E+04	9.48E+03	8.60E+03	8.61E+03	1.06E+04
1-O-[(E)-Caffeoyl]-D-glucose*	2.88E+04	5.32E+03	5.23E+04	2.08E+05	1.31E+05	1.69E+05	1.01E+05	1.80E+04	5.93E+04	3.41E+04	2.33E+04	1.42E+04
6-O-Caffeoyl-D-glucose*	3.75E+04	1.41E+04	6.10E+04	2.11E+05	1.35E+05	1.73E+05	9.45E+04	1.61E+04	5.53E+04	3.34E+04	2.61E+04	1.64E+04
Melibiose	1.55E+06	1.63E+06	1.47E+06	9.77E+05	1.24E+06	1.11E+06	1.40E+06	1.63E+06	1.51E+06	1.90E+06	2.32E+06	1.60E+06
Galactinol	8.86E+06	9.25E+06	8.48E+06	4.98E+06	6.41E+06	5.70E+06	7.46E+06	8.04E+06	7.75E+06	1.03E+07	1.29E+07	8.89E+06
Lactobiose*	3.07E+06	2.79E+06	3.35E+06	1.67E+06	2.21E+06	1.94E+06	2.96E+06	3.57E+06	3.26E+06	3.53E+06	5.53E+06	3.70E+06
D-Trehalose*	2.06E+06	2.02E+06	2.09E+06	7.55E+05	1.28E+06	1.02E+06	1.78E+06	2.81E+06	2.29E+06	2.73E+06	3.32E+06	2.38E+06
D-Sucrose*	3.02E+06	3.68E+06	2.36E+06	1.57E+06	2.12E+06	1.85E+06	2.13E+06	2.42E+06	2.28E+06	2.77E+06	3.30E+06	2.34E+06
D-Maltose*	2.92E+06	2.82E+06	3.03E+06	1.56E+06	2.43E+06	2.00E+06	3.36E+06	4.70E+06	4.03E+06	4.40E+06	5.90E+06	4.26E+06
Isomaltulose*	4.10E+06	4.11E+06	4.09E+06	1.76E+06	2.79E+06	2.27E+06	3.73E+06	4.64E+06	4.19E+06	5.18E+06	6.19E+06	4.44E+06
Guanosine 3',5'-cyclic monophosphate	9.95E+04	1.23E+05	7.63E+04	2.75E+05	1.92E+05	2.33E+05	5.32E+04	4.95E+04	5.13E+04	4.17E+04	4.43E+04	2.36E+04
Chlorogenic acid (3-O-Caffeoylquinic acid)*	2.96E+04	3.47E+04	2.46E+04	3.75E+03	9.52E+03	6.64E+03	3.11E+04	2.55E+04	2.83E+04	2.90E+04	3.01E+04	1.53E+04
Cryptochlorogenic acid (4-O-Caffeoylquinic acid)*	3.24E+04	3.92E+04	2.56E+04	2.15E+04	1.73E+04	1.94E+04	2.99E+04	1.30E+04	2.14E+04	2.97E+04	2.33E+04	8.50E+03
1-O-Feruloyl-D-Glucose	1.85E+04	1.90E+04	1.80E+04	3.24E+04	2.01E+04	2.63E+04	6.23E+03	8.54E+03	7.39E+03	5.56E+03	3.62E+03	6.91E+03
Glucosyringic Acid	5.29E+04	3.17E+04	7.42E+04	6.58E+04	4.54E+04	5.56E+04	5.89E+04	7.64E+04	6.77E+04	3.65E+04	4.74E+04	2.62E+04
1-O-Sinapoyl-D-glucose	2.09E+05	2.31E+05	1.87E+05	2.86E+05	2.48E+05	2.67E+05	1.56E+05	1.88E+05	1.72E+05	1.92E+05	1.91E+05	1.67E+05
Roseoside	3.21E+05	3.67E+05	2.74E+05	4.81E+05	4.33E+05	4.57E+05	2.95E+05	3.61E+05	3.28E+05	3.36E+05	3.55E+05	3.63E+05
Benzyl β-primeveroside*	3.04E+05	3.02E+05	3.07E+05	2.83E+05	3.71E+05	3.27E+05	2.80E+05	1.93E+05	2.37E+05	1.35E+05	2.13E+05	1.24E+05
Benzyl-(2''-O-xylosyl)glucoside*	1.88E+05	1.48E+05	2.28E+05	1.40E+05	1.66E+05	1.53E+05	2.37E+05	1.07E+05	1.72E+05	7.01E+04	1.23E+05	8.47E+04
Uridine 5'-diphosphate	1.80E+05	1.80E+05	1.79E+05	1.92E+05	2.80E+05	2.36E+05	8.09E+04	8.45E+04	8.27E+04	6.52E+04	6.29E+04	6.41E+04
Trehalose 6-phosphate	6.22E+04	6.74E+04	5.71E+04	8.48E+04	9.29E+04	8.88E+04	2.10E+04	1.12E+04	1.61E+04	1.82E+04	2.48E+04	1.70E+04
Adenosine 5'-diphosphate	4.34E+05	4.04E+05	4.65E+05	6.19E+05	6.08E+05	6.13E+05	3.39E+05	3.29E+05	3.34E+05	4.20E+05	3.26E+05	3.01E+05
Darendoside A*	4.97E+05	5.71E+05	4.23E+05	7.82E+05	7.97E+05	7.90E+05	4.65E+05	5.20E+05	4.93E+05	5.19E+05	5.96E+05	4.84E+05
Osmanthuside H [2-(4-Hydroxyphenyl)ethyl-β-D-apiosyl-(1→6)-β-D-glucoside]*	5.18E+05	5.96E+05	4.39E+05	8.82E+05	8.64E+05	8.73E+05	5.23E+05	5.63E+05	5.43E+05	5.64E+05	6.24E+05	4.81E+05
Casanthranol	1.95E+05	2.45E+05	1.44E+05	4.32E+05	4.59E+05	4.45E+05	1.39E+04	7.24E+03	1.06E+04	9.00E+00	9.00E+00	9.00E+00
Dihydrocharcone-4'-O-glucoside	4.32E+04	4.76E+04	3.89E+04	3.37E+04	2.60E+04	2.99E+04	2.61E+04	2.11E+04	2.36E+04	2.17E+04	1.58E+04	2.35E+04
Phloretin-2'-O-glucoside (Phlorizin)	2.86E+04	3.59E+04	2.13E+04	2.20E+04	1.66E+04	1.93E+04	1.30E+04	1.61E+04	1.46E+04	1.75E+04	1.35E+04	1.71E+04
Canthoside A	3.48E+04	4.63E+04	2.34E+04	5.84E+04	7.27E+04	6.56E+04	1.49E+04	1.04E+04	1.26E+04	7.66E+04	5.00E+04	4.30E+04
Isomangiferolic acid*	1.91E+05	3.41E+05	4.16E+04	2.12E+04	4.17E+04	3.15E+04	2.24E+05	2.68E+05	2.46E+05	1.19E+05	6.53E+03	3.38E+05
Mangiferolic acid*	2.02E+05	3.56E+05	4.74E+04	2.30E+04	4.03E+04	3.17E+04	2.13E+05	2.77E+05	2.45E+05	1.47E+05	9.19E+03	3.38E+05
24,30-Dihydroxy-12(13)-enolupinol*	2.04E+04	3.28E+04	7.93E+03	9.70E+03	1.22E+04	1.10E+04	2.83E+04	2.15E+04	2.49E+04	2.26E+03	1.18E+04	1.46E+04
Soyasapogenol E*	1.71E+04	2.75E+04	6.66E+03	1.17E+04	1.59E+04	1.38E+04	3.83E+04	1.93E+04	2.88E+04	6.36E+03	1.72E+04	1.12E+04
Betulinic acid*	1.49E+04	2.53E+04	4.48E+03	1.05E+04	1.11E+04	1.08E+04	3.47E+04	2.54E+04	3.01E+04	8.11E+03	1.98E+04	8.16E+03
(23S)-3β-hydroxydammara-21-oic acid 21,23-lactone*	1.79E+05	3.13E+05	4.43E+04	2.01E+04	4.48E+04	3.24E+04	2.26E+05	2.92E+05	2.59E+05	1.24E+05	7.47E+03	3.41E+05
3-Epiursolic acid*	2.46E+04	3.29E+04	1.63E+04	2.44E+04	1.94E+04	2.19E+04	8.15E+03	9.98E+03	9.07E+03	1.47E+04	1.56E+04	1.39E+04
Ursolic acid*	1.88E+05	3.35E+05	4.20E+04	2.24E+04	4.33E+04	3.29E+04	2.13E+05	2.87E+05	2.50E+05	1.25E+05	8.89E+03	3.48E+05
Gallocatechin 3-O-gallate*	2.95E+04	2.62E+04	3.27E+04	1.39E+04	2.05E+04	1.72E+04	2.95E+04	3.38E+04	3.16E+04	5.39E+04	2.85E+04	3.31E+04
Epigallocatechin-3-gallate*	2.22E+04	1.91E+04	2.52E+04	7.57E+03	1.21E+04	9.81E+03	2.62E+04	1.97E+04	2.30E+04	3.49E+04	2.53E+04	2.53E+04
Anthranilate-1-O-Sophoroside	1.21E+06	1.35E+06	1.08E+06	6.65E+05	1.13E+06	8.97E+05	4.24E+06	3.70E+06	3.97E+06	4.32E+06	6.14E+06	4.44E+06
Vnilloylcaffeoyltartaric acid	8.58E+03	1.71E+04	9.00E+00	4.87E+04	3.88E+04	4.38E+04	9.00E+00	9.00E+00	9.00E+00	9.00E+00	9.00E+00	9.00E+00
Tetahydroxyflavone-7-O-glucuronide*	2.54E+04	2.25E+04	2.83E+04	7.06E+03	5.97E+03	6.52E+03	8.04E+03	2.95E+04	1.88E+04	2.63E+04	3.21E+04	5.34E+03
Kaempferol-3-O-glucuronide*	2.44E+04	2.26E+04	2.63E+04	8.71E+03	9.22E+03	8.96E+03	1.34E+04	2.94E+04	2.14E+04	2.57E+04	3.78E+04	9.64E+03
Pomolic acid*	5.55E+03	4.59E+03	6.51E+03	1.04E+04	7.71E+03	9.07E+03	4.84E+03	4.90E+03	4.87E+03	4.59E+03	2.19E+03	3.69E+03
Corosolic acid*	5.79E+04	7.03E+04	4.54E+04	5.74E+04	4.71E+04	5.22E+04	1.39E+04	1.40E+04	1.40E+04	3.38E+04	2.43E+04	2.00E+04
Maslinic acid*	6.29E+04	7.88E+04	4.71E+04	5.92E+04	4.85E+04	5.38E+04	1.59E+04	1.35E+04	1.47E+04	2.94E+04	2.73E+04	2.14E+04
2,3-dihydroxy-12-ursen-28-oic acid*	4.84E+04	6.00E+04	3.68E+04	5.14E+04	4.20E+04	4.67E+04	1.41E+04	1.29E+04	1.35E+04	2.63E+04	2.23E+04	2.04E+04
N-(4-O-(Glucosyl)-E-feruloyl)-tyramine	1.97E+05	1.47E+05	2.47E+05	9.57E+05	9.27E+05	9.42E+05	4.60E+05	1.84E+05	3.22E+05	4.56E+04	1.17E+05	2.48E+04
2α,3α-Dihydroxyursolic acid*	4.37E+04	5.99E+04	2.74E+04	4.45E+04	3.93E+04	4.19E+04	9.05E+03	1.05E+04	9.75E+03	1.56E+04	1.39E+04	1.12E+04
2α,3α,23-trihydroxyolean-12-en-28-oic acid	6.52E+05	6.68E+05	6.36E+05	9.13E+05	8.20E+05	8.66E+05	3.16E+05	2.15E+05	2.66E+05	2.46E+05	2.61E+05	2.41E+05
Rutundic acid*	2.66E+04	3.35E+04	1.97E+04	2.74E+04	2.40E+04	2.57E+04	6.53E+03	4.26E+03	5.39E+03	6.83E+03	7.36E+03	4.34E+03
D-Panose	1.54E+05	2.86E+05	2.08E+04	2.07E+04	1.02E+05	6.15E+04	2.17E+04	1.28E+04	1.73E+04	1.90E+04	2.59E+04	1.58E+04
D-Melezitose	2.33E+05	4.57E+05	9.62E+03	3.74E+04	8.66E+04	6.20E+04	6.61E+03	3.93E+03	5.27E+03	6.35E+03	1.35E+04	7.32E+03
2α,3α,19α,23-tetrahydroxy-12-ursen-28-oic acid	1.58E+05	2.02E+05	1.14E+05	2.19E+05	1.75E+05	1.97E+05	4.60E+04	3.44E+04	4.02E+04	7.05E+04	4.72E+04	4.59E+04
1,3-O-Dicaffeoylquinic Acid (Cynarin)	4.87E+04	4.84E+04	4.90E+04	1.47E+05	1.13E+05	1.30E+05	1.38E+05	7.40E+04	1.06E+05	6.28E+04	7.52E+04	6.63E+04
Di-O-Glucosylquinic acid	1.96E+06	2.27E+06	1.66E+06	1.82E+06	2.12E+06	1.97E+06	5.28E+05	5.82E+05	5.55E+05	3.74E+05	4.70E+05	4.23E+05
Tricin-7-O-saccharic acid	6.53E+04	1.23E+05	7.18E+03	1.55E+04	1.55E+04	1.55E+04	2.40E+04	6.03E+04	4.21E+04	2.46E+04	3.26E+04	1.28E+04
Uridine-5'-Diphosphate-D-Xylose	1.49E+06	1.37E+06	1.61E+06	1.72E+06	1.82E+06	1.77E+06	6.12E+05	5.13E+05	5.63E+05	4.97E+05	5.43E+05	3.76E+05
5'-Methoxymatairesinoside	1.36E+04	1.00E+04	1.73E+04	5.81E+03	9.98E+03	7.90E+03	1.77E+04	7.01E+03	1.23E+04	2.22E+03	8.10E+03	1.72E+03
5'-Methoxyisolariciresinol-9'-O-glucoside	1.18E+04	1.73E+04	6.27E+03	5.10E+03	3.47E+03	4.29E+03	2.07E+04	4.59E+04	3.33E+04	4.43E+04	2.03E+04	1.15E+04
Uridine 5'-diphospho-D-glucose	1.15E+07	1.11E+07	1.20E+07	9.99E+06	1.10E+07	1.05E+07	6.00E+06	5.89E+06	5.95E+06	5.35E+06	5.60E+06	4.84E+06
Uridine 5'-diphospho-N-acetylglucosamine	2.29E+05	2.30E+05	2.27E+05	2.32E+05	2.39E+05	2.36E+05	1.56E+05	1.31E+05	1.43E+05	1.62E+05	1.64E+05	1.79E+05
Quercetin-3-O-robinobioside*	2.70E+04	2.81E+04	2.59E+04	8.26E+04	7.09E+04	7.67E+04	9.00E+00	9.00E+00	9.00E+00	9.00E+00	9.00E+00	9.00E+00
Quercetin-3-O-rutinoside (Rutin)*	2.25E+04	2.06E+04	2.43E+04	8.78E+04	6.55E+04	7.66E+04	1.09E+03	3.08E+03	2.08E+03	2.58E+03	2.58E+03	4.13E+03
Oxiglutatione	3.43E+05	3.78E+05	3.09E+05	5.30E+05	5.81E+05	5.56E+05	2.04E+05	4.63E+05	3.33E+05	4.95E+05	4.66E+05	6.86E+05
Cannabisin D	1.67E+06	1.87E+06	1.47E+06	7.05E+06	4.59E+06	5.82E+06	6.24E+06	8.53E+06	7.38E+06	7.87E+06	7.15E+06	6.06E+06
D(+)-Melezitose O-rhamnoside	1.95E+05	3.54E+05	3.49E+04	7.78E+04	1.69E+05	1.24E+05	3.12E+03	1.14E+03	2.13E+03	2.22E+03	3.97E+03	1.96E+03
Gingerglycolipid A	1.17E+05	1.13E+05	1.21E+05	1.67E+05	2.23E+05	1.95E+05	7.49E+04	6.14E+04	6.82E+04	8.41E+04	6.50E+04	8.38E+04
Gingerglycolipid B	3.62E+05	3.24E+05	3.99E+05	2.73E+05	4.71E+05	3.72E+05	4.04E+05	3.81E+05	3.93E+05	5.92E+05	4.41E+05	5.18E+05
Vaticanol A	1.03E+04	1.76E+04	3.03E+03	8.26E+03	4.57E+03	6.42E+03	2.76E+04	3.94E+03	1.58E+04	1.21E+03	1.62E+03	3.52E+05
NADP (Nicotinamide adenine dinucleotide phosphate)	4.32E+05	4.10E+05	4.54E+05	6.89E+05	6.54E+05	6.71E+05	3.60E+05	2.20E+05	2.90E+05	1.99E+05	2.08E+05	1.85E+05
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	PubChem_ID	kegg_ID
N-Methylglycine	C00213	ko00260,ko00330,ko01100
3-Hydroxybutyric acid	C01089	ko00072,ko00650,ko01100
Malonic acid	C00383	ko00061,ko00240,ko00410,ko01100,ko01212
Uracil	C00106	ko00240,ko00410,ko00770,ko01100
Fumaric acid	C00122	ko00020,ko00190,ko00220,ko00250,ko00350,ko00360,ko00620,ko00650,ko00760,ko01100,ko01110,ko01200
D-Erythronolactone	--	--
Methylmalonic acid*	C02170	ko00240,ko00280,ko00640,ko01100
Succinic acid*	C00042	ko00020,ko00190,ko00250,ko00310,ko00350,ko00360,ko00620,ko00630,ko00640,ko00650,ko00760,ko00920,ko01100,ko01110,ko01200
β-Hydroxyisovaleric acid	C20827	ko00280,ko01100
Aminomalonic acid	C00872	--
L-Cysteine	C00097	ko00260,ko00270,ko00311,ko00332,ko00430,ko00460,ko00480,ko00730,ko00770,ko00920,ko00970,ko01100,ko01110,ko01200,ko01230,ko01240,ko04122
4-Hydroxybenzaldehyde	C00633	ko01100
2-Picolinic acid	C10164	ko00380,ko01100
Methylenesuccinic acid	C00490	ko00660,ko01100
3-Guanidinopropionic acid	C03065	--
Glutaric acid*	C00489	ko00071,ko00310,ko01100
2-Methylsuccinic acid*	--	--
Dimethylmalonic acid*	--	--
Ethylmalonic acid	--	--
4-Hydroxy-2-Oxopentanoic Acid*	C03589	ko00360,ko01100
3-Ureidopropionic Acid	C02642	ko00240,ko00410,ko00770,ko01100
2-Hydroxyisocaproic acid*	C03264	--
2-Hydroxy-4-methylpentanoic acid*	--	--
Iminodiacetic acid	C19911	--
L-Aspartic Acid	C00049	ko00220,ko00250,ko00260,ko00261,ko00270,ko00300,ko00340,ko00410,ko00460,ko00710,ko00760,ko00770,ko00970,ko01100,ko01110,ko01200,ko01210,ko01230,ko01240,ko02010
3-Dehydro-L-Threonic Acid	C03064	ko00053,ko01100
L-Malic acid	C00149	ko00020,ko00620,ko00630,ko00710,ko01100,ko01110,ko01200
2,3-Dihydroxy-3-Methylbutanoic Acid	C04039	--
D-Threonic Acid	C21649	--
Phenyl acetate*	C00548	--
4'-Hydroxyacetophenone*	C10700	ko01100
2,5-Dihydroxybenzaldehyde*	C05585	ko00350,ko01100
3-Hydroxybenzoic Acid	C00587	ko00400
Protocatechualdehyde	C16700	ko00950
Salicylic acid	C00805	ko00360,ko01100,ko01110,ko04075
4-Hydroxybenzoic acid*	C00156	ko00130,ko00790,ko01100,ko01110,ko01240
O-Phosphorylethanolamine	C00346	ko00563,ko00564,ko00600,ko01100
Valproic Acid	C07185	--
α-Ketoglutaric acid	C00026	ko00020,ko00040,ko00053,ko00220,ko00250,ko00300,ko00310,ko00340,ko00430,ko00630,ko00650,ko00660,ko01100,ko01110,ko01200,ko01210,ko01230,ko01240
2-Methylglutaric acid*	--	--
2,2-Dimethylsuccinic acid	--	--
Adipic Acid*	C06104	ko01100
2-Acetyl-2-Hydroxybutanoic Acid	C06006	ko00290,ko01100,ko01110,ko01210,ko01230
L-threo-3-Methylaspartate	C03618	ko00630,ko00660,ko01100,ko01200
3-Methylmalic acid	C06032	ko00290,ko00660,ko01100,ko01210,ko01230
L-Citramalic acid	C02614	ko00660,ko01100
D-Arabinono-1,4-lactone	C00652	ko00053
L-Tartaric acid	C00898	ko00630,ko01100
D-Ribose	C00121	ko00030,ko01100,ko02010
D-Arabinose	C00216	ko00040,ko00053
2(3H)-Benzothiazolone	--	--
Vanillin	C00755	ko00998,ko01100,ko01110
Ribitol	C00474	ko00040,ko00740,ko01100
Xylitol	C00379	ko00040,ko01100,ko02010
5-Acetamidopentanoic Acid	C03087	ko00310,ko01100
Pimelic acid*	C02656	ko00780,ko01100,ko01240
2-Propylsuccinic acid*	C16657	--
L-Alanyl-L-Alanine	--	--
Indole-3-carboxylic acid	C19837	--
N-Acetyl-L-threonine	--	--
4-Hydroxy-2-oxoglutaric acid	C01127	ko00630,ko01100
3-Hydroxy-3-methylpentane-1,5-dioic acid	C03761	--
4-Hydroxy-L-glutamic acid	C03079	--
Terephthalic acid	C06337	ko01100
D-Xylonic acid	C00502	ko00040,ko01100
9-Oxononanoic acid	C16322	ko00592,ko01110
Dehydroascorbic acid	C05422	ko00053,ko00480,ko01100
N-Alpha-Acetyl-L-Asparagine	--	--
Suberic Acid	C08278	--
N-α-Acetyl-L-ornithine	C00437	ko00220,ko01100,ko01110,ko01210,ko01230
N-Acetyl-L-Aspartic Acid	C01042	ko00250,ko01100
2-Isopropylmalic Acid*	C02504	ko00290,ko00620,ko01100,ko01110,ko01210,ko01230
3-Isopropylmalic Acid*	C04411	ko00290,ko01100,ko01110,ko01210,ko01230
Isoxanthopterin	C03975	--
D-Fructose*	C05003	--
D-Glucose*	C00031	ko00010,ko00030,ko00052,ko00500,ko00520,ko00524,ko00901,ko01100,ko01110,ko02010
Inositol	C00137	ko00052,ko00053,ko00562,ko01100,ko01110,ko02010,ko04070
Syringaldehyde; 4-Hydroxy-3,5-Dimethoxybenzaldehyde	--	--
Dulcitol*	C01697	ko00052,ko01100
D-Sorbitol	C00794	ko00051,ko00052,ko01100,ko02010
Mannitol*	C00392	ko00051,ko01100,ko02010
Oleuropeic acid	--	--
Undecylic Acid	C17715	--
Ayapin	C18078	--
N-Acetyl-L-Glutamine	--	--
Eucommiol	C17878	--
Azelaic acid	C08261	--
N-Acetyl-L-glutamic acid	C00624	ko00220,ko01100,ko01110,ko01210,ko01230
N-Acetyl-L-methionine	C02712	--
Citric Acid*	C00158	ko00020,ko00250,ko00630,ko01100,ko01110,ko01200,ko01210,ko01230,ko01240
Isocitric Acid*	C00311	ko00020,ko00630,ko01100,ko01110,ko01200,ko01210,ko01230,ko01240
Quinic Acid	C00296	ko00400,ko01100
D-Galacturonic acid	C00333	ko00040,ko00053,ko00520,ko01100,ko01240,ko02010
D-Glucoronic acid	C00191	ko00040,ko00053,ko00520,ko00562,ko01100,ko01240
Ferulic acid	C01494	ko00940,ko01100,ko01110
D-Pinitol	C03844	--
Gluconic acid	C00257	ko00030,ko01100,ko01110,ko01200
D-Erythrose-4-phosphate	C00279	ko00030,ko00400,ko00710,ko00750,ko00998,ko01100,ko01110,ko01200,ko01230,ko01240
Dodecanoic acid (Lauric acid)	C02679	ko00061,ko01100,ko01110
L-Tryptophan	C00078	ko00260,ko00380,ko00400,ko00901,ko00966,ko00970,ko00998,ko01100,ko01110,ko01210,ko01230,ko01240
2,6-Di-tert-butylphenol*	--	--
2,4-Di-Tert-Butylphenol*	--	--
N-Acetyl-L-phenylalanine	C03519	ko00360,ko01100
Sinapinaldehyde	C05610	ko00940,ko01100,ko01110
3,4-Dimethoxycinnamic acid	--	--
D-Galactaric acid*	C00879	ko00053,ko01100
D-Saccharic acid*	C00818	ko00053,ko01100
Sedoheptulose	C02076	ko00710,ko01100
2-Deoxyribose-1-phosphate*	C00672	ko00030,ko00240,ko01100
2-Deoxyribose-5'-phosphate*	C00673	ko00030,ko01100
5-L-Glutamyl-L-amino acid	--	--
Myristic Acid	C06424	ko00061,ko01100
Ribulose-5-phosphate	C00117	ko00030,ko00230,ko00440,ko00710,ko00750,ko01100,ko01110,ko01200,ko01230,ko01240
Confertifoline	C09376	--
Chrysophanol-9-anthrone	C10314	--
Cis-10-Pentadecenoic Acid(C15: 1)	--	--
Pentadecanoic Acid	C16537	--
Uridine	C00299	ko00240,ko01100,ko02010
Tridecanedioic acid	--	--
N-Acetyl-L-Tryptophan	--	--
Anhydroglycinol	C10200	ko00943,ko01110
1-hydroxy-6-hydroxymethyl-anthraquinone	--	--
Palmitic acid	C00249	ko00061,ko00062,ko00071,ko00073,ko01040,ko01100,ko01212
D-Glucosamine 1-phosphate	C06156	ko00520,ko01100
D-Fructose 6-Phosphate*	C00085	ko00052,ko00500,ko00710,ko01100,ko01110,ko01200
Glucose-1-phosphate*	C00103	ko00010,ko00040,ko00052,ko00500,ko00520,ko00523,ko00561,ko01100,ko01110,ko01240
D-Glucose 6-phosphate*	C00092	ko00500,ko00524,ko00562,ko00998,ko01100,ko01110
Sorbitol-6-phosphate	C01096	ko00051,ko01100
Abscisic acid	C06082	ko00906,ko01100,ko01110,ko04075
9-(Arabinosyl)hypoxanthine	--	--
10-Heptadecenoic Acid	--	--
Emodin	C10343	--
1-Octadecanol	--	--
Arbutin	C06186	ko00010
2-Hydroxyhexadecanoic acid	--	--
Pantetheine	C00831	ko00332,ko00770,ko01110
α-Linolenic Acid	C06427	ko00592,ko01040,ko01100,ko01110
γ-Linolenic Acid	C06426	ko00591,ko01040,ko01100
Crepenynic acid	C07289	ko00591
p-Coumaroylmalic acid	--	--
Linoleic acid	C01595	ko00591,ko01040,ko01100
(9Z,11E)-Octadecadienoic acid	C04056	ko00591
Elaidic Acid	C01712	--
11-Octadecanoic acid(Vaccenic acid)	C21944	--
Petroselinic acid	C08363	--
Xanthosine	C01762	ko00230,ko00232,ko01100,ko01110,ko02010
Stearic Acid	C01530	ko00061,ko01040
Hexadecanedioic acid	C19615	ko00073,ko01100
Glucarate O-Phosphoric acid	--	--
D-Sedoheptuiose 7-phosphate	--	--
Nordihydrocapsiate	--	--
2R-hydroxy-9Z,12Z,15Z-octadecatrienoic acid	C16342	ko00592
13-Hydroxy-6,9,11-octadecatrienoic acid	--	--
17-Hydroxylinolenic acid	C16346	ko00592
Machilusolide D	--	--
9(10)-EpOME;(9R,10S)-(12Z)-9,10-Epoxyoctadecenoic acid	C14825	ko00591,ko01100
13(S)-HODE;13(S)-Hydroxyoctadeca-9Z,11E-dienoic acid	C14762	ko00591
9S-Hydroxy-10E,12Z-octadecadienoic acid	C14767	ko00591
12,13-Epoxy-9-Octadecenoic Acid	C14826	ko00591,ko01100
Ricinoleic acid	C08365	--
1-Eicosanol	--	--
8-Hydroxyguanosine	--	--
1-O-Salicyl-D-glucose*	--	--
Salicylic acid-2-O-glucoside*	--	--
Glucosyloxybenzoic acid*	--	--
4'-Hydroxy-5,7-dimethoxyflavanone	--	--
Salidroside	C06046	ko00350,ko01100
Doitungbiphenyl A	--	--
Dehydroabietic acid	--	--
2R-Hydroxyoctadecanoic Acid	C03042	--
3-Hydroxyoctadecanoic Acid	--	--
N-Acetyl-D-glucosamine-1-phosphate	C04256	--
Tachioside	--	--
Pimaric acid	C09159	--
Arachidonic Acid	C00219	ko00590,ko00591,ko01040,ko01100
2'-Deoxycytidine-5'-monophosphate	C00239	ko00240,ko01100
Glutathione reduced form	C00051	ko00270,ko00480,ko01100,ko01240,ko02010
Eicosadienoic acid	C16525	ko01040
L-Glutamic acid-O-glycoside	--	--
Feruloylmalic acid	--	--
9-Hydroperoxy-10E,12,15Z-octadecatrienoic acid	C16321	ko00592,ko01110
9-Hydroxy-12-oxo-10(E),15(Z)-octadecadienoic acid	C21923	ko00592,ko01110
13(s)-hydroperoxy-(9z,11e,15z)-octadecatrienoic acid	C04785	ko00592,ko01100,ko01110
9-Hydroxy-13-oxo-10-octadecenoic Acid	--	--
9-Hydroperoxy-9Z,11E-Octadecadienoic Acid	C14827	ko00591,ko01100
13-Hydroperoxy-9Z,11E-octadecadienoic acid	--	--
5S,8R-DiHODE; (5S,8R,9Z,12Z)-5,8-Dihydroxyoctadeca-9,12-dienoate	C20186	ko00591
7S,8S-DiHODE; (9Z,12Z)-(7S,8S)-Dihydroxyoctadeca-9,12-dienoic acid	C07354	ko00591
13S-Hydroperoxy-9Z,11E-octadecadienoic acid	C04717	ko00591,ko01100
Methyl salicylate-2-O-glucoside	--	--
12,13-DHOME; (9Z)-12,13-Dihydroxyoctadec-9-enoic acid	C14829	ko00591
1-O-Gentisoyl-D-glucoside*	--	--
Protocatechuic acid-4-O-glucoside*	--	--
3,4-dihydroxyphenylethanol-β-D-glucopyranoside	--	--
(-)-Jasmonoyl-L-Isoleucine	C18699	ko04075
Uridine 5'-monophosphate	C00105	ko00240,ko01100,ko01240
p-Coumaric acid-4-O-glucoside*	C06739	--
Phenylpropionic acid-O-β-D-glucopyranoside	--	--
1-O-[(E)-p-Cumaroyl]-D-glucose*	--	--
Raspberryketone glucoside	--	--
Cyclic 3',5'-Adenylic acid	C00575	ko00230,ko01100
N-Feruloyloctopamine	--	--
3-O-Acetylhamayne	C12165	--
3,4,5-Trimethoxyphenyl-1-O-Glucoside	--	--
9,10,11-Trihydroxy-12-octadecenoic acid	--	--
9,10,13-Trihydroxy-11-Octadecenoic Acid	C14835	ko00591
9,10-Dihydroxy-12,13-epoxyoctadecanoic acid	C14837	ko00591
1-O-Galloyl-D-glucose	C01158	--
Koaburaside*	--	--
2-(3,4-dihydroxyphenyl)ethanediol 1-O-β-D-glucopyranoside*	--	--
1-(sn-Glycero-3-phospho)-1D-myo-inositol	--	--
D-Fructose-1,6-biphosphate	C00354	ko00400,ko00710,ko01100,ko01110,ko01200
D-Glucose 1,6-bisphosphate	C01231	ko00500,ko01100
Docosanoic acid (Behenic acid)	C08281	ko00073,ko01040
1-O-[(E)-Caffeoyl]-D-glucose*	--	--
6-O-Caffeoyl-D-glucose*	--	--
Melibiose	C05402	ko00052,ko01100,ko02010
Galactinol	C01235	ko00052,ko01100
Lactobiose*	C00243	ko00052,ko01100,ko02010
D-Trehalose*	C01083	ko00500,ko01100,ko01110,ko02010
D-Sucrose*	C00089	ko00052,ko00500,ko01100,ko01110,ko02010
D-Maltose*	C01971	--
Isomaltulose*	C01742	--
Guanosine 3',5'-cyclic monophosphate	C00942	ko00230,ko01100
Chlorogenic acid (3-O-Caffeoylquinic acid)*	C00852	ko00940,ko00941,ko00945,ko01110
Cryptochlorogenic acid (4-O-Caffeoylquinic acid)*	--	--
1-O-Feruloyl-D-Glucose	C17759	--
Glucosyringic Acid	--	--
1-O-Sinapoyl-D-glucose	C01175	ko00940
Roseoside	--	--
Benzyl β-primeveroside*	--	--
Benzyl-(2''-O-xylosyl)glucoside*	--	--
Uridine 5'-diphosphate	C00015	ko00240,ko00908,ko01100,ko01240
Trehalose 6-phosphate	C00689	ko00500,ko01100,ko01110
Adenosine 5'-diphosphate	C00008	ko00190,ko00195,ko00230,ko00908,ko01100,ko01110,ko01240
Darendoside A*	--	--
Osmanthuside H [2-(4-Hydroxyphenyl)ethyl-β-D-apiosyl-(1→6)-β-D-glucoside]*	--	--
Casanthranol	--	--
Dihydrocharcone-4'-O-glucoside	--	--
Phloretin-2'-O-glucoside (Phlorizin)	C01604	ko00941,ko01110
Canthoside A	--	--
Isomangiferolic acid*	--	--
Mangiferolic acid*	--	--
24,30-Dihydroxy-12(13)-enolupinol*	--	--
Soyasapogenol E*	C17420	--
Betulinic acid*	C08619	--
(23S)-3β-hydroxydammara-21-oic acid 21,23-lactone*	--	--
3-Epiursolic acid*	--	--
Ursolic acid*	C08988	--
Gallocatechin 3-O-gallate*	--	--
Epigallocatechin-3-gallate*	C09731	--
Anthranilate-1-O-Sophoroside	--	--
Vnilloylcaffeoyltartaric acid	--	--
Tetahydroxyflavone-7-O-glucuronide*	--	--
Kaempferol-3-O-glucuronide*	--	--
Pomolic acid*	--	--
Corosolic acid*	--	--
Maslinic acid*	C16939	--
2,3-dihydroxy-12-ursen-28-oic acid*	--	--
N-(4-O-(Glucosyl)-E-feruloyl)-tyramine	--	--
2α,3α-Dihydroxyursolic acid*	--	--
2α,3α,23-trihydroxyolean-12-en-28-oic acid	--	--
Rutundic acid*	--	--
D-Panose	C00713	--
D-Melezitose	C08243	--
2α,3α,19α,23-tetrahydroxy-12-ursen-28-oic acid	--	--
1,3-O-Dicaffeoylquinic Acid (Cynarin)	C10445	--
Di-O-Glucosylquinic acid	--	--
Tricin-7-O-saccharic acid	--	--
Uridine-5'-Diphosphate-D-Xylose	C00190	ko00520,ko00908,ko01100
5'-Methoxymatairesinoside	--	--
5'-Methoxyisolariciresinol-9'-O-glucoside	--	--
Uridine 5'-diphospho-D-glucose	C00029	ko00040,ko00052,ko00053,ko00240,ko00500,ko00520,ko00524,ko00561,ko00908,ko01100,ko01110,ko01240
Uridine 5'-diphospho-N-acetylglucosamine	C00043	ko00520,ko00524,ko01100
Quercetin-3-O-robinobioside*	--	--
Quercetin-3-O-rutinoside (Rutin)*	C05625	ko00944,ko01100,ko01110
Oxiglutatione	C00127	ko00480,ko01100,ko01240
Cannabisin D	C17908	--
D(+)-Melezitose O-rhamnoside	--	--
Gingerglycolipid A	--	--
Gingerglycolipid B	--	--
Vaticanol A	--	--
NADP (Nicotinamide adenine dinucleotide phosphate)	C00006	ko00195,ko00480,ko00760,ko01100,ko01240
METABOLITES_END
#END