#METABOLOMICS WORKBENCH yxw_524521_20240929_111420 DATATRACK_ID:5248 STUDY_ID:ST003541 ANALYSIS_ID:AN005813 PROJECT_ID:PR002177
VERSION             	1
CREATED_ON             	October 17, 2024, 10:57 pm
#PROJECT
PR:PROJECT_TITLE                 	Metabolomic analysis of fluorescent hairy roots overexpressing the Gretchen
PR:PROJECT_TITLE                 	Hagen 3 genes enhancing soybean resistance to cyst nematodes
PR:PROJECT_SUMMARY               	Soybean root samples were collected, target metabolites were extracted, standard
PR:PROJECT_SUMMARY               	curves were established, methodology verification was performed, LC-MS/MS
PR:PROJECT_SUMMARY               	metabolites were detected, and data were analyzed.Metabolome analysis was
PR:PROJECT_SUMMARY               	conducted on FHRs overexpressing these genes to investigate how plant hormones
PR:PROJECT_SUMMARY               	play a role in soybean resistance to SCN. These results provide a new framework
PR:PROJECT_SUMMARY               	for understanding the interaction between soybean and SCN.
PR:INSTITUTE                     	Shenyang Agricultural University
PR:LAST_NAME                     	Yang
PR:FIRST_NAME                    	Xiaowen
PR:ADDRESS                       	College of Plant Protection
PR:EMAIL                         	2020200130@stu.syau.edu.cn
PR:PHONE                         	15702428682
#STUDY
ST:STUDY_TITLE                   	Metabolomic analysis of fluorescent hairy roots overexpressing the Gretchen
ST:STUDY_TITLE                   	Hagen 3_62 genes enhancing soybean resistance to cyst nematodes
ST:STUDY_SUMMARY                 	The Gretchen Hagen 3 genes maintain endogenous hormone homeostasis by
ST:STUDY_SUMMARY                 	conjugating excess hormones with amino acids. Herein, we identified the members
ST:STUDY_SUMMARY                 	of the GH3 family in soybeans and analyzed their phylogeny, gene duplication,
ST:STUDY_SUMMARY                 	structure, domains, conserved motifs, cis-elements in promoter regions for
ST:STUDY_SUMMARY                 	stress responses, and functional characteristics. We found that GH3 genes are
ST:STUDY_SUMMARY                 	induced by pathogens in Group-II. Furthermore, 8 out of 16 Group-II genes
ST:STUDY_SUMMARY                 	responded to cyst nematode infection. Through functional analysis of eight GmGH3
ST:STUDY_SUMMARY                 	genes via overexpression, they play a negative role in soybean resistance to
ST:STUDY_SUMMARY                 	cyst nematode. In addition, our metabolomic analysis showed that overexpression
ST:STUDY_SUMMARY                 	of Glyma.02G125600, Glyma.17G165500, and Glyma.13G284600 affected the content of
ST:STUDY_SUMMARY                 	salicylic acid and jasmonic acid. Our findings clarify the functional features
ST:STUDY_SUMMARY                 	of GH3 genes and reveal their involvement in plant hormone signaling pathways.
ST:STUDY_SUMMARY                 	This provides valuable insights into the complex molecular mechanisms underlying
ST:STUDY_SUMMARY                 	the interaction between soybeans and cyst nematode.
ST:INSTITUTE                     	Shenyang Agricultural University
ST:LAST_NAME                     	Yang
ST:FIRST_NAME                    	Xiaowen
ST:ADDRESS                       	College of Plant Protection
ST:EMAIL                         	2020200130@stu.syau.edu.cn
ST:PHONE                         	15702428682
#SUBJECT
SU:SUBJECT_TYPE                  	Plant
SU:SUBJECT_SPECIES               	Glycine max
SU:TAXONOMY_ID                   	3847
#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           	-	CK-1	Sample source:Plant root | Phenotype:control	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	CK-2	Sample source:Plant root | Phenotype:control	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	CK-3	Sample source:Plant root | Phenotype:control	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	CK-4	Sample source:Plant root | Phenotype:control	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	CK-5	Sample source:Plant root | Phenotype:control	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	CK-6	Sample source:Plant root | Phenotype:control	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	GH3_62-1	Sample source:Plant root | Phenotype:transgene	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	GH3_62-2	Sample source:Plant root | Phenotype:transgene	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	GH3_62-3	Sample source:Plant root | Phenotype:transgene	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	GH3_62-4	Sample source:Plant root | Phenotype:transgene	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	GH3_62-5	Sample source:Plant root | Phenotype:transgene	RAW_FILE_NAME(Raw file name)=-
SUBJECT_SAMPLE_FACTORS           	-	GH3_62-6	Sample source:Plant root | Phenotype:transgene	RAW_FILE_NAME(Raw file name)=-
#COLLECTION
CO:COLLECTION_SUMMARY            	Liquid nitrogen grinding samples, weighing a certain amount of samples into mass
CO:COLLECTION_SUMMARY            	spectrometry water, vortex mixing, as diluted samples; Take a dilution sample of
CO:COLLECTION_SUMMARY            	100μL and add 400 μL precipitator (acetonitrile: Water =1:1), vortex mixing,
CO:COLLECTION_SUMMARY            	extraction at 4 ° C for 30 min, centrifugation at 12000 rpm and 4 ° C for 10
CO:COLLECTION_SUMMARY            	min, taking 300μL supernatant slowly through the extraction column, adding 500
CO:COLLECTION_SUMMARY            	μL eluent (30% acetonitrile), slowly through the extraction column, mixing the
CO:COLLECTION_SUMMARY            	two times of flow solution, LC-MS analysis.
CO:SAMPLE_TYPE                   	Plant roots
#TREATMENT
TR:TREATMENT_SUMMARY             	Take a dilution sample of 100μL and add 400 μL precipitator (acetonitrile:
TR:TREATMENT_SUMMARY             	Water =1:1), vortex mixing, extraction at 4 ° C for 30 min, centrifugation at
TR:TREATMENT_SUMMARY             	12000 rpm and 4 ° C for 10 min, taking 300μL supernatant slowly through the
TR:TREATMENT_SUMMARY             	extraction column, adding 500 μL eluent (30% acetonitrile), slowly through the
TR:TREATMENT_SUMMARY             	extraction column, mixing the two times of flow solution, LC-MS analysis.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Take a dilution sample of 100μL and add 400 μL precipitator (acetonitrile:
SP:SAMPLEPREP_SUMMARY            	Water =1:1), vortex mixing, extraction at 4 ° C for 30 min, centrifugation at
SP:SAMPLEPREP_SUMMARY            	12000 rpm and 4 ° C for 10 min, taking 300μL supernatant slowly through the
SP:SAMPLEPREP_SUMMARY            	extraction column, adding 500 μL eluent (30% acetonitrile), slowly through the
SP:SAMPLEPREP_SUMMARY            	extraction column, mixing the two times of flow solution, LC-MS analysis.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	HILIC
CH:INSTRUMENT_NAME               	AB Sciex QTRAP 6500+
CH:COLUMN_NAME                   	Agilent ZORBAX Eclipse Plus C18 (100 x 2.1mm,1.8um)
CH:SOLVENT_A                     	5mM Ammonium Acetate Aqueous Solution (Adjusted to pH 4.5 with Acetic Acid)
CH:SOLVENT_B                     	Acetonitrile
CH:FLOW_GRADIENT                 	The initial proportion of mobile phase B is set at 15%, which then linearly
CH:FLOW_GRADIENT                 	increases at a rate of 0.8% per minute until it reaches 45%, where it is held
CH:FLOW_GRADIENT                 	for 5 minutes to adequately elute moderately polar metabolites. Afterward, it
CH:FLOW_GRADIENT                 	increases at a rate of 2% per minute up to 90%, and finally remains at this
CH:FLOW_GRADIENT                 	composition for an additional 5 minutes to clean the chromatographic column and
CH:FLOW_GRADIENT                 	collect less polar metabolites.
CH:FLOW_RATE                     	0.35ml/min
CH:COLUMN_TEMPERATURE            	35
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	AB Sciex QTRAP 6500+
MS:INSTRUMENT_TYPE               	QTRAP
MS:MS_TYPE                       	EI
MS:ION_MODE                      	POSITIVE
MS:MS_COMMENTS                   	The concentration series of the standard solution were detected by LC-MS, and
MS:MS_COMMENTS                   	the ratio of the concentration of the standard product to the internal standard
MS:MS_COMMENTS                   	was taken as the horizontal coordinate and the ratio of the peak area of the
MS:MS_COMMENTS                   	standard product to the internal standard was taken as the vertical coordinate
MS:MS_COMMENTS                   	to investigate the linearity of the standard solution. QC samples were tested by
MS:MS_COMMENTS                   	inserting a number of needles at intervals in each batch of samples. The RSD of
MS:MS_COMMENTS                   	all QC samples was calculated with the concentration of the standard substance
MS:MS_COMMENTS                   	to evaluate stability. According to the established sample pretreatment and
MS:MS_COMMENTS                   	instrumental analysis methods, all samples were quantitatively analyzed.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	Peak area
MS_METABOLITE_DATA_START
Samples	CK-1	CK-2	CK-3	CK-4	CK-5	CK-6	GH3_62-1	GH3_62-2	GH3_62-3	GH3_62-4	GH3_62-5	GH3_62-6
Factors	Sample source:Plant root | Phenotype:control	Sample source:Plant root | Phenotype:control	Sample source:Plant root | Phenotype:control	Sample source:Plant root | Phenotype:control	Sample source:Plant root | Phenotype:control	Sample source:Plant root | Phenotype:control	Sample source:Plant root | Phenotype:transgene	Sample source:Plant root | Phenotype:transgene	Sample source:Plant root | Phenotype:transgene	Sample source:Plant root | Phenotype:transgene	Sample source:Plant root | Phenotype:transgene	Sample source:Plant root | Phenotype:transgene
Capsaicin	5648	9894	6015	6418	7125	6603	4156	3885	2898	2657	4491	9571
Uridine	6094000	7686000	4217000	6064000	6282000	5238000	9224000	7660000	8065000	5072000	7902000	8445000
Cytidine	12980000	16550000	10360000	11630000	19200000	17860000	45330000	38320000	23290000	13010000	32220000	37940000
Indole-3-acetic acid	76270	160900	64930	53850	66490	66070	45310	25660	31790	21710	29060	62100
Methyl linoleate	57470	63090	36931	47950	53760	45143	70190	62080	61840	58184	53280	88910
SDMA	264900	511000	297400	189600	231100	241500	532400	640100	649800	404600	591200	470500
5-Methylcytidine	174800	269200	195000	160900	200300	231900	321700	383100	343400	138000	373100	334000
Calycosin-7-O-beta-D-glucoside	375300	377100	611600	569400	446600	1621000	96716	239500	379700	315214	103107	98147
Schaftoside	16639	27320	19480	20902	25050	40270	10080	15422	18354	25910	13087	15368
Corylin	169700	575700	134100	184300	520600	588300	39750	94050	156400	146400	29170	67080
Uracil	3353000	3483000	2478000	2670000	3454000	2862000	5452000	3771000	4654000	2664000	3402000	4756000
4-Aminobutyric acid	4171000	8915000	5619000	5280000	13550000	7546000	17980000	12040000	8320000	8471000	9618000	13900000
Glycine	70050	54070	39400	57630	31790	36440	208300	169900	141200	74430	159200	139700
L-Alanine	525700	1160000	652000	1019000	1595000	863900	4286000	2133000	2097000	724500	2143000	3239000
L-arginine	845300	2270000	1021000	1069000	1310000	1117000	4069000	2829000	2590000	1547000	1909000	2450000
L-Hydroxyproline	1081000	900300	761400	680100	561300	610900	1725000	1353000	1499000	923100	879600	1212000
D-Proline	6743000	9821000	5765000	5960000	21190000	7943000	26750000	18790000	12680000	11110000	16450000	17430000
3-Amino-2-methylpropanoic acid	1150000	1531000	1132000	1101000	1950000	1478000	2645000	2163000	1566000	1505000	1603000	1996000
L-serine	1028000	1378000	817300	1003000	842400	815100	2645000	1801000	1994000	1108000	1639000	1818000
D-Phenylalanine	41970000	56930000	27990000	31710000	29630000	27540000	89910000	52090000	77120000	30670000	55550000	68330000
4-Acetamidobutyric Acid	277600	295700	155000	432800	460500	215900	942600	600400	327500	579000	696100	434300
Sattabacin	42380	40250	49080	82870	56250	77640	16050	22860	30290	46010	28410	19970
NG,NG-Dimethyl-L-arginine	300800	426400	397800	295000	335300	189300	640700	616600	702600	291000	521800	476100
N-(2-Hydroxyethyl)iminodiacetic acid	1885000	1218000	2250000	3101000	2511000	2654000	1971000	1436000	1557000	1892000	1002000	1193000
L-Valine	117600	74570	40380	107300	81730	71480	221500	174100	227900	128800	130700	158100
Indole-3-acetamide	18920	40640	33500	47330	40000	24000	96140	56430	56340	46450	60730	73200
dUDP	130400	188900	180700	203500	116000	168000	35480	49580	34840	255100	52580	38080
Diethanolamine	202200	289300	160300	230100	180300	168500	496700	392400	401800	205100	345300	455200
Benzamidine	683100	893500	417400	490900	511900	407300	1471000	834700	1253000	476100	844800	1038000
Tetraethylammonium fluoride	5446000	6756000	4607000	3076000	6323000	6163000	14070000	12120000	6939000	5144000	11640000	9558000
1-Methylhistidine	449500	302100	123100	121700	244700	198200	1035000	402200	561100	208200	1024000	1175000
Spermidine	11750	19080	13270	16780	11890	23090	26870	19080	22590	20190	19780	21350
Sarcosine	1040000	2343000	1346000	2472000	3549000	1505000	9743000	4908000	4141000	1652000	4699000	6966000
R-Aminobutyrate	1125000	2367000	1440000	1360000	2846000	1908000	4567000	2973000	2182000	2164000	2193000	3171000
Purine	53200	72550	40390	41620	39220	31710	118800	68660	103800	42110	76600	84480
Nε-(1-Carboxymethyl)-L-lysine	70090	74430	55370	39830	78350	35660	96000	124300	63180	94330	81010	71060
N2-Acetyl-L-lysine	1.07E+08	1.31E+08	1.17E+08	1.23E+08	92280000	1.5E+08	87340000	77260000	73720000	1.53E+08	67410000	68480000
L-Cystathionine	42910	90820	43240	30940	53490	69720	21160	22390	38670	30630	33580	31620
Proline	4424000	7464000	4124000	4696000	10780000	5413000	13050000	10480000	8710000	7963000	8317000	9840000
D-Pyroglutamic acid	1697000	2032000	928200	4738100	1401000	1113000	16920000	19050000	13530000	4542000	18510000	6784000
methyl oxo pentanoate	80050	129800	112400	97320	148900	137100	82050	81150	75960	80820	89580	40880
2-Deoxy-D-galactose	4274000	5436000	4677000	5089000	3807000	6174000	3560000	3005000	3088000	5872000	3067000	2686000
1-Methylguanosine	36830	36410	16560	13530	28920	23900	59830	59100	63210	17510	54810	52130
Scopine	22750	22690	28640	31340	22590	32720	16130	23200	19360	24740	16910	19160
Allicin	45990	32700	31240	27040	33170	19880	214000	176400	137900	82190	118800	78280
Cephalotaxine	11133	12070	14080	8054	11980	34480	6830	2605	10610	4635	9757	2690
Deoxyarbutin	58200	112900	132000	110000	89420	63170	220900	93300	116400	335300	104500	267100
Tropine	254300	214900	203010	208180	356420	243900	315100	231700	361000	297770	335500	343400
Homoplantaginin	182200	127700	191400	239000	312300	548100	50710	117400	158300	283500	79270	70360
Tabersonine	242600	333800	203200	474700	601400	974100	31860	415400	368500	87820	65030	48250
Aloperine	7873	7236	9446	9516	9533	7409	25320	9217	13450	10960	15310	14050
3-Amino-4-methylpentanoic acid	545300	292400	525800	494200	565000	305500	700600	659000	891900	615800	574300	461400
D-Serine	6389000	7021000	4712000	5450000	5369000	4544000	15070000	10480000	12370000	5755000	10770000	12000000
Xanthopterin	14460	19760	16703	12610	17187	22990	64860	91170	111700	26450	87370	21900
L-Phenylalanine	40580000	56840000	26750000	29190000	28700000	26010000	87660000	48910000	70440000	27570000	52220000	62130000
Alanine	190700	345000	216000	335900	490100	241600	1261000	650900	624900	266000	626100	830100
Indirubin	9606	26930	3357	4406	5280	13540	52520	56060	129000	35351	42590	51600
Pratensein-7-O-glucoside	89760	132100	236100	137700	294300	351100	43340	34800	183900	129900	82530	69040
Trachelogenin	6475	6804	11210	8119	11720	10830	7129	10410	5951	4335	4301	4635
Prim-O-glucosylcimifugin	113500	94080	344700	255900	290400	440200	63790	125200	207800	96190	81420	66490
Vincosamide	5630	2958	3510	3538	5611	5576	13220	13690	8324	9057	6193	12590
Oxymatrine	64120	73000	34790	26490	41150	29010	239600	159700	234400	18350	166400	108100
ladanein	10970	86840	12090	39590	82270	47160	10329	13360	9787	11573	13615	9295
7-methylguanine	8256000	11170000	5352000	6074000	5826000	5110000	17850000	9787000	14860000	5670000	10560000	12240000
5-O-p-Coumaroyl shikimic acid	14380	10120	19580	30880	19970	17460	10220	4804	12740	9277	8049	5447
MAG (18:1)	5289	5666	3096	2133	2676	7611	27030	6621	6750	34680	4443	11500
Diethyl glutarate	1.04E+08	1.27E+08	1.17E+08	1.25E+08	92760000	1.5E+08	85580000	79080000	70710000	1.39E+08	62500000	68450000
Methionine sulfoxide	1179000	682400	841000	563300	366400	324400	2251000	1294000	1628000	588600	1214000	1840000
Methylguanidine	322700	326300	143000	142500	159600	76490	808900	313500	543800	145600	468000	515500
Sissotrin	810800	819200	1484000	1131000	1575000	3494000	66290	873300	1726000	527800	216000	107800
Peonidin O-hexoside	93500	204000	256800	326600	358700	432000	58180	113900	133200	143500	15850	46750
Cyanidin 3-O-malonylhexoside	296000	123400	300500	344200	358500	725500	47450	173400	436300	198600	73580	24220
(-)-Norepinephrine N-hexoside	827200	929100	1426000	1484000	1359000	1880000	429700	895200	797500	973300	876300	509500
1,3-Dimethyluric Acid	33680	41080	47730	43070	51670	42870	58130	54980	66220	49380	41950	50940
1-Methyladenine	82090	145000	79080	76980	77270	56430	207700	125200	154200	75990	172400	141600
2-Methyladenosine	1712000	3067000	1851000	1555000	2413000	2562000	4597000	5612000	5826000	1620000	5249000	3288000
Chinese bittersweet alkaloid II	30970	22630	26570	28310	44560	17780	733400	431300	392800	42280	59700	51780
Chrysoeriol 5-O-hexoside	171200	127700	240700	213800	349400	668200	72550	66970	138800	339100	82700	54400
GDP-L-fucose	14390	11380	10510	26050	8458	15100	11370	4148	2807	14440	3963	5233
IAA-Asp	455000	763100	789800	747100	1168000	1001000	417800	322000	371900	450600	258600	476000
Luteolin O-malonylhexoside	1561000	982700	1744000	1734000	1707000	3994000	179300	821500	2138000	787700	254700	93220
N-p-Coumaroylspermidine	12970	15050	14410	18300	20600	14610	7310	11900	14700	14590	9611	10140
Ononin	19080	37600	39320	25600	24520	23050	23980	17580	18070	17440	21300	21270
Phellodenol H	99110	122800	121700	128400	127000	108400	79480	92310	76660	54100	88630	109800
Quercetin-3,4'-O-di-beta-glucopyranoside	41500	39920	57100	91460	69840	80100	9137	27900	39490	37310	26630	13360
Quercetin 5-O-hexoside	29040	60460	35480	51510	53250	69480	15700	14360	24700	30140	15300	31500
Selgin O-malonylhexoside	122500	149000	121200	78410	66310	235600	169500	247500	168600	208000	155600	172100
Xanthurenic acid O-hexoside	22308	2707	25481	29144	1499	28999	616600	554200	287500	354200	599100	224400
Yamogenin	32150	34450	31880	32840	26760	45590	23530	20960	28690	17240	27700	19680
gamma-Glu-Leu	16330	36860	17190	18510	34240	35550	83780	76900	56170	23430	57170	47170
Chrysoeriol O-malonylhexoside	275500	192500	405400	521900	648700	1206000	66220	133900	217100	511300	93330	51900
D-Threonine	1614000	1275000	694200	707000	676000	391900	3304000	1649000	2588000	577500	2202000	2491000
Auramine	123500	119100	91090	149400	106700	109500	92120	89280	96980	88680	81090	90190
Vanillin	43230	24500	49520	75990	49890	29790	17390	26960	15850	34810	19760	27800
sn-Glycero-3-phosphocholine	241400	367900	198800	365500	422500	267000	275400	114900	141700	176900	155500	305200
Pyridoxine O-glucoside	259700	302800	367800	513600	400200	801900	188400	298200	289700	222000	164900	172500
Chrysoeriol 7-O-hexoside	149400	154900	210900	240800	376300	634200	112800	82870	166300	303300	86580	74400
Tricetin O-malonylhexoside	64220	79800	60230	111500	104600	156100	15150	48230	60990	50240	41980	23830
N-p-Coumaroylputrescine	7170	11540	4535	7367	8137	17200	19320	23090	40060	9103	9556	16130
D-Threose	40000	56060	240610	23610	31140	47020	940400	1168000	721100	406300	1177000	437800
Icariside B2	14060	19360	50390	25230	37210	36450	4994	7974	8729	28190	14270	10650
HBOA	29860000	43470000	20210000	22100000	21690000	19380000	67990000	35230000	52470000	21400000	38650000	46090000
Isohyperoside	38270	41810	32160	54380	79430	70730	24020	52580	33170	43700	22630	22270
Elemol	16260000	18560000	17410000	18740000	15620000	21620000	16510000	14120000	14360000	11960000	14170000	13350000
Luteolin-4'-O-glucoside	113622	194000	130756	182600	270600	288500	92900	126300	95160	258800	67220	48350
N-Feruloyl-3-methoxytyramine	13790	10810	11710	15390	24450	8010	128900	50800	48450	22790	53810	25970
D-Panthenol	9249	5553	7784	16770	9812	12390	13180000	12300000	8560000	3316000	11720000	5301000
Esculin	73980	104200	67310	126100	81590	88800	26000	82010	71490	59280	50840	48050
Luteolin	69670	77740	69950	126500	145200	154800	24340	38620	41710	77130	21690	32410
Diosmetin	1303000	2183000	3104000	4108000	5233000	6153000	28600	704000	1378000	2359000	72420	142000
Daphnetin	6973	5736	8339	8059	4851	9855	3517	4099	2648	7319	4161	4471
Orcinol glucoside	454700	440600	497600	422500	428700	367100	395300	166000	327300	351500	301600	359700
Salicylic acid	38000	19620	18650	33310	71900	68270	166500	204900	163300	69560	194300	77150
DL-Panthenol	5715	3157	21626	6756	4168	28479	3110000	2355000	1713000	616400	2434000	1054000
p-Coumaric Acid	41710	70590	25650	23010	45050	61850	8189	26100	15687	43670	18439	15920
Psoralidin	56890	173200	46810	23900	211600	221600	5436	15610	24830	28270	4332	10260
2-Hydroxybutyric acid	74090	64150	106900	131100	115500	109900	102800	66790	88190	43340	61270	46370
Tartaric acid	326000	387600	482800	506500	623500	346200	224000	270000	324200	319900	214200	252800
Scutellarein	42610	58140	57800	55130	66770	82290	26160	32620	28250	69620	31310	22840
Tectorigenin	2720	7229	8806	14630	19660	22510	4128	2929	3261	6598	3282	4087
Calceolarioside B	52110	41010	52460	76590	50560	82960	19200	21260	25760	15370	18640	18740
Neobavaisoflavone	671100	739400	225800	379300	510300	562400	58310	236600	222600	686900	120600	170400
L-Glutamine	96680	121400	78310	225100	110000	149700	116700	28120	36360	43870	80880	53800
L-Pyroglutamic acid	10520	5925	5886	9160	4749	4817	38050	58100	33910	10830	31110	16740
L-Arabinitol	80980	75090	66190	82260	98040	52920	15440	37080	35860	33190	38080	31930
D-Glucuronic acid	265200	270300	168000	130500	179500	141800	269200	206600	199200	336000	285600	328200
N-Acetylornithine	71950	85870	45030	83550	60200	95060	62540	37390	38060	59360	35900	33080
Creatine	7018	6109	2724	5956	2498	8031	2538	2649	1852	2531	1584	1231
12-OH-JA-Ile-1	14400	4973	4827	5541	7222	5837	4134	2749	3191	2532	4379	2927
GA7-1	4997000	3413000	4243000	7283000	6034000	5985000	3370000	2293000	1848000	4851000	2396000	1559000
Jasmonic acid	15660	15680	11140	14450	8748	16750	28900	21390	15940	13450	19240	21970
Kaempferol7-O-beta-D-glucopyranoside	77510	117100	65180	113200	204000	158600	66710	91090	69550	84610	34840	28900
Lactic acid	24310	80576	33480	18720	19080	16760	257900	198600	435800	109000	507300	179000
9(S)-HOTrE	109700	74970	73710	73360	68410	71970	35840	22430	20140	117000	27080	27280
Sinapoyl malate	6279	6929	8012	8796	17320	14720	6553	5981	5012	5710	5331	6804
4-Methylvaleric Acid	8123	5410	5748	5037	6198	6803	4316	4075	3724	7766	4478	3995
Lysope 16:0	1019	1357	1542	11859	916	12243	29640	4479	6050	9957	8084	20720
O-Phospho-L-Tyrosine	21290	14490	15720	8960	24360	34630	16430	3808	15970	7696	8132	9307
Methyl protocatechuate	97430	131400	73890	128000	144400	238400	29290	32170	46120	180300	27400	33820
Methyl 4-hydroxycinnamate	5601	13440	10770	24700	71390	55380	6664	10375	6742	7708	9256	8842
Oxyresveratrol	197900	529000	220500	349800	228900	331700	170500	182200	170200	228800	146000	138900
3,5-Dimethoxyphenol	9464	15560	8895	5819	9636	8965	6998	5778	4874	6799	6467	5248
Calycosin	10000000	13270000	16440000	20210000	28670000	33970000	397100	6800000	8037000	6795000	546300	668500
beta-L-Arabinose	3779000	5497000	6042000	5479000	8553000	4996000	1630000	3820000	3796000	2547000	2928000	1918000
Hastatoside	13960	13150	22730	49370	25020	41750	8811	10080	18400	12110	5249	8255
Eriodictyol	13420	13310	14700	7802	8770	17250	9943	6537	8984	11150	5031	6356
Choline bitartrate	715200	848900	885600	737700	1118000	682400	486000	547300	633200	483600	483000	361900
L-Sorbose	91460	52150	71080	54530	39890	24740	76910	47370	109200	99750	106100	89450
D-Ribose	237200	384800	399000	420300	556800	259300	200900	207000	275500	290500	229600	169000
p-Hydroxy-cinnamic acid	14940	88190	37060	33160	74990	42890	16110	7657	18240	34720	11480	23340
Apigenin 4-O-rhamnoside	4983	6083	6260	10870	13480	14870	6424	5952	3165	6446	2212	4757
Peonidin chloride	16210	18090	19660	15590	15030	17930	17890	15220	11060	14800	10080	11910
Luteolin 7-O-glucoside	179700	131700	200700	200100	213800	259400	88560	124500	123900	215100	81700	81280
Rhein	18430	125800	16530	20770	6028	10320	6459	4142	3097	22530	2476	7664
Acetyl tryptophan	52560	69340	62810	106700	136900	105300	34250	31850	19890	52790	19850	31890
Myristoleic acid	66340	60090	69940	383000	98870	118600	23420	25400	24910	197400	43350	19890
9,10-EODE	11400	10090	8180	9903	8511	9191	8942	9648	4698	5670	6559	7873
9(S)-HpOTrE	91670	117500	80910	87620	86410	86080	66960	57610	65140	105600	61730	53270
12,13-EODE	1533000	1192000	1138000	1281000	1191000	1390000	670300	495700	391300	1393000	354600	412200
13-HPODE	45170	53040	37030	41230	41140	45630	37770	27560	18900	37110	22950	30360
Gallic acid O-Hexoside	101000	45220	137800	44850	152800	120700	2240	15370	19670	34790	7316	11030
Pelargonidin O-acetylhexoside	600500	449200	421500	489300	1053000	1096000	157400	366700	386400	588600	181400	158400
O-p-coumaroyl-O-salicyloyl quinic acid	19350	26570	5298	16970	14370	22440	5022	11720	5862	4032	5589	5332
5-O-p-coumaroyl quinic acid O-hexoside	7899	7410	7863	7848	5363	14290	5052	5738	3241	3606	4534	5443
Syringic acid O-glucoside	97930	82350	91240	123300	108500	114100	85730	81880	99070	58600	71810	64780
Di-O-methylquercetin	3976000	4209000	3465000	5737000	4259000	4568000	2562000	2389000	2518000	3685000	1828000	1880000
LysoPE 16:0 (2n isomer)	2648	8806	4705	11161	7703	1720	32900	7336	6683	12180	8669	18970
Indole-5-carboxylic acid	637400	739000	695400	726000	338500	869500	367800	381600	465200	468200	404900	297700
Kaempferol 3-O-robinobioside	23300	21120	51330	28980	14320	29190	16765	14960	13340	17571	16526	11610
Isohemiphloin	31190	45760	28940	8135	23930	34020	9451	20130	4023	17770	9894	11360
5-oxoproline	21860	5258	7279	10790	12250	4513	55040	79950	60380	16920	73380	34690
2'-Hydroxydaidzein	1077000	1234000	703000	1243000	1894000	1916000	314100	987800	444900	1038000	229800	163700
Trifolin	140300	120900	107300	132100	121000	144500	37980	52960	64440	104100	47660	33530
2'-Hydroxygenistein	1362000	1827000	1808000	2833000	3350000	3873000	472300	1054000	905100	1668000	378800	245300
Prunetin	614900	496900	711700	1007000	998500	1797000	131200	356900	469600	177000	180700	116900
D-Xylose	53560	46580	95460	82310	104300	59690	21190	41260	55190	31910	45200	31690
Fmoc-Ile-OH	35010	30980	38170	35500	8051	28290	3733	5520	4038	15755	4315	2618
Chrysophanol 8-O-glucoside	37900	16540	14650	12580	31530	27080	19950	10320	5546	14810	12340	10200
Rhein 8-Glucoside	17490	14900	16630	20710	16450	33280	7464	16410	11420	9564	6671	4639
4'-Hydroxyacetophenone	6784	2717	12780	6079	10330	7082	96380	98770	52580	19990	128800	46490
Isomucronulatol-7-O-glucoside	12110	10030	10960	21300	8207	23600	6355	10680	6066	11510	7361	7464
Crocetin	62110	45540	45920	71240	60950	49030	23000	34390	24770	57410	33790	13690
Coumestrol	57700000	52000000	43270000	63530000	60470000	71340000	26410000	50100000	42130000	39580000	28340000	26360000
Methylenesuccinic acid	59180	59410	48660	42490	51160	44560	61360	62060	75960	82820	52340	64250
D-Xylulose	6033000	5531000	5949000	6886000	8330000	5585000	1582000	3270000	4107000	3436000	3295000	2141000
Kuwanon A	27180	26110	25660	30120	10870	17120	10810	4745	16510	13130	19820	5595
N-[(Tert-butoxy)carbonyl]-L-tryptophan	8693	12100	11840	11220	9951	9522	9359	9015	8011	8335	9584	7900
P-Coumaryl Alcohol	1480000	1272000	1806000	1719000	2344000	1333000	431500	1051000	1173000	957400	901500	701500
Physcion 8-O-Beta-D-Monoglucoside	159700	176000	285100	383500	160200	691100	17830	65620	97240	76140	10230	6326
N-Acetyl-L-glutamic acid	21070	13520	20970	14460	25770	17530	9143	13520	7990	18780	11770	10620
Succinic anhydride	4984000	7020000	7191000	10440000	6492000	11070000	4822000	4254000	2845000	3760000	6337000	4960000
3-O-p-coumaroyl shikimic acid O-hexoside	14650	10280	7411	8356	6819	14860	5724	7717	5138	2053	6887	6105
2-Oxoadipic acid	93580	145100	121400	141800	63810	116400	46610	55560	65190	99960	60080	39870
p-Coumaric acid-4-O-glucoside	15810	8912	9972	16960	8368	18220	6501	7096	5742	2070	6943	2479
6'-O-Feruloyl-D-sucrose	135100	280000	261200	274700	156400	431400	178700	153800	94520	255800	86770	110200
(-)-Jasmonoyl-L-isoleucine	2115	3308	2445	8338	3051	7050	9607	6962	9066	9589	7589	7298
1-O-Gentisoyl-D-glucoside	189600	78410	187000	89450	244500	148600	34420	133100	80400	39210	25780	62610
9,10,13-Trihydroxyoctadec-11-enoic acid	5539000	6095000	5018000	7761000	6747000	6660000	4112000	4333000	4567000	6471000	3561000	3787000
Koaburaside	72760	67110	100900	91400	120300	158900	9915	67890	54260	27600	18960	12410
2-O-Caffeoylmalic acid	27920	22810	45330	27380	24570	25520	19570	21220	13510	25380	20200	15880
Eicosadienoic acid	92240	123700	82990	221500	123500	161600	99470	44590	53140	92080	68300	33440
1-O-Galloyl-D-glucose	36090	26130	28470	28620	64110	50040	8180	29230	26550	24500	15560	8879
2,2-Dimethylsuccinic acid	68550	88630	79980	95450	117800	129300	60450	50390	90430	32140	57640	72630
N-Acetyl-L-Tryptophan	252100	311000	398700	481700	558500	416700	153400	120100	126300	220800	84040	183600
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	KEGG_ID	log2(GH3_62/CK)	P-value	VIP
Capsaicin	C06866	-0.59	0.03603	1.410631
Uridine	C00299	0.38	0.049077	1.335889
Cytidine	C00475	1.1	0.00738	1.678281
Indole-3-acetic acid	C00954	-1.17	0.004599	1.745099
Methyl linoleate	_	0.37	0.035225	1.400424
SDMA	_	0.92	0.001593	1.86532
5-Methylcytidine	_	0.61	0.048389	1.340858
Calycosin-7-O-beta-D-glucoside	_	-1.69	0.005904	1.714958
Schaftoside	C10181	-0.6	0.042562	1.371818
Corylin	_	-2.02	0.00554	1.714132
Uracil	C00106	0.43	0.044689	1.355725
4-Aminobutyric acid	C00334	0.64	0.04696	1.354123
Glycine	C00037	1.62	0.000149	2.029943
L-Alanine	C00041	1.33	0.015827	1.56341
L-arginine	C00062	1.01	0.004511	1.745516
L-Hydroxyproline	C01157	0.72	0.00723	1.67424
D-Proline	C00763	0.84	0.018624	1.54884
3-Amino-2-methylpropanoic acid	C05145	0.46	0.033336	1.426858
L-serine	C00065	0.9	0.001571	1.856123
D-Phenylalanine	C02265	0.79	0.020923	1.508886
4-Acetamidobutyric Acid	C02946	0.96	0.013088	1.599214
Sattabacin	_	-1.09	0.002621	1.809155
NG,NG-Dimethyl-L-arginine	C03626	0.74	0.016052	1.573783
N-(2-Hydroxyethyl)iminodiacetic acid	_	-0.58	0.04446	1.364716
L-Valine	C00183	1.07	0.00182	1.839141
Indole-3-acetamide	C02693	0.92	0.003754	1.76819
dUDP	C01346	-1.08	0.008581	1.659773
Diethanolamine	C06772	0.89	0.003058	1.784438
Benzamidine	C01784	0.79	0.025612	1.473814
Tetraethylammonium fluoride	_	0.87	0.013898	1.588267
1-Methylhistidine	C01152	1.61	0.012046	1.604719
Spermidine	C00315	0.43	0.023606	1.46489
Sarcosine	C00213	1.38	0.013644	1.589651
R-Aminobutyrate	_	0.64	0.03582	1.411031
Purine	C15587	0.82	0.014536	1.576662
Nε-(1-Carboxymethyl)-L-lysine	_	0.58	0.030817	1.458785
N2-Acetyl-L-lysine	C12989	-0.44	0.036908	1.412008
L-Cystathionine	C02291	-0.89	0.010308	1.624223
Proline	C16435	0.66	0.013397	1.603356
D-Pyroglutamic acid	C02237	2.73	0.000206	2.01657
methyl oxo pentanoate	C00233	-0.64	0.012914	1.574671
2-Deoxy-D-galactose	C02781	-0.46	0.026398	1.47913
1-Methylguanosine	C04545	0.97	0.029743	1.450685
Scopine	_	-0.42	0.013687	1.600068
Allicin	C07600	2.08	3.39E-05	2.114284
Cephalotaxine	C10580	-1.3	0.015705	1.559807
Deoxyarbutin	_	1	0.037877	1.384844
Tropine	C00729	0.34	0.041798	1.38544
Homoplantaginin	C17762	-1.07	0.034348	1.414545
Tabersonine	C09244	-1.47	0.021782	1.498238
Aloperine	C10748	0.79	0.007557	1.675349
3-Amino-4-methylpentanoic acid	_	0.51	0.033895	1.43384
D-Serine	C00740	0.98	0.0014	1.870072
Xanthopterin	_	1.95	0.002149	1.837587
L-Phenylalanine	C00079	0.74	0.03485	1.40942
Alanine	C01401	1.22	0.009793	1.642442
Indirubin	_	2.54	0.000373	1.973285
Pratensein-7-O-glucoside	_	-1.19	0.026444	1.45987
Trachelogenin	C10891	-0.58	0.036387	1.393054
Prim-O-glucosylcimifugin	_	-1.26	0.025157	1.473309
Vincosamide	_	1.23	0.000697	1.923823
Oxymatrine	_	1.78	0.033185	1.428156
ladanein	_	-2.03	0.013257	1.579592
7-methylguanine	C02242	0.76	0.031428	1.431556
5-O-p-Coumaroyl shikimic acid	_	-1.15	0.004095	1.753737
MAG (18:1)	_	1.78	0.024364	1.465802
Diethyl glutarate	_	-0.5	0.020037	1.533886
Methionine sulfoxide	C02989	1.15	0.014287	1.572886
Methylguanidine	C02294	1.25	0.025337	1.480189
Sissotrin	C05376	-1.4	0.02951	1.437842
Peonidin O-hexoside	_	-1.7	0.009591	1.642104
Cyanidin 3-O-malonylhexoside	_	-1.17	0.047155	1.337719
(-)-Norepinephrine N-hexoside	_	-0.81	0.011979	1.60211
1,3-Dimethyluric Acid	_	0.3	0.035816	1.413695
1-Methyladenine	C02216	0.76	0.019084	1.535078
2-Methyladenosine	_	0.99	0.019198	1.536206
Chinese bittersweet alkaloid II	_	3.32	0.008156	1.671582
Chrysoeriol 5-O-hexoside	_	-1.23	0.029352	1.446135
GDP-L-fucose	C00325	-1.03	0.022522	1.516178
IAA-Asp	_	-1.1	0.000974	1.902712
Luteolin O-malonylhexoside	_	-1.45	0.018332	1.529638
N-p-Coumaroylspermidine	_	-0.49	0.020846	1.498123
Ononin	C10509	-0.49	0.0322	1.421625
Phellodenol H	_	-0.49	0.006424	1.695884
Quercetin-3,4'-O-di-beta-glucopyranoside	_	-1.3	0.005428	1.713778
Quercetin 5-O-hexoside	_	-1.18	0.001955	1.845496
Selgin O-malonylhexoside	_	0.53	0.048513	1.315526
Xanthurenic acid O-hexoside	_	4.58	9.46E-05	2.046028
Yamogenin	C08918	-0.56	0.004428	1.753097
gamma-Glu-Leu	_	1.11	0.01123	1.621294
Chrysoeriol O-malonylhexoside	_	-1.59	0.016158	1.555524
D-Threonine	C00820	1.25	0.026288	1.470593
Auramine	C19193	-0.37	0.005664	1.726186
Vanillin	C00755	-0.93	0.013366	1.589485
sn-Glycero-3-phosphocholine	C00670	-0.67	0.031247	1.437571
Pyridoxine O-glucoside	_	-0.98	0.008414	1.66879
Chrysoeriol 7-O-hexoside	_	-1.09	0.0382	1.392383
Tricetin O-malonylhexoside	_	-1.26	0.00574	1.70894
N-p-Coumaroylputrescine	_	1.06	0.040013	1.371317
D-Threose	C06463	3.46	4.01E-05	2.104262
Icariside B2	_	-1.28	0.011013	1.61316
HBOA	C15769	0.74	0.036072	1.402104
Isohyperoside	_	-0.67	0.047568	1.33443
Elemol	_	-0.35	0.003187	1.799255
Luteolin-4'-O-glucoside	_	-0.77	0.048342	1.331704
N-Feruloyl-3-methoxytyramine	_	1.97	0.001669	1.865405
D-Panthenol	C05944	9.78	2.83E-10	2.288168
Esculin	C09264	-0.68	0.022395	1.496663
Luteolin	C01514	-1.44	0.00152	1.864043
Diosmetin	C10038	-2.23	0.009951	1.631109
Daphnetin	C03093	-0.74	0.011415	1.632291
Orcinol glucoside	_	-0.45	0.026566	1.467458
Salicylic acid	C00805	1.8	0.001684	1.858237
DL-Panthenol	_	7.33	3.00E-07	2.227333
p-Coumaric Acid	C06738	-1.06	0.023231	1.486881
Psoralidin	C10523	-3.04	0.002173	1.820124
2-Hydroxybutyric acid	C05984	-0.55	0.048642	1.332581
Tartaric acid	C00898	-0.73	0.002566	1.793549
Scutellarein	C10184	-0.78	0.008592	1.653527
Tectorigenin	C10534	-1.63	0.018266	1.53741
Calceolarioside B	_	-1.58	8.99E-06	2.162264
Neobavaisoflavone	_	-1.04	0.032225	1.425544
L-Glutamine	C00064	-1.11	0.009729	1.648624
L-Pyroglutamic acid	C01879	2.2	0.000478	1.960282
L-Arabinitol	C00532	-1.24	0.000296	1.979867
D-Glucuronic acid	C16245	0.49	0.042917	1.367624
N-Acetylornithine	C00437	-0.72	0.009605	1.653686
Creatine	C00300	-1.38	0.00379	1.780494
12-OH-JA-Ile-1	_	-1.1	0.004115	1.749972
GA7-1	_	-0.96	0.005339	1.723105
Jasmonic acid	C08491	0.55	0.030479	1.412962
Kaempferol7-O-beta-D-glucopyranoside	_	-0.96	0.026025	1.459651
Lactic acid	C01432	3.12	6.41E-05	2.08555
9(S)-HOTrE	C16326	-0.91	0.01139	1.617832
Sinapoyl malate	C02887	-0.81	0.018726	1.527467
4-Methylvaleric Acid	_	-0.39	0.046119	1.349293
Lysope 16:0	_	1.44	0.034761	1.379459
O-Phospho-L-Tyrosine	_	-0.96	0.039842	1.382326
Methyl protocatechuate	_	-1.22	0.009827	1.641717
Methyl 4-hydroxycinnamate	_	-1.87	0.045713	1.344658
Oxyresveratrol	C10273	-0.84	0.009658	1.645536
3,5-Dimethoxyphenol	_	-0.68	0.010197	1.619816
Calycosin	C01562	-2.39	0.004395	1.741214
beta-L-Arabinose	C02479	-1.04	0.002005	1.814117
Hastatoside	_	-1.39	0.00822	1.672851
Eriodictyol	C05631	-0.64	0.02995	1.45277
Choline bitartrate	C00919	-0.73	0.000716	1.904627
L-Sorbose	C00247	0.66	0.049592	1.337016
D-Ribose	C21057	-0.71	0.012112	1.579538
p-Hydroxy-cinnamic acid	C00811	-1.38	0.021611	1.498863
Apigenin 4-O-rhamnoside	_	-0.96	0.031194	1.441976
Peonidin chloride	C08726	-0.34	0.029062	1.456548
Luteolin 7-O-glucoside	C03951	-0.72	0.011705	1.610602
Rhein	C10401	-2.09	0.04625	1.358198
Acetyl tryptophan	C03137	-1.48	0.000701	1.931416
Myristoleic acid	C08322	-1.25	0.044689	1.360508
9,10-EODE	_	-0.4	0.034425	1.423508
9(S)-HpOTrE	C16321	-0.42	0.019168	1.523288
12,13-EODE	_	-1.05	0.002551	1.814728
13-HPODE	C04717	-0.59	0.005141	1.737045
Gallic acid O-Hexoside	_	-2.73	0.000882	1.904399
Pelargonidin O-acetylhexoside	_	-1.16	0.013798	1.576312
O-p-coumaroyl-O-salicyloyl quinic acid	_	-1.48	0.005317	1.726612
5-O-p-coumaroyl quinic acid O-hexoside	_	-0.87	0.004498	1.766099
Syringic acid O-glucoside	_	-0.41	0.014024	1.581064
Di-O-methylquercetin	_	-0.81	0.000852	1.918749
LysoPE 16:0 (2n isomer)	_	1.23	0.048205	1.340323
Indole-5-carboxylic acid	_	-0.74	0.008775	1.670825
Kaempferol 3-O-robinobioside	_	-0.89	0.0139	1.592421
Isohemiphloin	_	-1.24	0.028524	1.448807
5-oxoproline	_	2.37	0.000579	1.953732
2'-Hydroxydaidzein	C02495	-1.34	0.009383	1.63758
Trifolin	C12626	-1.16	0.000457	1.960701
2'-Hydroxygenistein	C12134	-1.67	0.00327	1.776885
Prunetin	C10521	-1.97	0.000712	1.927344
D-Xylose	C00181	-0.96	0.005929	1.690321
Fmoc-Ile-OH	_	-2.29	0.000728	1.935684
Chrysophanol 8-O-glucoside	_	-0.93	0.031157	1.431017
Rhein 8-Glucoside	_	-1.08	0.004215	1.754792
4'-Hydroxyacetophenone	C10700	3.27	9.67E-05	2.064498
Isomucronulatol-7-O-glucoside	_	-0.8	0.032936	1.447205
Crocetin	C08588	-0.83	0.010455	1.616941
Coumestrol	C10205	-0.71	0.003207	1.783466
Methylenesuccinic acid	C00490	0.38	0.013617	1.590562
D-Xylulose	C00310	-1.1	0.000502	1.941296
Kuwanon A	_	-0.95	0.027372	1.459633
N-[(Tert-butoxy)carbonyl]-L-tryptophan	_	-0.27	0.013951	1.572399
P-Coumaryl Alcohol	C02646	-0.93	0.003198	1.766122
Physcion 8-O-Beta-D-Monoglucoside	C10384	-2.76	0.001875	1.844077
N-Acetyl-L-glutamic acid	C00624	-0.65	0.01453	1.561586
Succinic anhydride	C19524	-0.8	0.007688	1.685531
3-O-p-coumaroyl shikimic acid O-hexoside	_	-0.89	0.021935	1.512206
2-Oxoadipic acid	C00322	-0.89	0.006003	1.713551
p-Coumaric acid-4-O-glucoside	_	-1.34	0.004136	1.75774
6'-O-Feruloyl-D-sucrose	_	-0.8	0.043965	1.378134
(-)-Jasmonoyl-L-isoleucine	C18699	0.92	0.00874	1.635426
1-O-Gentisoyl-D-glucoside	_	-1.32	0.00928	1.63715
9,10,13-Trihydroxyoctadec-11-enoic acid	_	-0.49	0.00794	1.670881
Koaburaside	_	-1.67	0.002623	1.799153
2-O-Caffeoylmalic acid	_	-0.58	0.014861	1.568269
Eicosadienoic acid	C16525	-1.04	0.008711	1.658912
1-O-Galloyl-D-glucose	_	-1.04	0.015998	1.542612
2,2-Dimethylsuccinic acid	_	-0.67	0.017645	1.542197
N-Acetyl-L-Tryptophan	_	-1.44	0.000244	2.008045
METABOLITES_END
#END