{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST001955","ANALYSIS_ID":"AN003181","VERSION":"1","CREATED_ON":"October 27, 2021, 4:52 pm"},

"PROJECT":{"PROJECT_TITLE":"Metabonomics analysis reveals the physiological mechanism of promoting maize shoots growth under negative pressure to stabilize soil water content","PROJECT_SUMMARY":"The purpose of this study is to analyze maize shoots growth under negative pressure to stabilize soil water content，Maize plants were subjected to two irrigation treatments. The first treatment was soil moisture dry-wet cycles, which was obtained using drip irrigation (control, DW). The second treatment was negative pressure to stabilize soil water content treatment (SW), which was obtained using the negative pressure irrigation (NPI) system.","INSTITUTE":"Heilongjiang Bayi Agricultural University","LAST_NAME":"Zhang","FIRST_NAME":"Jili","ADDRESS":"High tech Zone, Longfei District, Daqing, Heilongjiang, 163319, China","EMAIL":"zhangjili12@163.com","PHONE":"86-13504899312"},

"STUDY":{"STUDY_TITLE":"Metabonomics analysis reveals the physiological mechanism of promoting maize shoots growth under negative pressure to stabilize soil water content","STUDY_SUMMARY":"The purpose of this study is to analyze maize shoots growth under negative pressure to stabilize soil water content，Maize plants were subjected to two irrigation treatments. The first treatment was soil moisture dry-wet cycles, which was obtained using drip irrigation (control, DW). The second treatment was negative pressure to stabilize soil water content treatment (SW), which was obtained using the negative pressure irrigation (NPI) system.","INSTITUTE":"Heilongjiang Bayi Agricultural University","LAST_NAME":"Zhang","FIRST_NAME":"Jili","ADDRESS":"High tech Zone, Longfei District, Daqing, Heilongjiang, 163319, China","EMAIL":"zhangjili12@163.com","PHONE":"+86-13504899312"},

"SUBJECT":{"SUBJECT_TYPE":"Plant","SUBJECT_SPECIES":"Zea mays","TAXONOMY_ID":"4577"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"DW1-negative",
"Sample ID":"DW1",
"Factors":{"Treatment":"control"},
"Additional sample data":{"RAW_FILE_NAME":"DW1_N.wiff"}
},
{
"Subject ID":"DW2-negative",
"Sample ID":"DW2",
"Factors":{"Treatment":"control"},
"Additional sample data":{"RAW_FILE_NAME":"DW2_N.wiff"}
},
{
"Subject ID":"DW3-negative",
"Sample ID":"DW3",
"Factors":{"Treatment":"control"},
"Additional sample data":{"RAW_FILE_NAME":"DW3_N.wiff"}
},
{
"Subject ID":"DW1-positive",
"Sample ID":"DW4",
"Factors":{"Treatment":"control"},
"Additional sample data":{"RAW_FILE_NAME":"DW1_P.wiff"}
},
{
"Subject ID":"DW2-positive",
"Sample ID":"DW5",
"Factors":{"Treatment":"control"},
"Additional sample data":{"RAW_FILE_NAME":"DW2_P.wiff"}
},
{
"Subject ID":"DW3-positive",
"Sample ID":"DW6",
"Factors":{"Treatment":"control"},
"Additional sample data":{"RAW_FILE_NAME":"DW3_P.wiff"}
},
{
"Subject ID":"SW1-negative",
"Sample ID":"SW1",
"Factors":{"Treatment":"Moisture treatment"},
"Additional sample data":{"RAW_FILE_NAME":"SW1_N.wiff"}
},
{
"Subject ID":"SW2-negative",
"Sample ID":"SW2",
"Factors":{"Treatment":"Moisture treatment"},
"Additional sample data":{"RAW_FILE_NAME":"SW2_N.wiff"}
},
{
"Subject ID":"SW3-negative",
"Sample ID":"SW3",
"Factors":{"Treatment":"Moisture treatment"},
"Additional sample data":{"RAW_FILE_NAME":"SW3_N.wiff"}
},
{
"Subject ID":"SW1-positive",
"Sample ID":"SW4",
"Factors":{"Treatment":"Moisture treatment"},
"Additional sample data":{"RAW_FILE_NAME":"SW1_P.wiff"}
},
{
"Subject ID":"SW2-positive",
"Sample ID":"SW5",
"Factors":{"Treatment":"Moisture treatment"},
"Additional sample data":{"RAW_FILE_NAME":"SW2_P.wiff"}
},
{
"Subject ID":"SW3-positive",
"Sample ID":"SW6",
"Factors":{"Treatment":"Moisture treatment"},
"Additional sample data":{"RAW_FILE_NAME":"SW3_P.wiff"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"A total of 121 differential metabolites (75 were increased and 46 were decreased) were identified in maize leaves cultivated under conditions of stable soil water content and dry-wet cycles.","SAMPLE_TYPE":"new"},

"TREATMENT":{"TREATMENT_SUMMARY":"Maize plants were subjected to two irrigation treatments. The first treatment was soil moisture dry-wet cycles, which was obtained using drip irrigation (control, DW). The second treatment was negative pressure to stabilize soil water content treatment (SW), which was obtained using the negative pressure irrigation (NPI) system."},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"Collected samples were thawed on ice, and metabolites were extracted from 20 µL of each sample using 120 µL of precooled 50% methanol buffer. Next, the mixture of metabolites was vortexed for 1 min, followed by incubation for 10 min at room temperature, and storing at -20°C overnight. On the next day, the mixture was centrifuged at 4,000 g for 20 min and the supernatant was subsequently transferred to 96 well plates. Samples were stored at ‐80°C prior to the LC‐MS analysis. Pooled quality control (QC) samples were also prepared by combining 10 μL of each extraction mixture"},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_TYPE":"HILIC","INSTRUMENT_NAME":"TripleTOF 5600","COLUMN_NAME":"ACQUITY UPLC T3 column (100mm×2.1mm, 1.8µm, Waters, UK)"},

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

"MS":{"INSTRUMENT_NAME":"ABI Sciex 5600+ TripleTOF","INSTRUMENT_TYPE":"Triple TOF","MS_TYPE":"APCI","ION_MODE":"POSITIVE","MS_COMMENTS":"XCMS software (verison 3.4.1）"},

"MS_METABOLITE_DATA":{
"Units":"μg/100ml",

"Data":[{"Metabolite":"(-)-Riboflavin","DW1":"3585.031947","DW2":"3412.155023","DW3":"3749.759135","SW1":"3315.891191","SW2":"3677.34753","SW3":"3374.024012"},{"Metabolite":"(??)-(E)-13-Hydroxy-10-oxo-11-octadecenoic acid","DW1":"12428.00333","DW2":"11465.97163","DW3":"13350.67236","SW1":"22827.93395","SW2":"22075.14201","SW3":"27407.13726"},{"Metabolite":"(2'E,4'Z,7'Z,8E)-Colnelenic acid","DW1":"397130.9952","DW2":"437731.6485","DW3":"363946.7655","SW1":"659922.8832","SW2":"575060.4224","SW3":"638050.5028"},{"Metabolite":"(2R,3S)-2-methyl-3-propyloxirane","DW1":"4782.05107","DW2":"4818.031024","DW3":"3455.404714","SW1":"7682.905709","SW2":"10683.92685","SW3":"2559.631765"},{"Metabolite":"(3S,6E,10E)-1,6,10,14-Phytatetraen-3-ol","DW1":"10901.5548","DW2":"11473.99053","DW3":"11049.17982","SW1":"11454.41023","SW2":"11710.23516","SW3":"11424.95399"},{"Metabolite":"(4-Aminobutyl)guanidine","DW1":"641.6775726","DW2":"760.5789911","DW3":"717.1246874","SW1":"1430.396303","SW2":"1582.135626","SW3":"1613.078814"},{"Metabolite":"(E)-2,6-Dimethyl-2,5-heptadienoic acid","DW1":"7704.308267","DW2":"7886.802067","DW3":"7781.37272","SW1":"9537.178151","SW2":"9837.438042","SW3":"10057.3668"},{"Metabolite":"(E)-6,10-Dimethyl-9-methylene-5-undecen-2-one","DW1":"2352.924404","DW2":"2438.909114","DW3":"3477.161684","SW1":"2515.615821","SW2":"3620.926475","SW3":"2701.260945"},{"Metabolite":"(S)-(+)-Citramailc acid","DW1":"3184.774683","DW2":"3114.353906","DW3":"1345.171831","SW1":"2515.001658","SW2":"2242.766547","SW3":"2796.778202"},{"Metabolite":"(S)-p-Mentha-1,8-dien-10-yl acetate","DW1":"15860.39078","DW2":"13150.22121","DW3":"13518.28097","SW1":"13952.7701","SW2":"16860.15825","SW3":"13088.86817"},{"Metabolite":"(S,E)-Lyratol propanoate","DW1":"1943.1477","DW2":"1731.629542","DW3":"1726.936512","SW1":"2005.609784","SW2":"1916.638313","SW3":"3265.79181"},{"Metabolite":"(Z)-1,3-Octadiene","DW1":"6187.998603","DW2":"6450.432386","DW3":"6360.498065","SW1":"6554.037395","SW2":"6221.420602","SW3":"6708.250762"},{"Metabolite":"(Z)-Farnesol","DW1":"3480.547622","DW2":"4943.460777","DW3":"3134.839204","SW1":"3224.019621","SW2":"3173.461566","SW3":"8719.046597"},{"Metabolite":"(卤)-Tryptophan","DW1":"38319.76486","DW2":"36229.94242","DW3":"35315.75224","SW1":"42683.63936","SW2":"41417.96794","SW3":"44744.14592"},{"Metabolite":".alpha.-Hexylcinnamaldehyde","DW1":"5218.573366","DW2":"4870.475331","DW3":"5482.935758","SW1":"8657.507376","SW2":"10013.31501","SW3":"9617.118512"},{"Metabolite":".beta.-Damascone","DW1":"1831.055107","DW2":"1480.561187","DW3":"1576.582923","SW1":"2012.740536","SW2":"1892.789082","SW3":"1960.595809"},{"Metabolite":".gamma.-Dodecalactone","DW1":"1352.389258","DW2":"1701.040968","DW3":"1601.564736","SW1":"1373.258803","SW2":"1468.161389","SW3":"1480.259962"},{"Metabolite":"1,2,3,4,Tetrahydro-1,5,7-trimethylnapthalene","DW1":"905.5210745","DW2":"691.1775374","DW3":"549.4946013","SW1":"850.6022168","SW2":"1253.31308","SW3":"929.1146597"},{"Metabolite":"1,24-Dihydroxyvitamin D3","DW1":"7072.245934","DW2":"7340.65797","DW3":"44196.95871","SW1":"12820.74627","SW2":"1342.853673","SW3":"2804.9543"},{"Metabolite":"1,2-Dimethyl-4-(6-methyl-4-heptenyl)-1,3-cyclohexadiene","DW1":"3074.896438","DW2":"2058.850595","DW3":"1971.5511","SW1":"2684.49641","SW2":"2628.899154","SW3":"2570.67372"},{"Metabolite":"1,3,5-Benzenetriol","DW1":"710.546403","DW2":"712.7334184","DW3":"704.8170699","SW1":"750.584809","SW2":"637.32272","SW3":"771.8062654"},{"Metabolite":"1,3,5-Trihydroxy-6,7-dimethoxy-2-methylanthraquinone","DW1":"2610.784551","DW2":"2877.217958","DW3":"2862.822201","SW1":"2717.147378","SW2":"2969.751672","SW3":"2591.516155"},{"Metabolite":"10-Undecynoic acid","DW1":"2064.980847","DW2":"2930.5452","DW3":"3644.372479","SW1":"2878.639628","SW2":"3191.687119","SW3":"2316.816576"},{"Metabolite":"11,12-Methylenedioxykopsinaline","DW1":"5435.948208","DW2":"3251.345022","DW3":"3481.595518","SW1":"7827.184559","SW2":"7283.95641","SW3":"5982.495639"},{"Metabolite":"11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione","DW1":"5987.884071","DW2":"6072.473171","DW3":"6011.85614","SW1":"16394.97562","SW2":"16707.37097","SW3":"17048.42299"},{"Metabolite":"12(13)Ep-9-KODE","DW1":"21632.39769","DW2":"20962.20774","DW3":"24720.64487","SW1":"22740.52168","SW2":"24039.09439","SW3":"23614.65732"},{"Metabolite":"12,13-Dihydroxy-9Z-octadecenoic acid","DW1":"2374.026241","DW2":"2372.508284","DW3":"2518.848367","SW1":"1458.001618","SW2":"1479.291048","SW3":"2601.769695"},{"Metabolite":"13,14-Dihydro-15-ketoprostaglandin A2","DW1":"15672.86747","DW2":"24661.78015","DW3":"26078.01408","SW1":"41775.48028","SW2":"45252.17948","SW3":"49161.26487"},{"Metabolite":"15-deoxy-delta12,14-Prostaglandin J2-2-glycerol ester","DW1":"3283.214746","DW2":"3357.151867","DW3":"3338.590528","SW1":"2109.559308","SW2":"1862.977584","SW3":"2029.811244"},{"Metabolite":"17-Epiestriol","DW1":"30332.63955","DW2":"31319.63729","DW3":"31158.72532","SW1":"29998.29936","SW2":"17928.11973","SW3":"30299.37509"},{"Metabolite":"1-Kestose","DW1":"6592.791692","DW2":"7603.746047","DW3":"6963.076901","SW1":"3037.28288","SW2":"3409.720969","SW3":"2812.684926"},{"Metabolite":"1-Methyladenosine","DW1":"2340.66256","DW2":"2231.303608","DW3":"1985.18167","SW1":"2790.79591","SW2":"2699.070418","SW3":"2585.246393"},{"Metabolite":"1-Octanone, 1-(4-methoxyphenyl)-2-(1-pyrrolidinyl)-","DW1":"840.8997647","DW2":"701.9467785","DW3":"775.7335538","SW1":"621.5137269","SW2":"896.8626313","SW3":"440.5948029"},{"Metabolite":"1-Pyrroline","DW1":"23441.60378","DW2":"21723.28722","DW3":"22964.65269","SW1":"8479.377254","SW2":"7662.589352","SW3":"8079.421357"},{"Metabolite":"2,2',3,4,4',5',6-Heptabromodiphenyl ether","DW1":"1260.766277","DW2":"7831.174538","DW3":"3782.951025","SW1":"2154.847592","SW2":"3047.455953","SW3":"5640.145384"},{"Metabolite":"2,5-Dimethyloxazole","DW1":"11923.73303","DW2":"11843.29558","DW3":"10358.56896","SW1":"13281.13974","SW2":"12390.8935","SW3":"11956.13176"},{"Metabolite":"2,6-Dihydroxybenzoic acid","DW1":"2058.70725","DW2":"2212.568934","DW3":"2274.437098","SW1":"4024.150357","SW2":"4372.947214","SW3":"3987.227588"},{"Metabolite":"20-Hydroxyarachidonic acid","DW1":"7826.011476","DW2":"4696.106325","DW3":"6536.804996","SW1":"6078.957954","SW2":"6262.60031","SW3":"6055.700011"},{"Metabolite":"26,27-Dinorcholest-5-en-24-yne-3,20-diol, (3.beta.)-","DW1":"9202.971141","DW2":"10432.18215","DW3":"9367.941015","SW1":"10798.57081","SW2":"10889.26308","SW3":"11829.07618"},{"Metabolite":"2-acetoxy-4-pentadecylbenzoic acid","DW1":"24394.49178","DW2":"26861.35866","DW3":"40478.13091","SW1":"30340.11508","SW2":"24838.74953","SW3":"34918.53505"},{"Metabolite":"2-Aminoisobutyric acid","DW1":"12076.49188","DW2":"12583.402","DW3":"10229.43711","SW1":"9777.378015","SW2":"6366.922069","SW3":"9430.888188"},{"Metabolite":"2-Aminonaphthalene","DW1":"1984.443566","DW2":"2017.598694","DW3":"1908.966418","SW1":"2201.918892","SW2":"1894.159429","SW3":"2187.822193"},{"Metabolite":"2-Benzoxazolol","DW1":"420.541128","DW2":"621.0720369","DW3":"526.5861743","SW1":"400.039549","SW2":"715.8478704","SW3":"393.8868957"},{"Metabolite":"2-Chloro-3-deazaadenosine","DW1":"2060.842385","DW2":"2017.163456","DW3":"2208.589267","SW1":"1356.386788","SW2":"1502.72152","SW3":"1539.529457"},{"Metabolite":"2-Coumaric acid","DW1":"36341.17349","DW2":"33680.31695","DW3":"32167.23639","SW1":"27804.58571","SW2":"32731.29365","SW3":"28006.57563"},{"Metabolite":"2'-Deoxyadenosine","DW1":"637.5621236","DW2":"551.5359726","DW3":"646.7564372","SW1":"385.2533865","SW2":"348.29416","SW3":"369.1633039"},{"Metabolite":"2-Hexyl-4-pentynoic acid","DW1":"9312.267268","DW2":"10584.76095","DW3":"9600.752321","SW1":"9499.245058","SW2":"10029.79759","SW3":"9905.135724"},{"Metabolite":"2-Hydroxy-3-methoxybenzaldehyde","DW1":"4047.800229","DW2":"4019.50113","DW3":"3963.687883","SW1":"2027.819147","SW2":"1997.559313","SW3":"2200.459915"},{"Metabolite":"2-Hydroxycinnamic acid","DW1":"26024.30811","DW2":"24467.95073","DW3":"22539.60528","SW1":"17225.5807","SW2":"16499.34598","SW3":"16370.2274"},{"Metabolite":"2-Isopropyl-5-methyl-2-hexenal","DW1":"2921.564375","DW2":"3235.851225","DW3":"3276.290335","SW1":"3718.037839","SW2":"3740.298655","SW3":"3163.210693"},{"Metabolite":"2-Linoleoylglycerol","DW1":"13655.71344","DW2":"15813.84366","DW3":"15839.31641","SW1":"10770.35278","SW2":"11653.49624","SW3":"8131.186566"},{"Metabolite":"2'-O-Methyladenosine","DW1":"17636.64982","DW2":"17158.57007","DW3":"18003.80575","SW1":"14526.58961","SW2":"12707.41971","SW3":"15568.73352"},{"Metabolite":"2-Phenylacetamide","DW1":"147587.1858","DW2":"154991.0169","DW3":"138488.6896","SW1":"135278.3696","SW2":"128698.7979","SW3":"127705.8967"},{"Metabolite":"2-Piperidinone","DW1":"55961.67078","DW2":"73801.1272","DW3":"75247.14166","SW1":"55814.92556","SW2":"73101.91491","SW3":"48481.95431"},{"Metabolite":"2-trans-4-trans-7-cis-Decatrienal","DW1":"2323.340172","DW2":"2229.265399","DW3":"2450.01016","SW1":"3046.871671","SW2":"3178.510434","SW3":"3185.105384"},{"Metabolite":"3-(4-Hydroxyphenyl)-1-propanol","DW1":"9417.797648","DW2":"4060.401898","DW3":"7670.819984","SW1":"5133.250422","SW2":"5707.09817","SW3":"4878.51015"},{"Metabolite":"3,4-Methylenesebacic acid","DW1":"13050.77911","DW2":"11759.13467","DW3":"14347.39973","SW1":"16851.02774","SW2":"10319.64715","SW3":"11099.63419"},{"Metabolite":"3',5'-Cyclic AMP","DW1":"761.3612367","DW2":"827.2030967","DW3":"739.0470384","SW1":"1181.013307","SW2":"1008.956196","SW3":"1131.760801"},{"Metabolite":"3,5-Dimethoxycinnamic acid","DW1":"4058.435366","DW2":"4325.486522","DW3":"5313.052472","SW1":"2913.962015","SW2":"3078.637568","SW3":"3340.490258"},{"Metabolite":"3beta-Hydroxycinnamolide","DW1":"2098.180121","DW2":"2657.619996","DW3":"2681.03286","SW1":"3611.264901","SW2":"3735.872037","SW3":"5112.590048"},{"Metabolite":"3-Deazaadenosine","DW1":"4623.100985","DW2":"4420.746574","DW3":"4539.76193","SW1":"6860.93984","SW2":"5853.32704","SW3":"8242.844409"},{"Metabolite":"3-Hydroxyadipic acid","DW1":"29104.97765","DW2":"32955.70168","DW3":"31258.6417","SW1":"30587.21483","SW2":"31781.41959","SW3":"27855.55328"},{"Metabolite":"3-Hydroxyadipic acid 3,6-lactone","DW1":"470.4834004","DW2":"625.502865","DW3":"576.7184225","SW1":"519.3188369","SW2":"689.4465549","SW3":"539.4033923"},{"Metabolite":"3-Hydroxyanthranilic acid","DW1":"655.6220747","DW2":"520.87897","DW3":"474.0069292","SW1":"531.8493881","SW2":"628.4727357","SW3":"739.4274035"},{"Metabolite":"3-Hydroxybenzoic acid","DW1":"4917.822615","DW2":"5080.589101","DW3":"4713.742808","SW1":"2459.97198","SW2":"2523.413257","SW3":"2649.0626"},{"Metabolite":"4-Coumaric 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acid"},{"metabolite_name":"20-Hydroxyarachidonic acid"},{"metabolite_name":"26,27-Dinorcholest-5-en-24-yne-3,20-diol, (3.beta.)-"},{"metabolite_name":"2-acetoxy-4-pentadecylbenzoic acid"},{"metabolite_name":"2-Aminoisobutyric acid"},{"metabolite_name":"2-Aminonaphthalene"},{"metabolite_name":"2-Benzoxazolol"},{"metabolite_name":"2-Chloro-3-deazaadenosine"},{"metabolite_name":"2-Coumaric acid"},{"metabolite_name":"2'-Deoxyadenosine"},{"metabolite_name":"2-Hexyl-4-pentynoic acid"},{"metabolite_name":"2-Hydroxy-3-methoxybenzaldehyde"},{"metabolite_name":"2-Hydroxycinnamic acid"},{"metabolite_name":"2-Isopropyl-5-methyl-2-hexenal"},{"metabolite_name":"2-Linoleoylglycerol"},{"metabolite_name":"2'-O-Methyladenosine"},{"metabolite_name":"2-Phenylacetamide"},{"metabolite_name":"2-Piperidinone"},{"metabolite_name":"2-trans-4-trans-7-cis-Decatrienal"},{"metabolite_name":"3-(4-Hydroxyphenyl)-1-propanol"},{"metabolite_name":"3,4-Methylenesebacic acid"},{"metabolite_name":"3',5'-Cyclic AMP"},{"metabolite_name":"3,5-Dimethoxycinnamic acid"},{"metabolite_name":"3beta-Hydroxycinnamolide"},{"metabolite_name":"3-Deazaadenosine"},{"metabolite_name":"3-Hydroxyadipic acid"},{"metabolite_name":"3-Hydroxyadipic acid 3,6-lactone"},{"metabolite_name":"3-Hydroxyanthranilic acid"},{"metabolite_name":"3-Hydroxybenzoic acid"},{"metabolite_name":"4-Coumaric acid"},{"metabolite_name":"4-Hydroxybenzaldehyde"},{"metabolite_name":"4'-Methylacetophenone"},{"metabolite_name":"5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-chromen-4-one"},{"metabolite_name":"5.beta.-Pregnane-3.alpha.,17-diol-20-one"},{"metabolite_name":"5-Methylcytosine"},{"metabolite_name":"5-Methyldeoxycytidine"},{"metabolite_name":"5'-S-Methylthioadenosine"},{"metabolite_name":"6,10,14-Trimethyl-5,9,13-pentadecatrien-2-one"},{"metabolite_name":"7-Methylguanosine"},{"metabolite_name":"8(9)-Epoxy-5Z,11Z,14Z,17Z-eicosatetraenoic acid"},{"metabolite_name":"8(9)-Epoxy-5Z,11Z,14Z-eicosatrienoic acid"},{"metabolite_name":"8Z,14Z-Eicosadienoic acid"},{"metabolite_name":"9-(Benzylamino)-1,2,3,4-tetrahydroacridin-1-ol"},{"metabolite_name":"9,10-DiHODE"},{"metabolite_name":"9,10-Epoxyoctadecenoic acid"},{"metabolite_name":"9,12-Octadecadiynoic acid"},{"metabolite_name":"9-Oxo-10(E),12(E)-octadecadienoic acid"},{"metabolite_name":"9-Oxo-10E,12Z,15Z-octadecatrienoic acid"},{"metabolite_name":"9-Oxo-11-(3-pentyl-2-oxiranyl)-10E-undecenoic acid"},{"metabolite_name":"9-Oxoprosta-10,12Z,14E-trienoic acid"},{"metabolite_name":"9Z,11E,13E-Octadecatrienoic acid ethyl ester"},{"metabolite_name":"Acetyl-DL-carnitine"},{"metabolite_name":"Acylcarnitine 13:0"},{"metabolite_name":"Acylcarnitine 14:3"},{"metabolite_name":"Acylcarnitine 15:2"},{"metabolite_name":"Acylcarnitine 15:3"},{"metabolite_name":"Acylcarnitine 18:5"},{"metabolite_name":"Acylcarnitine 19:4"},{"metabolite_name":"Acylcarnitine 21:5"},{"metabolite_name":"Acylcarnitine 22:5"},{"metabolite_name":"Adenine"},{"metabolite_name":"Ala-Phe"},{"metabolite_name":"Ala-Tyr"},{"metabolite_name":"alpha-dihydrotetrabenazine"},{"metabolite_name":"alpha-Ionene"},{"metabolite_name":"alpha-Irone"},{"metabolite_name":"Ambronide"},{"metabolite_name":"Anileridine"},{"metabolite_name":"Apigenin 6-C-glucoside 8-C-arabinoside"},{"metabolite_name":"Arginine"},{"metabolite_name":"Arginyl-Proline"},{"metabolite_name":"Arg-Leu"},{"metabolite_name":"Ascorbic acid 6-palmitate"},{"metabolite_name":"Asn-Phe"},{"metabolite_name":"Asn-Pro"},{"metabolite_name":"Asparagine"},{"metabolite_name":"Aspartame"},{"metabolite_name":"Aspartic acid"},{"metabolite_name":"Aspartyl-Leucine"},{"metabolite_name":"Asp-Pro"},{"metabolite_name":"Asp-Trp"},{"metabolite_name":"Asp-Tyr"},{"metabolite_name":"Beclomethasone"},{"metabolite_name":"Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-nitro-"},{"metabolite_name":"Benzophenone"},{"metabolite_name":"beta-Alanyl-L-lysine"},{"metabolite_name":"Betaine"},{"metabolite_name":"beta-Santalal"},{"metabolite_name":"Bufalin"},{"metabolite_name":"Butyl 4-hydroxybenzoate"},{"metabolite_name":"Cadabicine"},{"metabolite_name":"Carbetapentane"},{"metabolite_name":"Carnosic acid"},{"metabolite_name":"Cer(d18:0/14:0)"},{"metabolite_name":"Cer[NS] 34:3; Cer[NS](d18:2/16:1)"},{"metabolite_name":"Chlorogenic acid"},{"metabolite_name":"Choline"},{"metabolite_name":"cis-5,8,11,14-Eicosatetraenoic acid"},{"metabolite_name":"cis-5,8,11-Eicosatrienoic acid"},{"metabolite_name":"Clenbuterol"},{"metabolite_name":"Clindamycin"},{"metabolite_name":"Cordycepin"},{"metabolite_name":"Corticosterone"},{"metabolite_name":"Coumarin"},{"metabolite_name":"Curcumol"},{"metabolite_name":"Cyclic GMP"},{"metabolite_name":"Cyclohexanecarboxylic acid, 1-phenyl-, 2-(4-morpholinyl)ethyl ester"},{"metabolite_name":"Cytarabine"},{"metabolite_name":"Cytosine"},{"metabolite_name":"D-Alanine"},{"metabolite_name":"Deoxycytidine"},{"metabolite_name":"Deoxyguanosine"},{"metabolite_name":"DErySphingosine"},{"metabolite_name":"Dexmedetomidine"},{"metabolite_name":"DGTS 21:1; DGTS(2:0/19:1)"},{"metabolite_name":"Di(2-nonyl) phthalate"},{"metabolite_name":"Dibutyl phthalate"},{"metabolite_name":"Diethyl phthalic acid"},{"metabolite_name":"Dihydrojasmonic acid"},{"metabolite_name":"DL-Leu-DL-Val"},{"metabolite_name":"Docosatrienoic acid"},{"metabolite_name":"Dodeca-2(E),4(E)-dienoic acid"},{"metabolite_name":"D-Pipecolinic acid"},{"metabolite_name":"Drofenine"},{"metabolite_name":"Dronedarone"},{"metabolite_name":"Eremopetasinorol"},{"metabolite_name":"Erucamide"},{"metabolite_name":"Esprocarb"},{"metabolite_name":"Ethanone, 1-[1-(2-cyclohexylethyl)-1H-indol-3-yl]-2-(2-methoxyphenyl)-"},{"metabolite_name":"Ethenyl acetate"},{"metabolite_name":"Ethylparaben"},{"metabolite_name":"Fenpropimorph"},{"metabolite_name":"Furanylfentanyl"},{"metabolite_name":"Gabapentin"},{"metabolite_name":"Galaxolidone"},{"metabolite_name":"Gardneramine"},{"metabolite_name":"Geranylcitronellol"},{"metabolite_name":"Gerberinol"},{"metabolite_name":"Gibberellin A64"},{"metabolite_name":"Ginkgolide B"},{"metabolite_name":"GlcADG 34:2; GlcADG(16:0/18:2)"},{"metabolite_name":"Gln-Leu"},{"metabolite_name":"Gln-Phe"},{"metabolite_name":"Glucose 6-phosphate"},{"metabolite_name":"Glu-Gly-Glu"},{"metabolite_name":"Glu-Leu"},{"metabolite_name":"Glu-Phe"},{"metabolite_name":"Glutamic acid"},{"metabolite_name":"Glutamine"},{"metabolite_name":"Glu-Trp"},{"metabolite_name":"Glu-Val-Phe"},{"metabolite_name":"Glycyl-L-norleucine"},{"metabolite_name":"Gly-Lys"},{"metabolite_name":"Gly-Phe"},{"metabolite_name":"Gly-Pro"},{"metabolite_name":"Gly-Trp"},{"metabolite_name":"Gly-Tyr"},{"metabolite_name":"Gly-Val"},{"metabolite_name":"Guanine"},{"metabolite_name":"Guanosine"},{"metabolite_name":"Guanosine-3',5'-cyclic monophosphate"},{"metabolite_name":"Hirsuteine"},{"metabolite_name":"His-Leu"},{"metabolite_name":"His-Pro"},{"metabolite_name":"Histidine"},{"metabolite_name":"His-Val"},{"metabolite_name":"Homoorientin"},{"metabolite_name":"Hydrocinnamic acid ethyl ester"},{"metabolite_name":"Hydrocortisone"},{"metabolite_name":"Ibuprofen"},{"metabolite_name":"Idoxanthin"},{"metabolite_name":"Ile-Ala"},{"metabolite_name":"Ile-Arg"},{"metabolite_name":"Ile-Gln"},{"metabolite_name":"Ile-Lys"},{"metabolite_name":"Ile-Pro-Ile"},{"metabolite_name":"Ile-Thr"},{"metabolite_name":"Ile-Trp"},{"metabolite_name":"Ile-Tyr"},{"metabolite_name":"Indane"},{"metabolite_name":"Indole-3-carboxyaldehyde"},{"metabolite_name":"Iressa"},{"metabolite_name":"Isoleucine"},{"metabolite_name":"Isoleucyl-Leucine"},{"metabolite_name":"Isomaltose"},{"metabolite_name":"Isonicotinic acid"},{"metabolite_name":"Isoreserpin"},{"metabolite_name":"isorhamnetin"},{"metabolite_name":"isorhamnetin-3-O-rutinoside"},{"metabolite_name":"Isothankunic acid"},{"metabolite_name":"Isovitexin"},{"metabolite_name":"Isoxanthohumol"},{"metabolite_name":"Jasmonic acid"},{"metabolite_name":"Kaempferol-3-O-rutinoside"},{"metabolite_name":"Keracyanin"},{"metabolite_name":"Kynurenic acid"},{"metabolite_name":"L-5-Oxoproline"},{"metabolite_name":"L-Alanyl-L-norleucine"},{"metabolite_name":"Leu-Arg"},{"metabolite_name":"Leucodopachrome"},{"metabolite_name":"Leu-Glu"},{"metabolite_name":"Leu-Gly-Leu"},{"metabolite_name":"Leu-Pro"},{"metabolite_name":"Leu-Thr"},{"metabolite_name":"Linoleic acid"},{"metabolite_name":"Linsidomine cation"},{"metabolite_name":"L-Methionine"},{"metabolite_name":"Lovastatin"},{"metabolite_name":"L-Pipecolic acid"},{"metabolite_name":"L-prolyl-L-proline"},{"metabolite_name":"Luteolin"},{"metabolite_name":"Lysine"},{"metabolite_name":"LysoPC 16:0"},{"metabolite_name":"Maysin"},{"metabolite_name":"Melilotigenin"},{"metabolite_name":"Meperidine"},{"metabolite_name":"Methanone, (4-hydroxyphenyl)(1-pentyl-1H-indol-3-yl)-"},{"metabolite_name":"Methionine"},{"metabolite_name":"Methyl (2E,6Z)-dodecadienoate"},{"metabolite_name":"Methyl dihydrojasmonate"},{"metabolite_name":"Methyl jasmonate"},{"metabolite_name":"Methylgingerol"},{"metabolite_name":"Monolinolenin (9c,12c,15c)"},{"metabolite_name":"Moupinamide"},{"metabolite_name":"Murrayazolinol"},{"metabolite_name":"Myclobutanil"},{"metabolite_name":"N,N-Dimethylguanosine"},{"metabolite_name":"N,O-Didesmethylvenlafaxine"},{"metabolite_name":"N4-Acetylsulfadimethoxine"},{"metabolite_name":"N-Acetylamphetamine"},{"metabolite_name":"N-Acetyl-L-phenylalanine"},{"metabolite_name":"Nandrolone"},{"metabolite_name":"N-Carbamoylputrescine"},{"metabolite_name":"Neomenthyldiphenylphosphine oxide"},{"metabolite_name":"Nerolidyl acetate"},{"metabolite_name":"Norecasantalic acid"},{"metabolite_name":"O-(4-Hydroxybenzoyl)tropine"},{"metabolite_name":"O,O-Diethyl phosphate"},{"metabolite_name":"Octyl 4-methoxycinnamic acid"},{"metabolite_name":"O-Desmethyl-cis-tramadol"},{"metabolite_name":"Oleamide"},{"metabolite_name":"Oxandrolone"},{"metabolite_name":"Palmitamide"},{"metabolite_name":"Palmitelaidic acid"},{"metabolite_name":"Palmitoyl ethanolamide"},{"metabolite_name":"PC(14:1(9Z)/16:0)"},{"metabolite_name":"PC(15:0/16:1(9Z))"},{"metabolite_name":"PE(16:0/18:1(11Z))"},{"metabolite_name":"PE(22:5(7Z,10Z,13Z,16Z,19Z)/14:1(9Z))"},{"metabolite_name":"Penicillamine disulfide"},{"metabolite_name":"Pergolide"},{"metabolite_name":"Phaeophorbide b"},{"metabolite_name":"Phe-Ala"},{"metabolite_name":"Phe-Asp"},{"metabolite_name":"Phe-Gln"},{"metabolite_name":"Phenylacetaldehyde"},{"metabolite_name":"Phenylalanine"},{"metabolite_name":"Pheophorbide a"},{"metabolite_name":"Phe-Pro"},{"metabolite_name":"Phe-Thr"},{"metabolite_name":"Phe-Val"},{"metabolite_name":"Phytosphingosine"},{"metabolite_name":"Piperidine"},{"metabolite_name":"Proline"},{"metabolite_name":"Propanediamide, N1-(5-chloro-2-hydroxyphenyl)-N3-octyl-"},{"metabolite_name":"Propofol"},{"metabolite_name":"Pro-Pro"},{"metabolite_name":"Propyl 2,4-decadienoate"},{"metabolite_name":"Prostaglandin B3"},{"metabolite_name":"Protoanemonin"},{"metabolite_name":"Puberanidine"},{"metabolite_name":"Punicic acid"},{"metabolite_name":"Pyroglutamylvaline"},{"metabolite_name":"Pyrrolidine"},{"metabolite_name":"Rishitin"},{"metabolite_name":"Robinin"},{"metabolite_name":"Saponarin"},{"metabolite_name":"Sclareolide"},{"metabolite_name":"Ser-Ile"},{"metabolite_name":"Serine"},{"metabolite_name":"Ser-Lys"},{"metabolite_name":"Ser-Phe"},{"metabolite_name":"Ser-Pro"},{"metabolite_name":"Sinapic acid"},{"metabolite_name":"Sinapoyl aldehyde"},{"metabolite_name":"SM 26:3; SM(d14:2/12:1)"},{"metabolite_name":"Somniferine"},{"metabolite_name":"Stearamide"},{"metabolite_name":"Strychnine"},{"metabolite_name":"Tetracycline"},{"metabolite_name":"Tetradecylamine"},{"metabolite_name":"TG 36:3; TG(12:1/12:1/12:1)"},{"metabolite_name":"Thalsimidine"},{"metabolite_name":"Threonine"},{"metabolite_name":"Thr-Leu"},{"metabolite_name":"Thr-Phe"},{"metabolite_name":"Thr-Pro"},{"metabolite_name":"Thr-Tyr"},{"metabolite_name":"Thr-Val"},{"metabolite_name":"Thymidine"},{"metabolite_name":"Thymine"},{"metabolite_name":"trans-4-Coumaric acid"},{"metabolite_name":"trans-Ferulic acid"},{"metabolite_name":"trans-Zeatin"},{"metabolite_name":"Traumatin"},{"metabolite_name":"Trehalose"},{"metabolite_name":"Tricin 7-diglucuronoside"},{"metabolite_name":"Tridecyl phloretate"},{"metabolite_name":"Triethylene glycol monobutyl ether"},{"metabolite_name":"Trigonelline"},{"metabolite_name":"Tris(1,3-dichloro-2-propyl) phosphate"},{"metabolite_name":"Tris(2-chloropropyl) phosphate"},{"metabolite_name":"Trp-Asp"},{"metabolite_name":"Trp-Pro"},{"metabolite_name":"Tyr-Asp"},{"metabolite_name":"Tyr-Gln"},{"metabolite_name":"Tyr-Gly"},{"metabolite_name":"Tyr-Leu"},{"metabolite_name":"Tyrosine"},{"metabolite_name":"Tyrosyl-Phenylalanine"},{"metabolite_name":"Tyr-Thr"},{"metabolite_name":"Uracil"},{"metabolite_name":"Uridine"},{"metabolite_name":"Val-Ala"},{"metabolite_name":"Val-Asn"},{"metabolite_name":"Val-Asp"},{"metabolite_name":"Valganciclovir"},{"metabolite_name":"Val-Gly-Val"},{"metabolite_name":"Valine"},{"metabolite_name":"Val-Lys"},{"metabolite_name":"Val-Phe"},{"metabolite_name":"Val-Pro"},{"metabolite_name":"Val-Ser"},{"metabolite_name":"Val-Thr"},{"metabolite_name":"Val-Trp"},{"metabolite_name":"Val-Tyr"},{"metabolite_name":"Val-Val"},{"metabolite_name":"Val-Val-Val"},{"metabolite_name":"Vitexin-2''-O-rhamnoside"},{"metabolite_name":"Zeanoside B"}]
}

}