{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST002493","ANALYSIS_ID":"AN004086","VERSION":"1","CREATED_ON":"02-27-2023"},

"PROJECT":{"PROJECT_TITLE":"Periodic Table of Plants","PROJECT_TYPE":"MS Untargeted Metabolomics","PROJECT_SUMMARY":"The goal of this study was to use metabolomics as a platform to elucidate the chemical composition of plants in order to increase their resolution and in turn use the identified chemicals to reveal potential health impacts.","INSTITUTE":"Northeastern University; Massachusets Institute of Technology","DEPARTMENT":"Department of Physics","LABORATORY":"BarabasiLab","LAST_NAME":"Barabasi","FIRST_NAME":"Albert-Laszlo","ADDRESS":"177 Huntington Ave, 11th Floor, Boston, MA, 02115, USA","EMAIL":"ccnrad@gmail.com","PHONE":"6173734071","FUNDING_SOURCE":"Rockefeller Foundation","DOI":"http://dx.doi.org/10.21228/M8QH77"},

"STUDY":{"STUDY_TITLE":"Composition of raw plant-based food items Pilot Study","STUDY_TYPE":"Composition of food","STUDY_SUMMARY":"The goal of this pilot study was to be a preliminary metabolomics study on the platforms used to elucidate the chemical composition of plants in order to increase their resolution and in turn use the identified chemicals to reveal potential health impacts. In this pilot we focused on 6 food items: apple, basil, lettuce, strawberry, tomato, and garlic.","INSTITUTE":"Northeastern University; Massachusets Institute of Technology","DEPARTMENT":"Department of Physics","LABORATORY":"BarabasiLab","LAST_NAME":"Barabasi","FIRST_NAME":"Albert-Laszlo","ADDRESS":"177 Huntington Ave, 11th Floor, Boston, MA, 02115, USA","EMAIL":"ccnrad@gmail.com","PHONE":"6173734071","SUBMIT_DATE":"2023-02-21"},

"SUBJECT":{"SUBJECT_TYPE":"Plant","SUBJECT_SPECIES":"Malus domestica/Solanum lycopersicum/Lactuca sativa/Fragaria x ananassa/Allium sativum/Ocimum basilicum"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"-",
"Sample ID":"A1",
"Factors":{"Species":"Apple","Variety":"Gala"}
},
{
"Subject ID":"-",
"Sample ID":"B1",
"Factors":{"Species":"Basil","Variety":"Sweet"}
},
{
"Subject ID":"-",
"Sample ID":"G1",
"Factors":{"Species":"Garlic","Variety":"Softneck"}
},
{
"Subject ID":"-",
"Sample ID":"L1",
"Factors":{"Species":"Lettuce","Variety":"Iceberg"}
},
{
"Subject ID":"-",
"Sample ID":"S1",
"Factors":{"Species":"Strawberry","Variety":"Honeoye"}
},
{
"Subject ID":"-",
"Sample ID":"T1",
"Factors":{"Species":"Tomato","Variety":"Globe type"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"Metabolomics experiments were performed on 6 food items collected from Stop & Shop. The six food items were apple, basil, garlic, lettuce, strawberry, and tomato for the analysis.","SAMPLE_TYPE":"Plant"},

"TREATMENT":{"TREATMENT_SUMMARY":"Since we bought the plant-based food items from a local grocery store, the only treatment prior to metabolomics analysis would be those performed by the distribution pipeline to get the items to the grocery store. We did not perform any treatments of our own prior to metabolomics analysis."},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"After purchase the items are directly taken into a humidity-controlled room and exposure to light was minimized. The foods are prepared following how they are commonly eaten; for example, apples cores are removed. Food items are rinsed with water if the consumed part is exposed; for example, apples are washed. The edible parts are sliced and chopped into small 1 cm^3 pieces with a knife on a glass cutting board. This process is repeated for all six items. About 120 g of each item are frozen at -80C for 16 hrs and after transferred into a freeze dryer (Catalog No. 10-269-56B from LabConco/Fisher) and a dark room for 24 hrs. Afterwards the pieces are put into a coffee grinder (Kitchen Aid, 170W, Model No. BCG111OBO) and pulverized to yield a fine powder. The powder is stored at -80C and 200 mg is shipped in argon filled vials under dry ice to the metabolomics center. Only one sample of each food items was sent."},

"CHROMATOGRAPHY":{"INSTRUMENT_NAME":"Waters Acquity","COLUMN_NAME":"Waters ACQUITY UPLC BEH Amide (150 x 2.1mm,1.7um)","COLUMN_TEMPERATURE":"40C","FLOW_GRADIENT":"0-2 min 100% (B), 2-7 min 100%-70% (B), 7.7-9 min 100%-40% (B), 9.5-10.25 min 40%-30% (B), 10.25-12.75 min 30%-100% (B), 12.75-16.75 min 100% (B)","FLOW_RATE":"0.4 mL/min","SOLVENT_A":"100% water; 10 mM ammonium formiate; 0.125% formic acid","SOLVENT_B":"95% acetonitrile/5% water; 10 mM ammonium formiate; 0.125% formic acid","CHROMATOGRAPHY_TYPE":"HILIC"},

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

"MS":{"INSTRUMENT_NAME":"Agilent 6530 QTOF","INSTRUMENT_TYPE":"QTOF","MS_TYPE":"ESI","MS_COMMENTS":"Additional information is attached in the associated files.","ION_MODE":"POSITIVE"},

"MS_METABOLITE_DATA":{
"Units":"peak intensity",

"Data":[{"Metabolite":"10-Hydroxy-2-decenoic acid","A1":"519735.0000","B1":"342901.0000","G1":"218040.0000","L1":"2406003.0000","S1":"2307264.0000","T1":"468230.0000"},{"Metabolite":"1_15N2-L-Arginine iSTD","A1":"30750518.0000","B1":"18987584.0000","G1":"33166488.0000","L1":"34629352.0000","S1":"","T1":"31747244.0000"},{"Metabolite":"1_3_4_6-Tetra-O-acetyl-.beta.-D-mannopyranose","A1":"5882572.0000","B1":"9184.0000","G1":"675931.0000","L1":"1043386.0000","S1":"4219922.0000","T1":"7809.0000"},{"Metabolite":"1_3-Benzenediol_ 5-methyl-4-[(1R_6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-","A1":"8538.0000","B1":"1047115.0000","G1":"4582.0000","L1":"14829.0000","S1":"502355.0000","T1":"72728.0000"},{"Metabolite":"1_4-Cyclohexanedione","A1":"1294483.0000","B1":"1169848.0000","G1":"2060462.0000","L1":"5280810.0000","S1":"3812550.0000","T1":"5404456.0000"},{"Metabolite":"1_5-Pentanediamine","A1":"1657990.0000","B1":"1553054.0000","G1":"1158774.0000","L1":"20105150.0000","S1":"1580484.0000","T1":"4131607.0000"},{"Metabolite":"1_6-Anhydro-2_3-O-isopropylidene-.beta.-D-mannopyranose","A1":"189118.0000","B1":"28946.0000","G1":"406442.0000","L1":"381270.0000","S1":"92887.0000","T1":"16559.0000"},{"Metabolite":"1-.beta.-D-Arabinofuranosyluracil 5^-monophosphate","A1":"526.0000","B1":"230409.0000","G1":"5260.0000","L1":"26911.0000","S1":"36547.0000","T1":"277575.0000"},{"Metabolite":"1_CUDA iSTD","A1":"22406264.0000","B1":"27185070.0000","G1":"20312430.0000","L1":"20755780.0000","S1":"","T1":"24878474.0000"},{"Metabolite":"1_D10-Isoleucine iSTD","A1":"22577364.0000","B1":"25858756.0000","G1":"20885966.0000","L1":"21385012.0000","S1":"","T1":"20378674.0000"},{"Metabolite":"1_D10-Leucine iSTD","A1":"44210508.0000","B1":"43681560.0000","G1":"43160664.0000","L1":"46076712.0000","S1":"","T1":"46248896.0000"},{"Metabolite":"1_D3-1-Methylnicotinamide iSTD","A1":"276860960.0000","B1":"280537024.0000","G1":"268225904.0000","L1":"292278752.0000","S1":"","T1":"273663360.0000"},{"Metabolite":"1_D3-AC(2:0) iSTD","A1":"66979832.0000","B1":"62636692.0000","G1":"61678492.0000","L1":"68693200.0000","S1":"","T1":"64706952.0000"},{"Metabolite":"1_D3-Aspartic Acid iSTD","A1":"5890322.0000","B1":"4056264.0000","G1":"7218437.0000","L1":"4626892.0000","S1":"","T1":"15003469.0000"},{"Metabolite":"1_D3-Creatine iSTD","A1":"78140760.0000","B1":"77982160.0000","G1":"159334496.0000","L1":"149988768.0000","S1":"","T1":"168227664.0000"},{"Metabolite":"1_D3-Creatinine iSTD","A1":"347542240.0000","B1":"348616000.0000","G1":"354960448.0000","L1":"356552096.0000","S1":"","T1":"353736448.0000"},{"Metabolite":"1_D3-DL-Alanine iSTD","A1":"19402316.0000","B1":"19306786.0000","G1":"24522662.0000","L1":"23230314.0000","S1":"","T1":"22583196.0000"},{"Metabolite":"1_D3-DL-Glutamic acid iSTD","A1":"23909600.0000","B1":"18052860.0000","G1":"28318528.0000","L1":"26183438.0000","S1":"","T1":"25247140.0000"},{"Metabolite":"1_D3-Histamine_ N-methyl- iSTD","A1":"5505384.0000","B1":"6180572.0000","G1":"4129051.0000","L1":"4841887.0000","S1":"","T1":"4339014.0000"},{"Metabolite":"1_D3-L-Carnitine iSTD","A1":"157655568.0000","B1":"139970048.0000","G1":"224964960.0000","L1":"149712128.0000","S1":"","T1":"154543120.0000"},{"Metabolite":"1_D3-Serine iSTD","A1":"6216262.0000","B1":"6141169.0000","G1":"8280126.0000","L1":"7866316.0000","S1":"","T1":"8152652.0000"},{"Metabolite":"1_D4-Cystine iSTD","A1":"2109847.0000","B1":"2054732.0000","G1":"2557456.0000","L1":"2092985.0000","S1":"","T1":"2922502.0000"},{"Metabolite":"1_D5-Glutamic acid iSTD","A1":"21084238.0000","B1":"15113738.0000","G1":"23454680.0000","L1":"21592568.0000","S1":"","T1":"20739824.0000"},{"Metabolite":"1_D5-L-Glutamine iSTD","A1":"19859376.0000","B1":"16434014.0000","G1":"36809044.0000","L1":"38431592.0000","S1":"","T1":"25681058.0000"},{"Metabolite":"1_D5-Threonine iSTD","A1":"4337174.0000","B1":"6671487.0000","G1":"6899411.0000","L1":"6760811.0000","S1":"","T1":"8950365.0000"},{"Metabolite":"1_D7-Arginine iSTD","A1":"84842912.0000","B1":"53079672.0000","G1":"91353320.0000","L1":"96591416.0000","S1":"","T1":"87481184.0000"},{"Metabolite":"1_D7-Proline iSTD","A1":"58919752.0000","B1":"53751872.0000","G1":"97440360.0000","L1":"62403436.0000","S1":"","T1":"62122052.0000"},{"Metabolite":"1_D8-Phenylalanine iSTD","A1":"13998575.0000","B1":"12691539.0000","G1":"12247054.0000","L1":"15294519.0000","S1":"","T1":"13876274.0000"},{"Metabolite":"1_D8-Tryptophan iSTD","A1":"4173254.0000","B1":"3934042.0000","G1":"3849507.0000","L1":"4632840.0000","S1":"","T1":"4140423.0000"},{"Metabolite":"1_D9-Betaine iSTD","A1":"363027392.0000","B1":"359936960.0000","G1":"348940640.0000","L1":"369166912.0000","S1":"","T1":"361492288.0000"},{"Metabolite":"1_D9-Butyrobetaine iSTD","A1":"288126176.0000","B1":"250531232.0000","G1":"389184128.0000","L1":"269879648.0000","S1":"","T1":"272859264.0000"},{"Metabolite":"1_D9-Choline iSTD","A1":"148358592.0000","B1":"106542840.0000","G1":"111558976.0000","L1":"211582736.0000","S1":"","T1":"209756800.0000"},{"Metabolite":"1_D9-Crotonobetaine iSTD","A1":"380683424.0000","B1":"368039296.0000","G1":"454657280.0000","L1":"380686336.0000","S1":"","T1":"428597920.0000"},{"Metabolite":"1_D9-TMAO iSTD","A1":"85991688.0000","B1":"80877928.0000","G1":"81941464.0000","L1":"88088640.0000","S1":"","T1":"80970128.0000"},{"Metabolite":"1-Hexadecylamine","A1":"256300.0000","B1":"160466.0000","G1":"208336.0000","L1":"351123.0000","S1":"544535.0000","T1":"477726.0000"},{"Metabolite":"1H-Imidazole_ 1-[2-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)propoxy]ethyl]-","A1":"6985.0000","B1":"5900.0000","G1":"589.9900","L1":"139740.0000","S1":"93277.0000","T1":"120403.0000"},{"Metabolite":"1-Methylnicotinamide","A1":"212672.0000","B1":"283496.0000","G1":"185321.0000","L1":"488064.0000","S1":"344796.0000","T1":"108932.0000"},{"Metabolite":"1-Methyltryptophan","A1":"904.3800","B1":"904.3800","G1":"378918.0000","L1":"904.3800","S1":"904.3800","T1":"904.3800"},{"Metabolite":"1-naphthylamine","A1":"444.8100","B1":"444.8100","G1":"61196.0000","L1":"7121.0000","S1":"34494.0000","T1":"31904398.0000"},{"Metabolite":"1_Val-Tyr-Val iSTD","A1":"2316950.0000","B1":"2060158.0000","G1":"1908740.0000","L1":"2444975.0000","S1":"","T1":"2257380.0000"},{"Metabolite":"2_4-Thiazolidinedione_ 5-[[4-[2-(2-thienyl)ethoxy]phenyl]methylene]-","A1":"7883.0000","B1":"788.2600","G1":"29305460.0000","L1":"788.2600","S1":"788.2600","T1":"788.2600"},{"Metabolite":"2_6-Diaminopimelic acid","A1":"148625.0000","B1":"537426.0000","G1":"33716.0000","L1":"38655.0000","S1":"55644.0000","T1":"55487.0000"},{"Metabolite":"2_6-Di-tert-butyl-4-hydroxymethylphenol","A1":"1261081.0000","B1":"1364434.0000","G1":"13522.0000","L1":"860710.0000","S1":"1046377.0000","T1":"779260.0000"},{"Metabolite":"2-alpha-Mannobiose","A1":"51000.0000","B1":"142310.0000","G1":"937.8800","L1":"188635.0000","S1":"23022.0000","T1":"937.8800"},{"Metabolite":"2-Amino-1-phenylethanol","A1":"342828.0000","B1":"778402.0000","G1":"2243793.0000","L1":"4681880.0000","S1":"750086.0000","T1":"8764845.0000"},{"Metabolite":"2-Amino-2-methyl-1_3-propanediol","A1":"42656.0000","B1":"48206.0000","G1":"45363.0000","L1":"97723.0000","S1":"35472.0000","T1":"75931.0000"},{"Metabolite":"2-Aminoadipic acid","A1":"43221.0000","B1":"266797.0000","G1":"524981.0000","L1":"196035.0000","S1":"220757.0000","T1":"541982.0000"},{"Metabolite":"2^-Deoxyadenosine","A1":"1032825.0000","B1":"978369.0000","G1":"565476.0000","L1":"744298.0000","S1":"578533.0000","T1":"257879.0000"},{"Metabolite":"2^-Deoxycytidine 5^-monophosphate","A1":"2147.9000","B1":"454558.0000","G1":"2147.9000","L1":"2147.9000","S1":"2147.9000","T1":"2147.9000"},{"Metabolite":"2^-Deoxyguanosine","A1":"151757.0000","B1":"120656.0000","G1":"29473.0000","L1":"200892.0000","S1":"122159.0000","T1":"58184.0000"},{"Metabolite":"2-Hydroxy-5-nitrobenzyl alcohol","A1":"1514913.0000","B1":"11936189.0000","G1":"6392502.0000","L1":"390063.0000","S1":"2695202.0000","T1":"21011928.0000"},{"Metabolite":"2^-O-Methyladenosine","A1":"7194.0000","B1":"52324.0000","G1":"262242.0000","L1":"220348.0000","S1":"25609.0000","T1":"146452.0000"},{"Metabolite":"2^-O-Methylguanosine","A1":"709.6500","B1":"55775.0000","G1":"114510.0000","L1":"319634.0000","S1":"7097.0000","T1":"758993.0000"},{"Metabolite":"(2-oxo-2_3-dihydro-1H-indol-3-yl)acetic acid","A1":"2324.6000","B1":"2324.6000","G1":"782650.0000","L1":"2324.6000","S1":"65011.0000","T1":"2324.6000"},{"Metabolite":"2-tert-Butyl-p-quinone","A1":"25030.0000","B1":"1468533.0000","G1":"20319.0000","L1":"23643.0000","S1":"22610.0000","T1":"21092.0000"},{"Metabolite":"3_4-Dihydroxyphenylacetic acid","A1":"1331.3200","B1":"1426962.0000","G1":"13313.0000","L1":"1331.3200","S1":"1331.3200","T1":"1331.3200"},{"Metabolite":"3_4-Dihydroxyphenylalanine (DOPA)","A1":"850.6800","B1":"850.6800","G1":"850.6800","L1":"850.6800","S1":"8507.0000","T1":"3535414.0000"},{"Metabolite":"(3_4-Dihydroxyphenyl)ethanol","A1":"4164.1000","B1":"4164.1000","G1":"4164.1000","L1":"4164.1000","S1":"334919.0000","T1":"4164.1000"},{"Metabolite":"3_4-Dimethylmethcathinone","A1":"795.3000","B1":"320641.0000","G1":"416790.0000","L1":"423413.0000","S1":"795.3000","T1":"72881.0000"},{"Metabolite":"3_7_4^-Trihydroxyflavone","A1":"19811.6200","B1":"19811.6200","G1":"19811.6200","L1":"19811.6200","S1":"1159919.0000","T1":"19811.6200"},{"Metabolite":"3_7-Dihydroxy-3^_4^-dimethoxyflavone","A1":"2861.1400","B1":"2131465.0000","G1":"28611.0000","L1":"2861.1400","S1":"2861.1400","T1":"2861.1400"},{"Metabolite":"3.alpha._4.beta._3.alpha.-Galactotetraose","A1":"14346.0000","B1":"1434.5500","G1":"25418950.0000","L1":"5105103.0000","S1":"1434.5500","T1":"1434.5500"},{"Metabolite":"3.alpha._4.beta.-Galactotriose","A1":"20766360.0000","B1":"137629.0000","G1":"29934896.0000","L1":"1733657.0000","S1":"16094015.0000","T1":"116532.0000"},{"Metabolite":"3.alpha.-Galactobiose","A1":"3881450.0000","B1":"8038.5000","G1":"80385.0000","L1":"376401.0000","S1":"3406742.0000","T1":"8038.5000"},{"Metabolite":"3.alpha.-Mannobiose","A1":"27318220.0000","B1":"119224.0000","G1":"3326839.0000","L1":"4884934.0000","S1":"18504408.0000","T1":"46436.0000"},{"Metabolite":"(3-Carboxypropyl)trimethylammonium","A1":"146579.0000","B1":"224292.0000","G1":"12577473.0000","L1":"223532.0000","S1":"251823.0000","T1":"190594.0000"},{"Metabolite":"3-Cyclopentene-1-octanoic acid_ 2-(3-hydroxy-1-penten-1-yl)-5-oxo-","A1":"823.8400","B1":"642422.0000","G1":"823.8400","L1":"471786.0000","S1":"72255.0000","T1":"262409.0000"},{"Metabolite":"3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid","A1":"199322.0000","B1":"5347.0000","G1":"11198.0000","L1":"232907.0000","S1":"534.6800","T1":"365587.0000"},{"Metabolite":"3-Furancarboxylic acid_ tetrahydro-4-methylene-2-octyl-5-oxo-_ (2R_3S)-rel-","A1":"126981.0000","B1":"879313.0000","G1":"83546.0000","L1":"196353.0000","S1":"88209.0000","T1":"198222.0000"},{"Metabolite":"3^-Galactosyllactose","A1":"1958029.0000","B1":"9582.7100","G1":"95827.0000","L1":"271263.0000","S1":"2283693.0000","T1":"9582.7100"},{"Metabolite":"3-Hydroxy-4-methoxybenzyl alcohol","A1":"23150.0000","B1":"580436.0000","G1":"144256.0000","L1":"309941.0000","S1":"1131843.0000","T1":"60226.0000"},{"Metabolite":"3-Hydroxy-6_3^_4^-trimethoxyflavone","A1":"1083986.0000","B1":"22597508.0000","G1":"1083986.0000","L1":"1083986.0000","S1":"1083986.0000","T1":"1083986.0000"},{"Metabolite":"3-Methoxytyramine","A1":"5476.0000","B1":"23285.0000","G1":"1834264.0000","L1":"457.2000","S1":"457.2000","T1":"169811.0000"},{"Metabolite":"3-Methylcytidine","A1":"2041.0300","B1":"20410.0000","G1":"2041.0300","L1":"60206.0000","S1":"2041.0300","T1":"474796.0000"},{"Metabolite":"3-Methylhippuric acid","A1":"272935.0000","B1":"436277.0000","G1":"213203.0000","L1":"252454.0000","S1":"849655.0000","T1":"321399.0000"},{"Metabolite":"3-Methylhistidine","A1":"373076.0000","B1":"182285.0000","G1":"1065047.0000","L1":"342816.0000","S1":"436199.0000","T1":"513131.0000"},{"Metabolite":"3-Methylthiopropylamine","A1":"490.4600","B1":"5150.0000","G1":"490.4600","L1":"490.4600","S1":"5474.0000","T1":"3613330.0000"},{"Metabolite":"3-Pyridinecarboxaldehyde","A1":"509.5400","B1":"8379.0000","G1":"746537.0000","L1":"5237.0000","S1":"13923.0000","T1":"509.5400"},{"Metabolite":"3-Pyridinemethanol","A1":"1062553.0000","B1":"19656.0000","G1":"2675207.0000","L1":"30199.0000","S1":"7802696.0000","T1":"437017.0000"},{"Metabolite":"(3R)-4_4-Dimethyl-2-oxotetrahydro-3-furanyl beta-D-glucopyranoside","A1":"60497.0000","B1":"34075.0000","G1":"2704.3000","L1":"2704.3000","S1":"762569.0000","T1":"2704.3000"},{"Metabolite":"4-(2-Hydroxyethyl)piperazine-1-ethanesulfonic acid","A1":"300398.0000","B1":"265689.0000","G1":"187280.0000","L1":"1854871.0000","S1":"1677455.0000","T1":"34997.0000"},{"Metabolite":"4_4-Dimethyl-L-glutamic acid","A1":"34091.0000","B1":"17445.0000","G1":"7835.0000","L1":"13487.0000","S1":"111342.0000","T1":"5221366.0000"},{"Metabolite":"4^_7-Dimethoxy-3-hydroxyflavone","A1":"87023.6200","B1":"1892597.0000","G1":"87023.6200","L1":"87023.6200","S1":"87023.6200","T1":"87023.6200"},{"Metabolite":"4-Acetamidobutyric acid","A1":"5532.0000","B1":"30329.0000","G1":"47620.0000","L1":"111260.0000","S1":"32130.0000","T1":"1941.0000"},{"Metabolite":"4-Aminobenzoic acid","A1":"107818384.0000","B1":"454459.0000","G1":"452992128.0000","L1":"266287584.0000","S1":"143874384.0000","T1":"427395072.0000"},{"Metabolite":"4-Guanidinobutyric acid","A1":"443823.0000","B1":"4404138.0000","G1":"3132988.0000","L1":"1238202.0000","S1":"980252.0000","T1":"467090.0000"},{"Metabolite":"4-Hydroxy-3-methoxyamphetamine","A1":"516.2700","B1":"516.2700","G1":"516.2700","L1":"516.2700","S1":"516.2700","T1":"533012.0000"},{"Metabolite":"4-Hydroxyhippuric acid","A1":"21576.5200","B1":"2731842.0000","G1":"21576.5200","L1":"21576.5200","S1":"21576.5200","T1":"21576.5200"},{"Metabolite":"4-(Hydroxymethyl)-1-isopropyl-3-cyclohexen-1-yl beta-D-glucopyranoside","A1":"8434.6300","B1":"8434.6300","G1":"8434.6300","L1":"8434.6300","S1":"459640.0000","T1":"8434.6300"},{"Metabolite":"4-Ketopimelic acid","A1":"6766.4900","B1":"6766.4900","G1":"6766.4900","L1":"6766.4900","S1":"745700.0000","T1":"6766.4900"},{"Metabolite":"4^-Methoxypelargonidin","A1":"9993.4600","B1":"1013441.0000","G1":"9993.4600","L1":"9993.4600","S1":"9993.4600","T1":"9993.4600"},{"Metabolite":"4-Methyl-5-thiazoleethanol","A1":"311935.0000","B1":"1602.0100","G1":"24192.0000","L1":"17643.0000","S1":"16020.0000","T1":"1602.0100"},{"Metabolite":"4-Methylbenzyl alcohol","A1":"57525.0000","B1":"668623.0000","G1":"21230.0000","L1":"180906.0000","S1":"168473.0000","T1":"103467.0000"},{"Metabolite":"4-Pyridoxic acid","A1":"1352791.0000","B1":"1531474.0000","G1":"1917957.0000","L1":"10943537.0000","S1":"7182248.0000","T1":"173449.0000"},{"Metabolite":"5_3^-Dihydroxy-6_7_4^-trimethoxyflavone","A1":"1388.8200","B1":"19312682.0000","G1":"13888.0000","L1":"1388.8200","S1":"1388.8200","T1":"1388.8200"},{"Metabolite":"5-Amino-1-methyl-2-piperidinone","A1":"10949.0000","B1":"16857.0000","G1":"787285.0000","L1":"24681.0000","S1":"12016.0000","T1":"6103.0000"},{"Metabolite":"5-Androstene-3.beta._17.beta.-diol","A1":"47582.0000","B1":"69394.0000","G1":"61365.0000","L1":"3451664.0000","S1":"191903.0000","T1":"98144.0000"},{"Metabolite":"5-Hydroxy-2-methylpyridine","A1":"17736.0000","B1":"14684.0000","G1":"521035.0000","L1":"18813.0000","S1":"23284.0000","T1":"6601.0000"},{"Metabolite":"5-Methylcytidine","A1":"22048.1800","B1":"22048.1800","G1":"22048.1800","L1":"22048.1800","S1":"22048.1800","T1":"295765.0000"},{"Metabolite":"5-Methylcytosine","A1":"105570.0000","B1":"672394.0000","G1":"1068722.0000","L1":"509353.0000","S1":"54679.0000","T1":"1011712.0000"},{"Metabolite":"5^-S-Methyl-5^-thioadenosine","A1":"377678.0000","B1":"1313745.0000","G1":"2487062.0000","L1":"530690.0000","S1":"1252587.0000","T1":"4597525.0000"},{"Metabolite":"6-[5_7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy-3_4_5-trihydroxyoxane-2-carboxylic acid","A1":"27917.4900","B1":"27917.4900","G1":"27917.4900","L1":"27917.4900","S1":"1191970.0000","T1":"27917.4900"},{"Metabolite":"6-Methyladenosine","A1":"66535.0000","B1":"682159.0000","G1":"202440.0000","L1":"949796.0000","S1":"131276.0000","T1":"8387510.0000"},{"Metabolite":"6^^-O-Malonylgenistin","A1":"589.4300","B1":"589.4300","G1":"5894.0000","L1":"589.4300","S1":"2001587.0000","T1":"589.4300"},{"Metabolite":"7-Methylguanosine","A1":"3955.1200","B1":"39551.0000","G1":"128209.0000","L1":"98626.0000","S1":"3955.1200","T1":"725497.0000"},{"Metabolite":"9(10)-Epoxy-12Z-octadecenoic acid","A1":"37022.0000","B1":"90969.0000","G1":"35468.0000","L1":"287515.0000","S1":"156437.0000","T1":"1711098.0000"},{"Metabolite":"9-Oxo-10E_12Z_15Z-octadecatrienoic acid","A1":"610.4600","B1":"282668.0000","G1":"610.4600","L1":"24434274.0000","S1":"173221.0000","T1":"110546.0000"},{"Metabolite":"9-Oxo-10E_12Z-octadecadienoic acid","A1":"526520.0000","B1":"443211.0000","G1":"128782.0000","L1":"1172060.0000","S1":"1273446.0000","T1":"1888706.0000"},{"Metabolite":"Abietic acid","A1":"532692.0000","B1":"826836.0000","G1":"179360.0000","L1":"692948.0000","S1":"839610.0000","T1":"672599.0000"},{"Metabolite":"(+)-Abscisic acid","A1":"138008.0000","B1":"184562.0000","G1":"9594.5300","L1":"141799.0000","S1":"9467272.0000","T1":"1269265.0000"},{"Metabolite":"Abscisic acid","A1":"43084.0000","B1":"73369.0000","G1":"508.5100","L1":"31766.0000","S1":"2404900.0000","T1":"341168.0000"},{"Metabolite":"Acetylcarnitine","A1":"71455.0000","B1":"33375.0000","G1":"1738290.0000","L1":"546433.0000","S1":"177513.0000","T1":"47952.0000"},{"Metabolite":"Acetyl coenzyme A","A1":"1042.1600","B1":"253073.0000","G1":"10422.0000","L1":"97361.0000","S1":"880896.0000","T1":"1042.1600"},{"Metabolite":"Acetyleugenol","A1":"17449.0000","B1":"3604212.0000","G1":"201479.0000","L1":"13669.0000","S1":"10289.0000","T1":"10976.0000"},{"Metabolite":"Adenine","A1":"7125194.0000","B1":"71198816.0000","G1":"3586498.0000","L1":"9270416.0000","S1":"29539954.0000","T1":"8814647.0000"},{"Metabolite":"Adenosine","A1":"23040272.0000","B1":"66374156.0000","G1":"32645692.0000","L1":"103442744.0000","S1":"102258160.0000","T1":"163829616.0000"},{"Metabolite":"Adenosine 5^-monophosphate","A1":"16774.0000","B1":"571414.0000","G1":"67393.0000","L1":"210876.0000","S1":"369851.0000","T1":"5963782.0000"},{"Metabolite":"Agmatine","A1":"80186.0000","B1":"805678.0000","G1":"2871808.0000","L1":"679638.0000","S1":"356691.0000","T1":"786948.0000"},{"Metabolite":"Ala-Ala","A1":"208261.0000","B1":"322749.0000","G1":"130932.0000","L1":"334294.0000","S1":"493086.0000","T1":"282748.0000"},{"Metabolite":"Ala-Ile","A1":"42508.0000","B1":"221355.0000","G1":"33126.0000","L1":"572610.0000","S1":"555339.0000","T1":"3312.6300"},{"Metabolite":"Ala-Lys","A1":"69315.0000","B1":"127745.0000","G1":"43171.0000","L1":"1207865.0000","S1":"305819.0000","T1":"34158.0000"},{"Metabolite":"Alanine","A1":"1396289.0000","B1":"21480762.0000","G1":"21912438.0000","L1":"17100532.0000","S1":"25482692.0000","T1":"3554014.0000"},{"Metabolite":"Ala-Val-Arg","A1":"5055.0000","B1":"25504.0000","G1":"505.4500","L1":"377855.0000","S1":"49894.0000","T1":"27333.0000"},{"Metabolite":"Aleuritic acid","A1":"5536949.0000","B1":"22375.0000","G1":"8078.6300","L1":"1833.2100","S1":"1833.2100","T1":"6626.6300"},{"Metabolite":"Allantoic acid","A1":"5402.0000","B1":"940226.0000","G1":"540.2200","L1":"3430909.0000","S1":"540.2200","T1":"8521.0000"},{"Metabolite":"Allicin","A1":"43057.6400","B1":"1629940.0000","G1":"6625554.0000","L1":"43057.6400","S1":"43057.6400","T1":"43057.6400"},{"Metabolite":".alpha._.beta.-Trehalose","A1":"182436.0000","B1":"3315060.0000","G1":"90147.0000","L1":"195999.0000","S1":"77267.0000","T1":"689119.0000"},{"Metabolite":".alpha.-Guanidinoglutaric acid","A1":"557246.0000","B1":"3653305.0000","G1":"1946109.0000","L1":"537471.0000","S1":"2448741.0000","T1":"23785050.0000"},{"Metabolite":".alpha.-Ionone","A1":"540.7100","B1":"674340.0000","G1":"540.7100","L1":"11064.0000","S1":"540.7100","T1":"540.7100"},{"Metabolite":"Apigenin 7-O-neohesperidoside","A1":"1632.3600","B1":"1632.3600","G1":"1632.3600","L1":"1632.3600","S1":"390211.0000","T1":"1632.3600"},{"Metabolite":"Apiin","A1":"809.5700","B1":"8096.0000","G1":"809.5700","L1":"809.5700","S1":"1568975.0000","T1":"809.5700"},{"Metabolite":"Arg-Ala","A1":"702078.0000","B1":"947624.0000","G1":"179393.0000","L1":"3712105.0000","S1":"1625014.0000","T1":"338845.0000"},{"Metabolite":"Arg-Gln","A1":"22818.0000","B1":"93531.0000","G1":"462.0800","L1":"322598.0000","S1":"47290.0000","T1":"6003.0000"},{"Metabolite":"Arg-Gly","A1":"277798.0000","B1":"566741.0000","G1":"39105.0000","L1":"732370.0000","S1":"715611.0000","T1":"19802.0000"},{"Metabolite":"Arginine; [M+H]+; HCD (NCE 20-30-40%)","A1":"18253724.0000","B1":"14478285.0000","G1":"517510528.0000","L1":"94688672.0000","S1":"25114374.0000","T1":"42944628.0000"},{"Metabolite":"Argininosuccinic acid","A1":"2307.6700","B1":"328638.0000","G1":"113579.0000","L1":"53073.0000","S1":"23077.0000","T1":"2307.6700"},{"Metabolite":"Arg-Leu","A1":"566450.0000","B1":"959084.0000","G1":"259477.0000","L1":"2628002.0000","S1":"772341.0000","T1":"154187.0000"},{"Metabolite":"Arg-Pro","A1":"639.4000","B1":"49569.0000","G1":"639.4000","L1":"146870.0000","S1":"6394.0000","T1":"639.4000"},{"Metabolite":"Arg-Tyr","A1":"56329.0000","B1":"121255.0000","G1":"136856.0000","L1":"317208.0000","S1":"126336.0000","T1":"137553.0000"},{"Metabolite":"Arg-Val","A1":"278859.0000","B1":"424685.0000","G1":"20276.0000","L1":"1031488.0000","S1":"397160.0000","T1":"24021.0000"},{"Metabolite":"Asn-Arg","A1":"69561.0000","B1":"112886.0000","G1":"6773.0000","L1":"619519.0000","S1":"150274.0000","T1":"12840.0000"},{"Metabolite":"Asparagine","A1":"15153058.0000","B1":"6581484.0000","G1":"15516699.0000","L1":"179347184.0000","S1":"217287776.0000","T1":"35353672.0000"},{"Metabolite":"Astragalin","A1":"29316.0000","B1":"49548.0000","G1":"711.8500","L1":"711.8500","S1":"1156689.0000","T1":"711.8500"},{"Metabolite":"Benzyl alcohol","A1":"139856.0000","B1":"1430906.0000","G1":"93222.0000","L1":"454889.0000","S1":"158775.0000","T1":"271345.0000"},{"Metabolite":".beta.-Carboline-1-propionic acid","A1":"1608464.0000","B1":"2480269.0000","G1":"134432.0000","L1":"608163.0000","S1":"533008.0000","T1":"467459.0000"},{"Metabolite":".beta.-Gentiobiose","A1":"580060.0000","B1":"2287385.0000","G1":"3038965.0000","L1":"838489.0000","S1":"248314.0000","T1":"650570.0000"},{"Metabolite":"Betaine","A1":"25183030.0000","B1":"23184354.0000","G1":"98353864.0000","L1":"66083488.0000","S1":"68857576.0000","T1":"14856252.0000"},{"Metabolite":".beta.-Sitosterol","A1":"225286.0000","B1":"745642.0000","G1":"605129.0000","L1":"1005500.0000","S1":"562094.0000","T1":"280682.0000"},{"Metabolite":"Bisabolol oxide A","A1":"35505.0000","B1":"695796.0000","G1":"3550.5500","L1":"53073.0000","S1":"31137778.0000","T1":"3550.5500"},{"Metabolite":"Caffeic acid","A1":"473.7400","B1":"64772.0000","G1":"4737.0000","L1":"473.7400","S1":"473.7400","T1":"363944.0000"},{"Metabolite":"Caffeine","A1":"22810.0000","B1":"76931.0000","G1":"1185.2000","L1":"37552.0000","S1":"61995.0000","T1":"16200.0000"},{"Metabolite":"(+)-Camphor","A1":"494.1500","B1":"2033809.0000","G1":"494.1500","L1":"4941.0000","S1":"494.1500","T1":"494.1500"},{"Metabolite":"Carnitine","A1":"2899997.0000","B1":"4033272.0000","G1":"19519226.0000","L1":"5891187.0000","S1":"6712755.0000","T1":"2119217.0000"},{"Metabolite":"Carnosine","A1":"21234.0000","B1":"47556.0000","G1":"854.6000","L1":"131032.0000","S1":"106239.0000","T1":"854.6000"},{"Metabolite":"(-)-Carveol","A1":"95337.0000","B1":"327451.0000","G1":"215620.0000","L1":"141908.0000","S1":"2783839.0000","T1":"233616.0000"},{"Metabolite":"(-)-Caryophyllene oxide","A1":"394458.0000","B1":"243923.0000","G1":"20098.0000","L1":"43583.0000","S1":"1577993.0000","T1":"108807.0000"},{"Metabolite":"Castanospermine","A1":"9810.0000","B1":"81759.0000","G1":"369299.0000","L1":"96096.0000","S1":"564191.0000","T1":"308136.0000"},{"Metabolite":"(+)-Catechin","A1":"9343578.0000","B1":"26035.0000","G1":"47161.9200","L1":"22306.9200","S1":"517381.0000","T1":"8639352.9200"},{"Metabolite":"Choline","A1":"187400816.0000","B1":"2755983616.0000","G1":"2708620800.0000","L1":"2766514432.0000","S1":"448604160.0000","T1":"2192644096.0000"},{"Metabolite":"Chromone-3-carboxylic acid","A1":"26688.0000","B1":"811001.0000","G1":"416732.0000","L1":"1852756.0000","S1":"910783.0000","T1":"2825716.0000"},{"Metabolite":"Cinnamaldehyde","A1":"6977.0000","B1":"11452.0000","G1":"9072.0000","L1":"271914.0000","S1":"856470.0000","T1":"170136.0000"},{"Metabolite":"cis-Jasmone","A1":"15201.0000","B1":"1891107.0000","G1":"12059.0000","L1":"244514.0000","S1":"44392.0000","T1":"148145.0000"},{"Metabolite":"Citric acid","A1":"87175.0000","B1":"68227.0000","G1":"77235.0000","L1":"138276.0000","S1":"706636.0000","T1":"77871.0000"},{"Metabolite":"Citrulline","A1":"587619.0000","B1":"9880051.0000","G1":"29512588.0000","L1":"4876682.0000","S1":"2396207.0000","T1":"19394334.0000"},{"Metabolite":"Coniferyl alcohol","A1":"431.2500","B1":"431.2500","G1":"4312.0000","L1":"6299.0000","S1":"11498215.0000","T1":"431.2500"},{"Metabolite":"Creatine","A1":"1795541.0000","B1":"1342524.0000","G1":"863083.0000","L1":"2508325.0000","S1":"9140832.0000","T1":"248780.0000"},{"Metabolite":"Creatinine","A1":"359848.0000","B1":"438288.0000","G1":"224875.0000","L1":"1237911.0000","S1":"1102693.0000","T1":"204706.0000"},{"Metabolite":"Curcumol","A1":"56323.0000","B1":"179247.0000","G1":"13080.0000","L1":"284853.0000","S1":"3262201.0000","T1":"73687.0000"},{"Metabolite":"Cystine","A1":"692.1800","B1":"6922.0000","G1":"12156.0000","L1":"692.1800","S1":"692.1800","T1":"48178.0000"},{"Metabolite":"Cytidine","A1":"144823.0000","B1":"52807.0000","G1":"198440.0000","L1":"206911.0000","S1":"655974.0000","T1":"1322445.0000"},{"Metabolite":"Cytidine-5^-monophosphate","A1":"1720.0400","B1":"17200.0000","G1":"1720.0400","L1":"1720.0400","S1":"313491.0000","T1":"73396.0000"},{"Metabolite":"Cytosine","A1":"774643.0000","B1":"407792.0000","G1":"473982.0000","L1":"579459.0000","S1":"800259.0000","T1":"1136178.0000"},{"Metabolite":"D-2-Aminoadipic acid","A1":"1960157.0000","B1":"803394.0000","G1":"1965819.0000","L1":"1213433.0000","S1":"2048518.0000","T1":"580839.0000"},{"Metabolite":".delta.-Octalactone","A1":"150785.0000","B1":"85572.0000","G1":"16542.0000","L1":"45947.0000","S1":"2741168.0000","T1":"305595.0000"},{"Metabolite":"D-erythro-Imidazolylglycerol phosphate","A1":"143470.0000","B1":"309156.0000","G1":"215654.0000","L1":"2133125.0000","S1":"76264.0000","T1":"241264.0000"},{"Metabolite":"D-Fructose 6-phosphate","A1":"14382.0000","B1":"64399.0000","G1":"1438.2000","L1":"15469.0000","S1":"332935.0000","T1":"528626.0000"},{"Metabolite":"D-Glucosamine","A1":"2956772.0000","B1":"259757.0000","G1":"1925222.0000","L1":"1446259.0000","S1":"1681255.0000","T1":"1224347.0000"},{"Metabolite":"D-Glucose 6-phosphate","A1":"203098.0000","B1":"441292.0000","G1":"17083.2300","L1":"481940.0000","S1":"1098809.0000","T1":"1342499.0000"},{"Metabolite":"Dicyclohexylamine","A1":"350197.0000","B1":"595631.0000","G1":"327548.0000","L1":"802104.0000","S1":"613720.0000","T1":"737789.0000"},{"Metabolite":"Digalacturonic acid","A1":"20419.2700","B1":"20419.2700","G1":"20419.2700","L1":"20419.2700","S1":"31826.7200","T1":"2345064.0000"},{"Metabolite":"(+)-Dihydrocervone","A1":"7020.0000","B1":"1042679.0000","G1":"5465.0000","L1":"9590.0000","S1":"87256.0000","T1":"21407.0000"},{"Metabolite":"Dikegulac acid","A1":"67700.0000","B1":"65686.0000","G1":"45796.0000","L1":"149501.0000","S1":"224850.0000","T1":"113654.0000"},{"Metabolite":"Dimethyl succinate","A1":"534.6200","B1":"534.6200","G1":"534.6200","L1":"534.6200","S1":"5346.0000","T1":"3620795.0000"},{"Metabolite":"DL-2-Methylglutamic acid","A1":"331745.0000","B1":"2034100.0000","G1":"115274.0000","L1":"567676.0000","S1":"515758.0000","T1":"555539.0000"},{"Metabolite":"DL-.alpha.-Aminopimelic acid","A1":"204624.0000","B1":"188385.0000","G1":"71390.0000","L1":"125713.0000","S1":"891210.0000","T1":"51712.0000"},{"Metabolite":"DL-Arginine","A1":"756469.0000","B1":"10059706.0000","G1":"83489776.0000","L1":"18325170.0000","S1":"887484.0000","T1":"352704.0000"},{"Metabolite":"DL-.beta.-Homoleucine","A1":"413047.0000","B1":"233899.0000","G1":"36433.0000","L1":"207364.0000","S1":"575197.0000","T1":"368772.0000"},{"Metabolite":"DL-Lanthionine","A1":"2011.8700","B1":"2011.8700","G1":"1899932.0000","L1":"2011.8700","S1":"2011.8700","T1":"2011.8700"},{"Metabolite":"DL-Octopamine","A1":"11621.0000","B1":"2984097.0000","G1":"3531090.0000","L1":"5013.0000","S1":"16845.0000","T1":"2781860.0000"},{"Metabolite":"DL-Ornithine","A1":"363784.0000","B1":"221733.0000","G1":"1593301.0000","L1":"540803.0000","S1":"389344.0000","T1":"324465.0000"},{"Metabolite":"DL-Phenylalanine","A1":"18191.0000","B1":"37542.0000","G1":"2290314.0000","L1":"22588.0000","S1":"20843.0000","T1":"29580.0000"},{"Metabolite":"D-Mannosamine","A1":"3764499.0000","B1":"494510.0000","G1":"5108092.0000","L1":"933489.0000","S1":"3200456.0000","T1":"869217.0000"},{"Metabolite":"D-myo-Inositol-1-phosphate","A1":"54688.0000","B1":"37765.0000","G1":"21075.0000","L1":"52037.0000","S1":"173226.0000","T1":"480562.0000"},{"Metabolite":"D-Psicose","A1":"58679132.0000","B1":"239981.0000","G1":"7217445.0000","L1":"10512935.0000","S1":"40379272.0000","T1":"331414.0000"},{"Metabolite":"D-Pyroglutamic acid","A1":"10810.0000","B1":"164190.0000","G1":"41750.0000","L1":"700636.0000","S1":"795968.0000","T1":"1368698.0000"},{"Metabolite":"D-Sorbitol","A1":"3557266.0000","B1":"130104.0000","G1":"10586.3700","L1":"367740.0000","S1":"497523.0000","T1":"97660.0000"},{"Metabolite":"D-(+)-Trehalose","A1":"523104832.0000","B1":"2435036.0000","G1":"70745952.0000","L1":"98836440.0000","S1":"362245696.0000","T1":"1489664.0000"},{"Metabolite":"D-Turanose","A1":"67910782.0000","B1":"287603.2600","G1":"8604144.2600","L1":"12341586.2600","S1":"46975344.0000","T1":"198893.2600"},{"Metabolite":"D-Xylulose","A1":"2585746.0000","B1":"5334.0000","G1":"265937.0000","L1":"520363.0000","S1":"1759787.0000","T1":"533.4500"},{"Metabolite":"Eleutheroside B","A1":"15642.0000","B1":"59095.0000","G1":"945.2400","L1":"1671095.0000","S1":"945.2400","T1":"22877.0000"},{"Metabolite":"Ergothioneine","A1":"762.6800","B1":"762.6800","G1":"1983233.0000","L1":"14494.0000","S1":"60823.0000","T1":"762.6800"},{"Metabolite":"Erlose","A1":"2091616.0000","B1":"2585966.9500","G1":"730425.1700","L1":"3356515.0000","S1":"966175.0000","T1":"182993.9500"},{"Metabolite":"Erythrodiol","A1":"6792.0000","B1":"1410214.0000","G1":"18591.0000","L1":"379791.0000","S1":"84279.0000","T1":"136221.0000"},{"Metabolite":"Ethanolamine","A1":"458297.0000","B1":"13345172.0000","G1":"981677.0000","L1":"10924907.0000","S1":"1443207.0000","T1":"4964417.0000"},{"Metabolite":"Ethyl 4-hydroxyquinoline-2-carboxylate","A1":"869365.0000","B1":"2231795.0000","G1":"888732.0000","L1":"1727110.0000","S1":"1356247.0000","T1":"1670336.0000"},{"Metabolite":"Farnesal","A1":"575.2900","B1":"575.2900","G1":"575.2900","L1":"575.2900","S1":"526680.0000","T1":"5753.0000"},{"Metabolite":"Feruloylputrescine","A1":"5787.6200","B1":"5787.6200","G1":"5787.6200","L1":"5787.6200","S1":"57876.0000","T1":"19378058.0000"},{"Metabolite":"Galactinol","A1":"70984.0000","B1":"2251908.0000","G1":"78504.0000","L1":"56767.0000","S1":"35033.0000","T1":"3503.3400"},{"Metabolite":"Galactosamine","A1":"22466672.0000","B1":"141208.0000","G1":"3791059.0000","L1":"4363502.0000","S1":"15565560.0000","T1":"246004.0000"},{"Metabolite":".gamma.-Aminobutyric acid","A1":"615504.0000","B1":"32773094.0000","G1":"1360100.0000","L1":"13962935.0000","S1":"6009671.0000","T1":"21480745.0000"},{"Metabolite":"gamma-Glutamylleucine","A1":"21220.0000","B1":"82794.0000","G1":"16502897.0000","L1":"104975.0000","S1":"91979.0000","T1":"68401.0000"},{"Metabolite":"gamma-Glutamylmethionine","A1":"1162.9100","B1":"27547.0000","G1":"8370043.0000","L1":"18071.0000","S1":"17580.0000","T1":"11629.0000"},{"Metabolite":".gamma.-Glutamyl-(S)-allyl-L-cysteine","A1":"350286.5700","B1":"48243.6000","G1":"416814640.0000","L1":"59267.5700","S1":"23791.5700","T1":"17717.5700"},{"Metabolite":"gamma-Glutamyltyrosine","A1":"908.9800","B1":"908.9800","G1":"1661283.0000","L1":"908.9800","S1":"908.9800","T1":"908.9800"},{"Metabolite":"Geranic acid","A1":"697058.0000","B1":"433030.0000","G1":"236502.0000","L1":"577052.0000","S1":"1899548.0000","T1":"467287.0000"},{"Metabolite":"Geraniol","A1":"2059.4000","B1":"765778.0000","G1":"2059.4000","L1":"2059.4000","S1":"2059.4000","T1":"2059.4000"},{"Metabolite":"Ginkgotoxin","A1":"44926.0000","B1":"127189.0000","G1":"662944.0000","L1":"34840.0000","S1":"51422.0000","T1":"33367.0000"},{"Metabolite":"Glabridin","A1":"2495426.0000","B1":"28100.7900","G1":"28100.7900","L1":"28100.7900","S1":"28100.7900","T1":"28100.7900"},{"Metabolite":"Gln-Ala","A1":"562046.0000","B1":"741119.0000","G1":"172050.0000","L1":"1898233.0000","S1":"1194355.0000","T1":"183181.0000"},{"Metabolite":"Gln-Arg","A1":"711.0200","B1":"73624.0000","G1":"7110.0000","L1":"301919.0000","S1":"82678.0000","T1":"711.0200"},{"Metabolite":"Gln-Gln","A1":"283401.0000","B1":"221305.0000","G1":"926109.0000","L1":"1227914.0000","S1":"272754.0000","T1":"62895.0000"},{"Metabolite":"Gln-Leu-Arg","A1":"508.2200","B1":"5482.0000","G1":"508.2200","L1":"44513.0000","S1":"11238.0000","T1":"5082.0000"},{"Metabolite":"Glucose 1-phosphate","A1":"242841.0000","B1":"220063.0000","G1":"22006.2100","L1":"481157.0000","S1":"419872.0000","T1":"1475063.0000"},{"Metabolite":"Glucose-6-phosphate","A1":"61633.0000","B1":"169699.0000","G1":"6163.2500","L1":"191869.0000","S1":"603370.0000","T1":"358755.0000"},{"Metabolite":"Glu-Gly-Arg","A1":"89648.0000","B1":"68717.0000","G1":"119420.0000","L1":"1106973.0000","S1":"975004.0000","T1":"5953.0000"},{"Metabolite":"Glu-Phe","A1":"158866.0000","B1":"1236.3900","G1":"236385952.0000","L1":"25300.0000","S1":"22110.0000","T1":"50588.0000"},{"Metabolite":"Glu-Phe-Arg","A1":"1089.3700","B1":"1089.3700","G1":"539980.0000","L1":"10894.0000","S1":"1089.3700","T1":"1089.3700"},{"Metabolite":"Glutamic acid","A1":"13519279.0000","B1":"87265512.0000","G1":"47561412.0000","L1":"9486118.0000","S1":"57793516.0000","T1":"567985216.0000"},{"Metabolite":"Glutamine","A1":"3731010.0000","B1":"39435368.0000","G1":"10829547.0000","L1":"622355776.0000","S1":"155999936.0000","T1":"355962368.0000"},{"Metabolite":"Glutathione (reduced)","A1":"56621.0000","B1":"142475.0000","G1":"125610.0000","L1":"80166.0000","S1":"11504397.0000","T1":"2901020.0000"},{"Metabolite":"Glu-Thr","A1":"1315.7300","B1":"1315.7300","G1":"1315.7300","L1":"13157.0000","S1":"1315.7300","T1":"1315.7300"},{"Metabolite":"Gly-Ala-Lys","A1":"530.8200","B1":"133896.0000","G1":"530.8200","L1":"487730.0000","S1":"67038.0000","T1":"5308.0000"},{"Metabolite":"Gly-Arg","A1":"277798.0000","B1":"566741.0000","G1":"88861.0000","L1":"1402281.0000","S1":"715611.0000","T1":"49598.0000"},{"Metabolite":"Glycine","A1":"109865.0000","B1":"267753.0000","G1":"353566.0000","L1":"259777.0000","S1":"415567.0000","T1":"261677.0000"},{"Metabolite":"Glycyl-L-4-hydroxyproline","A1":"77943.0000","B1":"45089.0000","G1":"88619.0000","L1":"385045.0000","S1":"506325.0000","T1":"640.0500"},{"Metabolite":"Gly-Glu-Lys","A1":"63462.8100","B1":"63462.8100","G1":"63462.8100","L1":"63462.8100","S1":"3736240.0000","T1":"63462.8100"},{"Metabolite":"Gly-Leu-Arg","A1":"74616.0000","B1":"72550.0000","G1":"7128.0000","L1":"504800.0000","S1":"125409.0000","T1":"25140.0000"},{"Metabolite":"Guanine","A1":"194377.0000","B1":"286566.0000","G1":"458943.0000","L1":"499491.0000","S1":"284639.0000","T1":"2039037.0000"},{"Metabolite":"Guanosine","A1":"529737.0000","B1":"751773.0000","G1":"1201555.0000","L1":"1338841.0000","S1":"695808.0000","T1":"5458125.0000"},{"Metabolite":"H-gamma-glutamyl-glutamine","A1":"1216.4800","B1":"72475.0000","G1":"12165.0000","L1":"800545.0000","S1":"308424.0000","T1":"513219.0000"},{"Metabolite":"His-Pro","A1":"85858.0000","B1":"53324.0000","G1":"169991.0000","L1":"170010.0000","S1":"160880.0000","T1":"257931.0000"},{"Metabolite":"Histamine","A1":"155791.0000","B1":"4748952.0000","G1":"422264.0000","L1":"318957.0000","S1":"257864.0000","T1":"18071952.0000"},{"Metabolite":"Histidine","A1":"1862747.0000","B1":"2903814.0000","G1":"23749390.0000","L1":"13934442.0000","S1":"4228798.0000","T1":"45962172.0000"},{"Metabolite":"His-Val","A1":"267283.0000","B1":"186149.0000","G1":"115613.0000","L1":"1188364.0000","S1":"436386.0000","T1":"11561.3200"},{"Metabolite":"Homoarginine","A1":"108358.0000","B1":"388953.0000","G1":"5588572.0000","L1":"184483.0000","S1":"64277.0000","T1":"298219.0000"},{"Metabolite":"Hypoxanthine","A1":"761733.0000","B1":"804737.0000","G1":"377108.0000","L1":"2179374.0000","S1":"1686923.0000","T1":"320865.0000"},{"Metabolite":"Iberin","A1":"2709772.0000","B1":"61328.0000","G1":"119993.0000","L1":"127752.0000","S1":"106867.0000","T1":"2523544.0000"},{"Metabolite":"Ile-Arg","A1":"186678.0000","B1":"247763.0000","G1":"326617.0000","L1":"1250695.0000","S1":"450654.0000","T1":"189804.0000"},{"Metabolite":"Ile-Ile","A1":"274359.0000","B1":"558253.0000","G1":"91206.0000","L1":"592713.0000","S1":"518514.0000","T1":"308688.0000"},{"Metabolite":"Indole-3-carboxaldehyde","A1":"8632.0000","B1":"349603.0000","G1":"863.1700","L1":"248710.0000","S1":"863.1700","T1":"863.1700"},{"Metabolite":"Indole-3-pyruvic acid","A1":"13187.0200","B1":"13187.0200","G1":"13187.0200","L1":"13187.0200","S1":"13187.0200","T1":"422262.0000"},{"Metabolite":"Inosine","A1":"419238.0000","B1":"303438.0000","G1":"212894.0000","L1":"952291.0000","S1":"784677.0000","T1":"178238.0000"},{"Metabolite":"Isoeugenyl acetate","A1":"425.1400","B1":"1938570.0000","G1":"4251.0000","L1":"8803.0000","S1":"9137.0000","T1":"5991.0000"},{"Metabolite":"Isoleucine","A1":"3463618.0000","B1":"3441300.0000","G1":"2534439.0000","L1":"45277080.0000","S1":"3562593.0000","T1":"9474548.0000"},{"Metabolite":"Isovaleryl-L-carnitine","A1":"32970.0000","B1":"29636.0000","G1":"457308.0000","L1":"62209.0000","S1":"62003.0000","T1":"24241.0000"},{"Metabolite":"Kaempferol-3-O-rutinoside","A1":"2498.5500","B1":"40836.0000","G1":"2498.5500","L1":"2498.5500","S1":"376151.0000","T1":"2498.5500"},{"Metabolite":"Kaempferol-7-O-neohesperidoside","A1":"1407.5200","B1":"18068.0000","G1":"1407.5200","L1":"1407.5200","S1":"304971.0000","T1":"1407.5200"},{"Metabolite":"Lactitol","A1":"37300920.0000","B1":"119301.0000","G1":"548934.0000","L1":"7497.2000","S1":"165827.0000","T1":"74972.0000"},{"Metabolite":"L-(.+/-.)-Alliin","A1":"264648.5500","B1":"220550.3500","G1":"159535976.0000","L1":"220550.3500","S1":"220550.3500","T1":"220550.3500"},{"Metabolite":"L-Asparagine","A1":"635266.0000","B1":"151402.0000","G1":"601366.0000","L1":"8398968.0000","S1":"10145857.0000","T1":"1404502.0000"},{"Metabolite":"L-Aspartic acid","A1":"2024530.0000","B1":"3235227.0000","G1":"381118.0000","L1":"2414745.0000","S1":"9588352.0000","T1":"13841631.0000"},{"Metabolite":"L-beta-Homothreonine","A1":"70401.0000","B1":"218319.0000","G1":"1637707.0000","L1":"34002.0000","S1":"292980.0000","T1":"235720.0000"},{"Metabolite":"L-Citrulline","A1":"205802.0000","B1":"3610159.0000","G1":"11423161.0000","L1":"2077559.0000","S1":"896217.0000","T1":"7749401.0000"},{"Metabolite":"Leu-Arg","A1":"286268.0000","B1":"632352.0000","G1":"605693.0000","L1":"1878237.0000","S1":"673159.0000","T1":"808803.0000"},{"Metabolite":"Leu-Phe","A1":"4879.0000","B1":"147756.0000","G1":"487.8900","L1":"152145.0000","S1":"71728.0000","T1":"220039.0000"},{"Metabolite":"L-.gamma.-Glutamyl-L-glutamic acid","A1":"11884.0000","B1":"22188.0000","G1":"11951.0000","L1":"2246.0000","S1":"43884.0000","T1":"511251.0000"},{"Metabolite":"L-Glutamic acid","A1":"17543.0000","B1":"326895.0000","G1":"91293.0000","L1":"31550.0000","S1":"302157.0000","T1":"1546099.0000"},{"Metabolite":"L-Glutamic acid_ dimethyl ester","A1":"22956.0000","B1":"72451.0000","G1":"69564.0000","L1":"136148.0000","S1":"291766.0000","T1":"403189.0000"},{"Metabolite":"L-Glutamine","A1":"1800049.0000","B1":"19334588.0000","G1":"5148214.0000","L1":"318692448.0000","S1":"77832968.0000","T1":"183459504.0000"},{"Metabolite":"L-Histidine","A1":"1501367.0000","B1":"390729.0000","G1":"1409941.0000","L1":"2032986.0000","S1":"1622315.0000","T1":"2589766.0000"},{"Metabolite":"L-Histidinol","A1":"10053.0000","B1":"611156.0000","G1":"105231.0000","L1":"82296.0000","S1":"29167.0000","T1":"25724.0000"},{"Metabolite":"Linalool oxide","A1":"7729.0000","B1":"68898.0000","G1":"5351.0000","L1":"27251.0000","S1":"895371.0000","T1":"9603.0000"},{"Metabolite":"Linamarin","A1":"79187.0000","B1":"195476.0000","G1":"3129.2900","L1":"298690.0000","S1":"205906.0000","T1":"727687.0000"},{"Metabolite":"L-Leucyl-L-leucine methyl ester","A1":"73432.0000","B1":"126731.0000","G1":"89183.0000","L1":"1474467.0000","S1":"146681.0000","T1":"799252.0000"},{"Metabolite":"L-Methionine","A1":"142142.0000","B1":"32900.0000","G1":"31352.0000","L1":"164250.0000","S1":"244721.0000","T1":"798245.0000"},{"Metabolite":"L-NG-Monomethylarginine","A1":"8198.6900","B1":"551594.0000","G1":"279081.0000","L1":"100250.0000","S1":"8198.6900","T1":"144105.0000"},{"Metabolite":"L-Saccharopine","A1":"3425.0000","B1":"55453.0000","G1":"61206.0000","L1":"215900.0000","S1":"126185.0000","T1":"34250.0000"},{"Metabolite":"L-Tryptophan","A1":"72168.0000","B1":"262226.0000","G1":"1024726.0000","L1":"1903487.0000","S1":"1867945.0000","T1":"2556766.0000"},{"Metabolite":"Luteolin","A1":"655.3400","B1":"6553.0000","G1":"655.3400","L1":"655.3400","S1":"276684.0000","T1":"655.3400"},{"Metabolite":"Luteolin 7-glucoside","A1":"6906.0000","B1":"690.5800","G1":"690.5800","L1":"690.5800","S1":"930500.0000","T1":"690.5800"},{"Metabolite":"Lys-Ala","A1":"164918.0000","B1":"156584.0000","G1":"8081.0000","L1":"776226.0000","S1":"279822.0000","T1":"69341.0000"},{"Metabolite":"Lys-Gln","A1":"27941.0000","B1":"107700.0000","G1":"2794.0800","L1":"354170.0000","S1":"133286.0000","T1":"2794.0800"},{"Metabolite":"Lys-Gly","A1":"47389.0000","B1":"104280.0000","G1":"9210.0000","L1":"242507.0000","S1":"138274.0000","T1":"17751.0000"},{"Metabolite":"Lysine","A1":"4577598.0000","B1":"2204082.0000","G1":"36467900.0000","L1":"15496573.0000","S1":"7852710.0000","T1":"15389387.0000"},{"Metabolite":"Lys-Leu","A1":"538170.0000","B1":"986009.0000","G1":"172735.0000","L1":"2989246.0000","S1":"1013209.0000","T1":"394310.0000"},{"Metabolite":"Lys-Val","A1":"334473.0000","B1":"416629.0000","G1":"560696.0000","L1":"2592331.0000","S1":"432197.0000","T1":"8104902.0000"},{"Metabolite":"Maltitol","A1":"3466724.0000","B1":"238985.0000","G1":"7415.0000","L1":"19343.0000","S1":"8440.0000","T1":"96347.0000"},{"Metabolite":"Maltotriose","A1":"91556.0000","B1":"2473291.1800","G1":"769931.0000","L1":"16812.1800","S1":"6426.4400","T1":"6426.4400"},{"Metabolite":"Melezitose","A1":"11919761.0000","B1":"11155.0000","G1":"27834992.0000","L1":"11246458.0000","S1":"1926773.0000","T1":"8264.0000"},{"Metabolite":"Melibiose","A1":"328146.0000","B1":"8549196.0000","G1":"34282.0000","L1":"261593.0000","S1":"187498.0000","T1":"103214.0000"},{"Metabolite":"Met-Arg","A1":"756.8000","B1":"17781.0000","G1":"756.8000","L1":"325469.0000","S1":"7568.0000","T1":"23110.0000"},{"Metabolite":"Methacholine","A1":"69427.0000","B1":"405009.0000","G1":"69555.0000","L1":"155296.0000","S1":"109984.0000","T1":"11742.0000"},{"Metabolite":"Methionine","A1":"964055.0000","B1":"205562.0000","G1":"290003.0000","L1":"1334566.0000","S1":"1442846.0000","T1":"4364102.0000"},{"Metabolite":"Methionine sulfoxide","A1":"133487.0000","B1":"321297.0000","G1":"226717.0000","L1":"844768.0000","S1":"346496.0000","T1":"243844.0000"},{"Metabolite":"Methioninesulfoxide A","A1":"845400.0000","B1":"658323.0000","G1":"180461.0000","L1":"1245242.0000","S1":"1548103.0000","T1":"180764.0000"},{"Metabolite":"Mevalonic acid","A1":"9836.0000","B1":"39477.0000","G1":"428.5200","L1":"428.5200","S1":"354142.0000","T1":"4285.0000"},{"Metabolite":"Monolinolenin (9c_12c_15c)","A1":"9373.3000","B1":"12200896.0000","G1":"22857.0000","L1":"2628098.0000","S1":"144560.3000","T1":"184257.3000"},{"Metabolite":"N-2-Hydroxycyclopentyladenosine","A1":"473.4300","B1":"473.4300","G1":"473.4300","L1":"65808.0000","S1":"473.4300","T1":"9830.0000"},{"Metabolite":"N2_N2-Dimethylguanosine","A1":"664.1200","B1":"6641.0000","G1":"22644.0000","L1":"22238.0000","S1":"664.1200","T1":"1170994.0000"},{"Metabolite":"N-3-Hydroxydecanoyl-L-homoserine lactone","A1":"207436.0000","B1":"773510.0000","G1":"764988.0000","L1":"1233253.0000","S1":"789968.0000","T1":"908446.0000"},{"Metabolite":"N6-Isopentenyladenosine","A1":"52059.0000","B1":"97437.0000","G1":"2505.3400","L1":"707825.0000","S1":"25450.0000","T1":"25053.0000"},{"Metabolite":"N8-Acetylspermidine","A1":"204201.0000","B1":"257817.0000","G1":"245343.0000","L1":"242513.0000","S1":"411773.0000","T1":"1116510.0000"},{"Metabolite":"N-Acetyl-D-galactosaminitol","A1":"1591962.0000","B1":"2552368.0000","G1":"122289.0000","L1":"872104.0000","S1":"2410974.0000","T1":"160924.0000"},{"Metabolite":"N-Acetyl-D-glucosamine","A1":"869618.0000","B1":"34765.0000","G1":"41204.0000","L1":"1112484.0000","S1":"828037.0000","T1":"4175082.0000"},{"Metabolite":"N-Acetyl-D-lactosamine","A1":"1283203.0000","B1":"27196.0000","G1":"158800.0000","L1":"226867.0000","S1":"1022282.0000","T1":"2719.6400"},{"Metabolite":"N-Acetyl-DL-valine","A1":"888137.0000","B1":"2286429.0000","G1":"1022950.0000","L1":"899788.0000","S1":"160257.0000","T1":"1333993.0000"},{"Metabolite":"N-Acetylhistidine","A1":"497659.0000","B1":"1548822.0000","G1":"164593.0000","L1":"464370.0000","S1":"2194836.0000","T1":"124805.0000"},{"Metabolite":"N-Acetylneuraminic acid","A1":"70077.0000","B1":"526496.0000","G1":"14377.0000","L1":"798664.0000","S1":"277330.0000","T1":"1267566.0000"},{"Metabolite":"N-acetyl putrescine","A1":"2192422.0000","B1":"1113216.0000","G1":"807444.0000","L1":"1445551.0000","S1":"1329901.0000","T1":"15766198.0000"},{"Metabolite":"N-.alpha.-Acetyl-L-arginine","A1":"376612.0000","B1":"13053127.0000","G1":"6338343.0000","L1":"1838564.0000","S1":"2109054.0000","T1":"1892178.0000"},{"Metabolite":"N-.alpha.-Acetyl-L-ornithine","A1":"147012.0000","B1":"471009.0000","G1":"868636.0000","L1":"369499.0000","S1":"248200.0000","T1":"41052.3300"},{"Metabolite":"N.alpha.-Methyl-L-lysine","A1":"469906.0000","B1":"1722489.0000","G1":"1113529.0000","L1":"674750.0000","S1":"593920.0000","T1":"269798.0000"},{"Metabolite":"N-.alpha.-(tert-Butoxycarbonyl)-L-histidine","A1":"275519.0000","B1":"284690.0000","G1":"2349543.0000","L1":"1891278.0000","S1":"433789.0000","T1":"4858819.0000"},{"Metabolite":"N-Carboxyethyl-.gamma.-aminobutyric acid","A1":"281592.0000","B1":"1240950.0000","G1":"1449213.0000","L1":"123254.0000","S1":"550508.0000","T1":"127433.0000"},{"Metabolite":"N-epsilon-Acetyllysine","A1":"130802.0000","B1":"588128.0000","G1":"3572862.0000","L1":"509260.0000","S1":"841522.0000","T1":"1888133.0000"},{"Metabolite":"N.epsilon.-Methyl-L-lysine","A1":"223936.0000","B1":"17275.0000","G1":"8004790.0000","L1":"500827.0000","S1":"108986.0000","T1":"259537.0000"},{"Metabolite":"Nicotinamide","A1":"1864949.0000","B1":"10303741.0000","G1":"8491940.0000","L1":"2282780.0000","S1":"3728093.0000","T1":"3445870.0000"},{"Metabolite":"Nicotinamide riboside","A1":"5302993.0000","B1":"729086.0000","G1":"4389747.0000","L1":"449628.0000","S1":"8722232.0000","T1":"247229.0000"},{"Metabolite":"Nicotinic acid","A1":"233254.0000","B1":"292649.0000","G1":"52233.0000","L1":"2628870.0000","S1":"784959.0000","T1":"231898.0000"},{"Metabolite":"Nipecotic acid","A1":"66543.0000","B1":"3577047.0000","G1":"22174.0000","L1":"55986.0000","S1":"16817.0000","T1":"33974.0000"},{"Metabolite":"N-Methylalanine","A1":"1903741.0000","B1":"130813480.0000","G1":"4873799.0000","L1":"58492444.0000","S1":"25483396.0000","T1":"100047272.0000"},{"Metabolite":"N-Methylanthranilic acid","A1":"28130.0000","B1":"21234.0000","G1":"165429.0000","L1":"17932.0000","S1":"4293940.0000","T1":"30216.0000"},{"Metabolite":"N-Methylglutamic acid","A1":"1620516.0000","B1":"193760.0000","G1":"1588348.0000","L1":"1426414.0000","S1":"2094549.0000","T1":"721975.0000"},{"Metabolite":"N-Methyl-L-proline","A1":"1414956.0000","B1":"697511.0000","G1":"11399425.0000","L1":"4837964.0000","S1":"2449660.0000","T1":"4713950.0000"},{"Metabolite":"N-Methyl-L-threonine","A1":"214107.0000","B1":"1051579.0000","G1":"256791.0000","L1":"1654179.0000","S1":"308386.0000","T1":"244531.0000"},{"Metabolite":"N-Methyllysine","A1":"44736.0000","B1":"89359.0000","G1":"95934.0000","L1":"201767.0000","S1":"239024.0000","T1":"767.6900"},{"Metabolite":"N-Methylphenylalanine","A1":"551.5200","B1":"6052.0000","G1":"298918.0000","L1":"6977.0000","S1":"7859.0000","T1":"6857.0000"},{"Metabolite":"N-Methylproline","A1":"166405.0000","B1":"314484.0000","G1":"975081.0000","L1":"251139.0000","S1":"464486.0000","T1":"258437.0000"},{"Metabolite":"N-Methyltryptamine","A1":"377038.1700","B1":"377038.1700","G1":"377038.1700","L1":"377038.1700","S1":"377038.1700","T1":"3770382.0000"},{"Metabolite":"N-Methylvaline","A1":"1666283.0000","B1":"3229002.0000","G1":"12008135.0000","L1":"28588244.0000","S1":"3481295.0000","T1":"8559890.0000"},{"Metabolite":"N_N-Dimethylarginine","A1":"1411965.0000","B1":"5188103.0000","G1":"18714788.0000","L1":"7845569.0000","S1":"2275401.0000","T1":"15568503.0000"},{"Metabolite":"N-omega-Acetylhistamine","A1":"176211.0000","B1":"86378.0000","G1":"39696.0000","L1":"175443.0000","S1":"57173.0000","T1":"78615.0000"},{"Metabolite":"N-Tetradecanoyl-DL-homoserine lactone","A1":"3375405.0000","B1":"14208081.0000","G1":"636443.0000","L1":"32847088.0000","S1":"20079976.0000","T1":"15486609.0000"},{"Metabolite":"Oleamide","A1":"3399724.0000","B1":"2550553.0000","G1":"2979370.0000","L1":"1030018.0000","S1":"3841051.0000","T1":"547997.0000"},{"Metabolite":"O-Methyl-L-threonine","A1":"244334.0000","B1":"254562.0000","G1":"1563319.0000","L1":"190060.0000","S1":"4388100.0000","T1":"67358.0000"},{"Metabolite":"Ornithine","A1":"346887.0000","B1":"207485.0000","G1":"1674765.0000","L1":"606829.0000","S1":"480819.0000","T1":"374366.0000"},{"Metabolite":"Palatinose","A1":"66462.0000","B1":"2739.1000","G1":"594345.0000","L1":"2739.1000","S1":"2739.1000","T1":"2739.1000"},{"Metabolite":"Pantothenic acid","A1":"2396932.0000","B1":"4023064.0000","G1":"3975954.0000","L1":"6651222.0000","S1":"3611898.0000","T1":"4571666.0000"},{"Metabolite":"p-Coumaric acid","A1":"140114.0000","B1":"655.3800","G1":"6554.0000","L1":"655.3800","S1":"12344897.0000","T1":"143416.0000"},{"Metabolite":"Pelargonidin","A1":"6798.0000","B1":"679.7900","G1":"679.7900","L1":"679.7900","S1":"4578255.0000","T1":"679.7900"},{"Metabolite":"Phe-Arg","A1":"41764.0000","B1":"134159.0000","G1":"142653.0000","L1":"389876.0000","S1":"81892.0000","T1":"187887.0000"},{"Metabolite":"Phe-Lys","A1":"569.7700","B1":"68426.0000","G1":"5698.0000","L1":"9692.0000","S1":"10460.0000","T1":"48440.0000"},{"Metabolite":"Phenylacetaldehyde","A1":"336.6600","B1":"26358.0000","G1":"26362.0000","L1":"336.6600","S1":"336.6600","T1":"301289.0000"},{"Metabolite":"Phenylacetaldehyde isomer a","A1":"415.6700","B1":"197949.0000","G1":"745283.0000","L1":"33645.0000","S1":"1837484.0000","T1":"379724.0000"},{"Metabolite":"Phenylacetaldehyde isomer b","A1":"16327.0000","B1":"7841766.0000","G1":"36957568.0000","L1":"96152.0000","S1":"89502.0000","T1":"18648580.0000"},{"Metabolite":"Phenylalanine","A1":"1152631.0000","B1":"2659394.0000","G1":"7627156.0000","L1":"15639706.0000","S1":"2514098.0000","T1":"29380470.0000"},{"Metabolite":"Phenylethanolamine B","A1":"114341.0000","B1":"2754144.0000","G1":"13264063.0000","L1":"129207.0000","S1":"115068.0000","T1":"6603020.0000"},{"Metabolite":"Pheophorbide a","A1":"4955.8400","B1":"5409880.0000","G1":"4955.8400","L1":"49558.0000","S1":"417906.0000","T1":"4955.8400"},{"Metabolite":"Phloretin","A1":"444954.0000","B1":"1008.0900","G1":"1008.0900","L1":"1008.0900","S1":"1008.0900","T1":"1008.0900"},{"Metabolite":"Phytosphingosine","A1":"720895.0000","B1":"406683.0000","G1":"303596.0000","L1":"170131.0000","S1":"288108.0000","T1":"2386504.0000"},{"Metabolite":"Pipecolic acid","A1":"31415.0000","B1":"22083280.0000","G1":"3808309.0000","L1":"625753.0000","S1":"2313144.0000","T1":"1115517.0000"},{"Metabolite":"Pro-Glu","A1":"3551.8700","B1":"237192.0000","G1":"3551.8700","L1":"2079902.0000","S1":"269969.0000","T1":"508021.0000"},{"Metabolite":"Pro-Leu-Lys","A1":"34715.0000","B1":"2650583.0000","G1":"424897.0000","L1":"1070624.0000","S1":"424889.0000","T1":"2397521.0000"},{"Metabolite":"Proline","A1":"1635795.0000","B1":"7307320.0000","G1":"75482824.0000","L1":"22822598.0000","S1":"7935434.0000","T1":"4345232.0000"},{"Metabolite":"Proline-hydroxyproline","A1":"6401.5700","B1":"6401.5700","G1":"6401.5700","L1":"3294416.0000","S1":"64016.0000","T1":"6401.5700"},{"Metabolite":"Propanoic acid_ 2-(1H-benzimidazol-2-ylthio)-_ 2-[(5-bromo-2-hydroxyphenyl)methylene]hydrazide","A1":"4022.1200","B1":"556431.0000","G1":"4022.1200","L1":"4022.1200","S1":"4022.1200","T1":"4022.1200"},{"Metabolite":"Propionylcarnitine","A1":"5936.0000","B1":"9672.0000","G1":"67157.0000","L1":"12850.0000","S1":"48100.0000","T1":"528.4500"},{"Metabolite":"Putrescine","A1":"1371898.0000","B1":"1121999.0000","G1":"696143.0000","L1":"6270151.0000","S1":"5616848.0000","T1":"7929368.0000"},{"Metabolite":"Pyridoxal phosphate","A1":"20251.0000","B1":"581163.0000","G1":"196327.0000","L1":"419613.0000","S1":"1301882.0000","T1":"39043.0000"},{"Metabolite":"Pyridoxamine","A1":"124622.0000","B1":"123299.0000","G1":"1249094.0000","L1":"393056.0000","S1":"139076.0000","T1":"686738.0000"},{"Metabolite":"Pyridoxine","A1":"684258.0000","B1":"79040.0000","G1":"140023.0000","L1":"131061.0000","S1":"167153.0000","T1":"525610.0000"},{"Metabolite":"PyroGlu-Pro","A1":"21671.0000","B1":"47553.0000","G1":"1097543.0000","L1":"234912.0000","S1":"273074.0000","T1":"529339.0000"},{"Metabolite":"Pyroglutamic acid","A1":"2316189.0000","B1":"15700197.0000","G1":"8784131.0000","L1":"20365190.0000","S1":"14090480.0000","T1":"111131704.0000"},{"Metabolite":"Quercetin-3_7_3^_4^-tetramethyl ether","A1":"34157.5000","B1":"921501.0000","G1":"34157.5000","L1":"34157.5000","S1":"34157.5000","T1":"34157.5000"},{"Metabolite":"(R)-Butyrylcarnitine","A1":"10255.0000","B1":"4739.0000","G1":"126794.0000","L1":"24030.0000","S1":"7692.0000","T1":"473.8600"},{"Metabolite":"Retinoic acid","A1":"13889.0000","B1":"121029.0000","G1":"7091.0000","L1":"31562.0000","S1":"74904.0000","T1":"134856.0000"},{"Metabolite":"roseoside","A1":"34646.0000","B1":"1016517.0000","G1":"4878.0000","L1":"6253.0000","S1":"122907.0000","T1":"76796.0000"},{"Metabolite":"S-Adenosyl-homocysteine","A1":"10993.0000","B1":"585280.0000","G1":"194100.0000","L1":"262162.0000","S1":"281408.0000","T1":"32028.0000"},{"Metabolite":"S-Adenosyl-L-methionine","A1":"118477.0000","B1":"959586.0000","G1":"132369.0000","L1":"1034918.0000","S1":"2625946.0000","T1":"4789372.0000"},{"Metabolite":"S-Allyl-L-Cysteine","A1":"19842.5800","B1":"372385.0000","G1":"7910310.0000","L1":"19842.5800","S1":"19842.5800","T1":"19842.5800"},{"Metabolite":"(S)-(-)-.alpha.-Methylbenzylamine","A1":"65009.0000","B1":"115398.0000","G1":"1762455.0000","L1":"131332.0000","S1":"227729.0000","T1":"5167032.0000"},{"Metabolite":"Sedanolide","A1":"33021.0000","B1":"73894.0000","G1":"40789.0000","L1":"12905723.0000","S1":"271364.0000","T1":"194964.0000"},{"Metabolite":"Ser-Arg","A1":"104363.0000","B1":"248976.0000","G1":"27046.0000","L1":"1257910.0000","S1":"252533.0000","T1":"81437.0000"},{"Metabolite":"Serine","A1":"1330200.0000","B1":"3258139.0000","G1":"4228398.0000","L1":"10280822.0000","S1":"10666770.0000","T1":"3239495.0000"},{"Metabolite":"Shikimic acid","A1":"89996.0000","B1":"33786.0000","G1":"6184176.0000","L1":"72890.0000","S1":"143578.0000","T1":"66868.0000"},{"Metabolite":"Sinapyl alcohol","A1":"1555.7900","B1":"134412.0000","G1":"1555.7900","L1":"3097334.0000","S1":"5188.0000","T1":"27983.0000"},{"Metabolite":"S-Methyl-L-cysteine","A1":"445.7400","B1":"445.7400","G1":"983852.0000","L1":"4457.0000","S1":"445.7400","T1":"445.7400"},{"Metabolite":"Stachyose","A1":"499671.0000","B1":"340643.0000","G1":"84778.0000","L1":"5564.0000","S1":"556.4200","T1":"556.4200"},{"Metabolite":"Stearidonic acid","A1":"10842.0000","B1":"2217662.0000","G1":"23206.0000","L1":"604188.0000","S1":"84559.0000","T1":"497351.0000"},{"Metabolite":"Sucrose","A1":"95632564.0000","B1":"16831041.0000","G1":"103153401.0000","L1":"114935351.0000","S1":"97202952.0000","T1":"16360415.0700"},{"Metabolite":"Swainsonine","A1":"3800.0000","B1":"282651.0000","G1":"948089.0000","L1":"12190.0000","S1":"107450.0000","T1":"62155.0000"},{"Metabolite":"Targinine","A1":"1151865.0000","B1":"3386735.0000","G1":"82186368.0000","L1":"11584470.0000","S1":"1402560.0000","T1":"15075698.0000"},{"Metabolite":"Tetradonium","A1":"279218.0000","B1":"1029255.0000","G1":"318141.0000","L1":"652440.0000","S1":"632758.0000","T1":"316177.0000"},{"Metabolite":"Thiamine","A1":"550523.0000","B1":"1398916.0000","G1":"9982411.0000","L1":"9348726.0000","S1":"885071.0000","T1":"2215089.0000"},{"Metabolite":"Thr-Ala","A1":"359250.0000","B1":"99084.0000","G1":"118870.0000","L1":"239701.0000","S1":"649398.0000","T1":"1458038.0000"},{"Metabolite":"Thr-Arg","A1":"140708.0000","B1":"268080.0000","G1":"101345.0000","L1":"1428666.0000","S1":"590452.0000","T1":"92091.0000"},{"Metabolite":"Threonine","A1":"657504.0000","B1":"3503770.0000","G1":"5495604.0000","L1":"23636504.0000","S1":"10182594.0000","T1":"5841830.0000"},{"Metabolite":"Thymol","A1":"99559.0000","B1":"66466.0000","G1":"53283.0000","L1":"1000722.0000","S1":"197880.0000","T1":"157317.0000"},{"Metabolite":"Tiliroside","A1":"52702.3200","B1":"52702.3200","G1":"52702.3200","L1":"52702.3200","S1":"527023.0000","T1":"52702.3200"},{"Metabolite":"trans-3_5-Dimethoxy-4-hydroxycinnamaldehyde","A1":"2919.5900","B1":"2919.5900","G1":"2919.5900","L1":"552406.0000","S1":"2919.5900","T1":"2919.5900"},{"Metabolite":"trans-4-Hydroxy-L-proline","A1":"301749.0000","B1":"121478.0000","G1":"332075.0000","L1":"56739.0000","S1":"651571.0000","T1":"43887.0000"},{"Metabolite":"trans-Ferulic acid","A1":"8486.0000","B1":"735491.0000","G1":"4380.0000","L1":"3439.0000","S1":"343.9300","T1":"343.9300"},{"Metabolite":"trans-Traumatic acid","A1":"1077.8200","B1":"758396.0000","G1":"1077.8200","L1":"10778.0000","S1":"1077.8200","T1":"28710.0000"},{"Metabolite":"Tributylamine","A1":"248480.0000","B1":"646422.0000","G1":"11688.0000","L1":"135135.0000","S1":"239894.0000","T1":"259647.0000"},{"Metabolite":"Triethanolamine","A1":"990174.0000","B1":"1135246.0000","G1":"1946439.0000","L1":"1010450.0000","S1":"10658226.0000","T1":"3358923.0000"},{"Metabolite":"Tri(ethylene glycol) monoethyl ether","A1":"551000.0000","B1":"683512.0000","G1":"368931.0000","L1":"632874.0000","S1":"521761.0000","T1":"416199.0000"},{"Metabolite":"Triethyl phosphate","A1":"2672858.0000","B1":"1886631.0000","G1":"358545.0000","L1":"2355982.0000","S1":"2076392.0000","T1":"1338626.0000"},{"Metabolite":"Tripropylamine","A1":"26369.0000","B1":"540316.0000","G1":"6932.0000","L1":"21151.0000","S1":"51114.0000","T1":"35063.0000"},{"Metabolite":"Tris(hydroxymethyl)aminomethane","A1":"829336.0000","B1":"682082.0000","G1":"284691.0000","L1":"212669.0000","S1":"1202204.0000","T1":"266514.0000"},{"Metabolite":"Tryptamine","A1":"816.6500","B1":"12985.0000","G1":"816.6500","L1":"816.6500","S1":"8166.0000","T1":"7286339.0000"},{"Metabolite":"Tryptophan","A1":"178461.0000","B1":"596007.0000","G1":"2446191.0000","L1":"4475166.0000","S1":"4323285.0000","T1":"5683144.0000"},{"Metabolite":"Tyr-Lys","A1":"9008.0000","B1":"6609.0000","G1":"660.9100","L1":"21131.0000","S1":"660.9100","T1":"660.9100"},{"Metabolite":"Tyrosine","A1":"16404.0000","B1":"306562.0000","G1":"655711.0000","L1":"954537.0000","S1":"272464.0000","T1":"360938.0000"},{"Metabolite":"Uracil","A1":"290244.0000","B1":"305566.0000","G1":"198296.0000","L1":"992741.0000","S1":"190971.0000","T1":"1143511.0000"},{"Metabolite":"Uridine","A1":"239795.0000","B1":"1988.4400","G1":"167174.0000","L1":"526255.0000","S1":"101013.0000","T1":"1666398.0000"},{"Metabolite":"Uridine 5^-monophosphate","A1":"1856.6600","B1":"1048922.0000","G1":"14286.5100","L1":"175494.0000","S1":"244660.0000","T1":"1381996.0000"},{"Metabolite":"Val-Arg","A1":"232813.0000","B1":"513184.0000","G1":"722762.0000","L1":"1006996.0000","S1":"512627.0000","T1":"312277.0000"},{"Metabolite":"Valerenic acid","A1":"9035.0000","B1":"32633.0000","G1":"5226.0000","L1":"442.7900","S1":"725247.0000","T1":"4428.0000"},{"Metabolite":"Val-Gln","A1":"20462.0000","B1":"131684.0000","G1":"38745.0000","L1":"838972.0000","S1":"344311.0000","T1":"2046.2100"},{"Metabolite":"Val-Lys","A1":"38469.0000","B1":"1802190.0000","G1":"531573.0000","L1":"190636.0000","S1":"786600.0000","T1":"8104902.0000"}],

"Metabolites":[{"Metabolite":"10-Hydroxy-2-decenoic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.2","ri_type":"","moverz_quant":"133.1008_151.1114","":""},{"Metabolite":"1_15N2-L-Arginine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6451924","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1,3,4,6-Tetra-O-acetyl-.beta.-D-mannopyranose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"109.0282","":""},{"Metabolite":"1,3-Benzenediol, 5-methyl-4-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.7","ri_type":"","moverz_quant":"135.1165","":""},{"Metabolite":"1,4-Cyclohexanedione","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"113.0595","":""},{"Metabolite":"1,5-Pentanediamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.1","ri_type":"","moverz_quant":"86.0962","":""},{"Metabolite":"1,6-Anhydro-2,3-O-isopropylidene-.beta.-D-mannopyranose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.3","ri_type":"","moverz_quant":"127.0387","":""},{"Metabolite":"1-.beta.-D-Arabinofuranosyluracil 5'-monophosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.1","ri_type":"","moverz_quant":"369.0064","":""},{"Metabolite":"1_CUDA iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"20312430","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D10-Isoleucine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"20378674","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D10-Leucine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"43160664","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D3-1-Methylnicotinamide iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"268225904","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D3-AC(2:0) iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"61678492","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D3-Aspartic Acid iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"3321852","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D3-Creatine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"77982160","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D3-Creatinine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"347542240","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D3-DL-Alanine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"19306786","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D3-DL-Glutamic acid iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"18052860","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D3-Histamine, N-methyl- iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4129051","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D3-L-Carnitine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"139970048","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D3-Serine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6141169","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D4-Cystine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1741027","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D5-Glutamic acid iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"15113738","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D5-L-Glutamine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"14507217","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D5-Threonine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4337174","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D7-Arginine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"17902142","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D7-Proline iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"53751872","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D8-Phenylalanine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"12247054","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D8-Tryptophan iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"3849507","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D9-Betaine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"348940640","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D9-Butyrobetaine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"250531232","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D9-Choline iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"106542840","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D9-Crotonobetaine iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"356256800","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1_D9-TMAO iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"80877928","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"1-Hexadecylamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.7","ri_type":"","moverz_quant":"242.2838","":""},{"Metabolite":"1H-Imidazole, 1-[2-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)propoxy]ethyl]-","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"367.2085","":""},{"Metabolite":"1-Methylnicotinamide","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.1","ri_type":"","moverz_quant":"137.0708","":""},{"Metabolite":"1-Methyltryptophan","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.3","ri_type":"","moverz_quant":"219.1121","":""},{"Metabolite":"1-naphthylamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.9","ri_type":"","moverz_quant":"144.0804","":""},{"Metabolite":"1_Val-Tyr-Val iSTD","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1908740","ri_type":"","moverz_quant":"ESI (+)","":""},{"Metabolite":"2,4-Thiazolidinedione, 5-[[4-[2-(2-thienyl)ethoxy]phenyl]methylene]-","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"111.0261","":""},{"Metabolite":"2,6-Diaminopimelic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.8","ri_type":"","moverz_quant":"128.0704","":""},{"Metabolite":"2,6-Di-tert-butyl-4-hydroxymethylphenol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.6","ri_type":"","moverz_quant":"219.1738","":""},{"Metabolite":"2-alpha-Mannobiose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.5","ri_type":"","moverz_quant":"343.1228","":""},{"Metabolite":"2-Amino-1-phenylethanol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.8","ri_type":"","moverz_quant":"120.0806","":""},{"Metabolite":"2-Amino-2-methyl-1,3-propanediol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6","ri_type":"","moverz_quant":"106.086","":""},{"Metabolite":"2-Aminoadipic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.7","ri_type":"","moverz_quant":"144.0652_162.0757","":""},{"Metabolite":"2'-Deoxyadenosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"3.8","ri_type":"","moverz_quant":"252.1087","":""},{"Metabolite":"2'-Deoxycytidine 5'-monophosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.2","ri_type":"","moverz_quant":"330.0417","":""},{"Metabolite":"2'-Deoxyguanosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.4","ri_type":"","moverz_quant":"268.1035","":""},{"Metabolite":"2-Hydroxy-5-nitrobenzyl alcohol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"170.042","":""},{"Metabolite":"2'-O-Methyladenosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.4","ri_type":"","moverz_quant":"282.1194","":""},{"Metabolite":"2'-O-Methylguanosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.7","ri_type":"","moverz_quant":"298.1142","":""},{"Metabolite":"(2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.8","ri_type":"","moverz_quant":"192.0684","":""},{"Metabolite":"2-tert-Butyl-p-quinone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4","ri_type":"","moverz_quant":"137.0958","":""},{"Metabolite":"3,4-Dihydroxyphenylacetic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"169.0492","":""},{"Metabolite":"3,4-Dihydroxyphenylalanine (DOPA)","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.2","ri_type":"","moverz_quant":"198.0733","":""},{"Metabolite":"(3,4-Dihydroxyphenyl)ethanol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.2","ri_type":"","moverz_quant":"119.0489","":""},{"Metabolite":"3,4-Dimethylmethcathinone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5","ri_type":"","moverz_quant":"174.1292","":""},{"Metabolite":"3,7,4'-Trihydroxyflavone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.4","ri_type":"","moverz_quant":"271.0593","":""},{"Metabolite":"3,7-Dihydroxy-3',4'-dimethoxyflavone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"315.0856","":""},{"Metabolite":"3.alpha.,4.beta.,3.alpha.-Galactotetraose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.7","ri_type":"","moverz_quant":"689.2095","":""},{"Metabolite":"3.alpha.,4.beta.-Galactotriose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"527.1573","":""},{"Metabolite":"3.alpha.-Galactobiose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"347.094","":""},{"Metabolite":"3.alpha.-Mannobiose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"343.1227","":""},{"Metabolite":"(3-Carboxypropyl)trimethylammonium","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.7","ri_type":"","moverz_quant":"146.1172","":""},{"Metabolite":"3-Cyclopentene-1-octanoic acid, 2-(3-hydroxy-1-penten-1-yl)-5-oxo-","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"291.1948","":""},{"Metabolite":"3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.1","ri_type":"","moverz_quant":"313.05","":""},{"Metabolite":"3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel-","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"237.1478","":""},{"Metabolite":"3'-Galactosyllactose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"509.1465","":""},{"Metabolite":"3-Hydroxy-4-methoxybenzyl alcohol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"137.0594","":""},{"Metabolite":"3-Hydroxy-6,3',4'-trimethoxyflavone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"329.1013","":""},{"Metabolite":"3-Methoxytyramine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.3","ri_type":"","moverz_quant":"151.075","":""},{"Metabolite":"3-Methylcytidine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7","ri_type":"","moverz_quant":"258.1081","":""},{"Metabolite":"3-Methylhippuric acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"119.0529","":""},{"Metabolite":"3-Methylhistidine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.4","ri_type":"","moverz_quant":"170.092","":""},{"Metabolite":"3-Methylthiopropylamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5","ri_type":"","moverz_quant":"106.0682","":""},{"Metabolite":"3-Pyridinecarboxaldehyde","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.7","ri_type":"","moverz_quant":"108.0441","":""},{"Metabolite":"3-Pyridinemethanol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"110.0598","":""},{"Metabolite":"(3R)-4,4-Dimethyl-2-oxotetrahydro-3-furanyl beta-D-glucopyranoside","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4","ri_type":"","moverz_quant":"315.1045","":""},{"Metabolite":"4-(2-Hydroxyethyl)piperazine-1-ethanesulfonic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.9","ri_type":"","moverz_quant":"239.1055","":""},{"Metabolite":"4,4-Dimethyl-L-glutamic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.2","ri_type":"","moverz_quant":"176.0914","":""},{"Metabolite":"4',7-Dimethoxy-3-hydroxyflavone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"299.0908","":""},{"Metabolite":"4-Acetamidobutyric acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.1","ri_type":"","moverz_quant":"146.0809","":""},{"Metabolite":"4-Aminobenzoic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.3","ri_type":"","moverz_quant":"138.0546","":""},{"Metabolite":"4-Guanidinobutyric acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.6","ri_type":"","moverz_quant":"146.0921","":""},{"Metabolite":"4-Hydroxy-3-methoxyamphetamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.1","ri_type":"","moverz_quant":"182.1172","":""},{"Metabolite":"4-Hydroxyhippuric acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.2","ri_type":"","moverz_quant":"196.0601","":""},{"Metabolite":"4-(Hydroxymethyl)-1-isopropyl-3-cyclohexen-1-yl beta-D-glucopyranoside","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2","ri_type":"","moverz_quant":"355.1721","":""},{"Metabolite":"4-Ketopimelic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.4","ri_type":"","moverz_quant":"129.0543","":""},{"Metabolite":"4'-Methoxypelargonidin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"285.0752","":""},{"Metabolite":"4-Methyl-5-thiazoleethanol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.3","ri_type":"","moverz_quant":"144.0475","":""},{"Metabolite":"4-Methylbenzyl alcohol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.3","ri_type":"","moverz_quant":"105.0696","":""},{"Metabolite":"4-Pyridoxic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.3","ri_type":"","moverz_quant":"184.0635","":""},{"Metabolite":"5,3'-Dihydroxy-6,7,4'-trimethoxyflavone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"345.0963","":""},{"Metabolite":"5-Amino-1-methyl-2-piperidinone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.2","ri_type":"","moverz_quant":"112.0755","":""},{"Metabolite":"5-Androstene-3.beta.,17.beta.-diol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"159.1165","":""},{"Metabolite":"5-Hydroxy-2-methylpyridine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.3","ri_type":"","moverz_quant":"110.0598","":""},{"Metabolite":"5-Methylcytidine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.4","ri_type":"","moverz_quant":"258.1082","":""},{"Metabolite":"5-Methylcytosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.9","ri_type":"","moverz_quant":"126.0659","":""},{"Metabolite":"5'-S-Methyl-5'-thioadenosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.5","ri_type":"","moverz_quant":"298.0963","":""},{"Metabolite":"6-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.7","ri_type":"","moverz_quant":"493.0969","":""},{"Metabolite":"6-Methyladenosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.3","ri_type":"","moverz_quant":"282.1192","":""},{"Metabolite":"6''-O-Malonylgenistin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.4","ri_type":"","moverz_quant":"519.1121","":""},{"Metabolite":"7-Methylguanosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.4","ri_type":"","moverz_quant":"298.1141","":""},{"Metabolite":"9(10)-Epoxy-12Z-octadecenoic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"297.2418","":""},{"Metabolite":"9-Oxo-10E,12Z,15Z-octadecatrienoic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"275.2","":""},{"Metabolite":"9-Oxo-10E,12Z-octadecadienoic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"277.2157","":""},{"Metabolite":"Abietic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"123.1166_303.2317","":""},{"Metabolite":"(+)-Abscisic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.2","ri_type":"","moverz_quant":"247.1324","":""},{"Metabolite":"Abscisic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.2","ri_type":"","moverz_quant":"265.143","":""},{"Metabolite":"Acetylcarnitine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.1","ri_type":"","moverz_quant":"204.1227","":""},{"Metabolite":"Acetyl coenzyme A","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"303.1369","":""},{"Metabolite":"Acetyleugenol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.9","ri_type":"","moverz_quant":"165.0907","":""},{"Metabolite":"Adenine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.5","ri_type":"","moverz_quant":"136.0615","":""},{"Metabolite":"Adenosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.8","ri_type":"","moverz_quant":"268.1035","":""},{"Metabolite":"Adenosine 5'-monophosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9","ri_type":"","moverz_quant":"348.0698_370.0515","":""},{"Metabolite":"Agmatine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.9","ri_type":"","moverz_quant":"131.1289","":""},{"Metabolite":"Ala-Ala","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.3","ri_type":"","moverz_quant":"161.0917","":""},{"Metabolite":"Ala-Ile","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.6","ri_type":"","moverz_quant":"203.1387","":""},{"Metabolite":"Ala-Lys","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.7","ri_type":"","moverz_quant":"218.1493","":""},{"Metabolite":"Alanine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8","ri_type":"","moverz_quant":"90.0548","":""},{"Metabolite":"Ala-Val-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"345.2238","":""},{"Metabolite":"Aleuritic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"269.2107_305.2318","":""},{"Metabolite":"Allantoic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.6","ri_type":"","moverz_quant":"177.0614","":""},{"Metabolite":"Allicin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"163.0242","":""},{"Metabolite":".alpha.,.beta.-Trehalose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"360.1493","":""},{"Metabolite":".alpha.-Guanidinoglutaric acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"102.0548","":""},{"Metabolite":".alpha.-Ionone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.1","ri_type":"","moverz_quant":"175.1477","":""},{"Metabolite":"Apigenin 7-O-neohesperidoside","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7","ri_type":"","moverz_quant":"579.1697","":""},{"Metabolite":"Apiin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.8","ri_type":"","moverz_quant":"433.1119","":""},{"Metabolite":"Arg-Ala","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.6","ri_type":"","moverz_quant":"246.1556","":""},{"Metabolite":"Arg-Gln","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.8","ri_type":"","moverz_quant":"303.1771","":""},{"Metabolite":"Arg-Gly","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.8","ri_type":"","moverz_quant":"232.1399","":""},{"Metabolite":"Arginine; [M+H]+; HCD (NCE 20-30-40%)","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.9","ri_type":"","moverz_quant":"175.1186","":""},{"Metabolite":"Argininosuccinic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.9","ri_type":"","moverz_quant":"291.1295","":""},{"Metabolite":"Arg-Leu","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.6","ri_type":"","moverz_quant":"288.2025","":""},{"Metabolite":"Arg-Pro","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.5","ri_type":"","moverz_quant":"272.1712","":""},{"Metabolite":"Arg-Tyr","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"338.1818","":""},{"Metabolite":"Arg-Val","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9","ri_type":"","moverz_quant":"274.1867","":""},{"Metabolite":"Asn-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.8","ri_type":"","moverz_quant":"289.1613","":""},{"Metabolite":"Asparagine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"133.0604","":""},{"Metabolite":"Astragalin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.5","ri_type":"","moverz_quant":"449.107","":""},{"Metabolite":"Benzyl alcohol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.3","ri_type":"","moverz_quant":"91.0541","":""},{"Metabolite":".beta.-Carboline-1-propionic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.1","ri_type":"","moverz_quant":"263.0734","":""},{"Metabolite":".beta.-Gentiobiose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.1","ri_type":"","moverz_quant":"325.1122_360.1494","":""},{"Metabolite":"Betaine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.1","ri_type":"","moverz_quant":"118.0859","":""},{"Metabolite":".beta.-Sitosterol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.2","ri_type":"","moverz_quant":"397.382","":""},{"Metabolite":"Bisabolol oxide A","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"221.1895","":""},{"Metabolite":"Caffeic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.7","ri_type":"","moverz_quant":"181.0492","":""},{"Metabolite":"Caffeine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.2","ri_type":"","moverz_quant":"195.0874","":""},{"Metabolite":"(+)-Camphor","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.2","ri_type":"","moverz_quant":"153.127","":""},{"Metabolite":"Carnitine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.7","ri_type":"","moverz_quant":"162.1121","":""},{"Metabolite":"Carnosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.6","ri_type":"","moverz_quant":"227.1132","":""},{"Metabolite":"(-)-Carveol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"135.1165","":""},{"Metabolite":"(-)-Caryophyllene oxide","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"0.9","ri_type":"","moverz_quant":"203.1791","":""},{"Metabolite":"Castanospermine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.6","ri_type":"","moverz_quant":"190.1071","":""},{"Metabolite":"(+)-Catechin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.1","ri_type":"","moverz_quant":"291.0859_123.0471","":""},{"Metabolite":"Choline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5","ri_type":"","moverz_quant":"104.1066","":""},{"Metabolite":"Chromone-3-carboxylic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.6","ri_type":"","moverz_quant":"191.0398","":""},{"Metabolite":"Cinnamaldehyde","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"133.0605","":""},{"Metabolite":"cis-Jasmone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"0.9","ri_type":"","moverz_quant":"165.1271","":""},{"Metabolite":"Citric acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"10","ri_type":"","moverz_quant":"210.0605","":""},{"Metabolite":"Citrulline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"176.1026","":""},{"Metabolite":"Coniferyl alcohol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2","ri_type":"","moverz_quant":"131.0489","":""},{"Metabolite":"Creatine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8","ri_type":"","moverz_quant":"132.0765","":""},{"Metabolite":"Creatinine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.7","ri_type":"","moverz_quant":"114.0659","":""},{"Metabolite":"Curcumol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"219.1739","":""},{"Metabolite":"Cystine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.9","ri_type":"","moverz_quant":"241.0307","":""},{"Metabolite":"Cytidine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.8","ri_type":"","moverz_quant":"244.0923","":""},{"Metabolite":"Cytidine-5'-monophosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.5","ri_type":"","moverz_quant":"324.0583","":""},{"Metabolite":"Cytosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.8","ri_type":"","moverz_quant":"112.0503","":""},{"Metabolite":"D-2-Aminoadipic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"162.0757","":""},{"Metabolite":".delta.-Octalactone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"143.1064","":""},{"Metabolite":"D-erythro-Imidazolylglycerol phosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.5","ri_type":"","moverz_quant":"111.055","":""},{"Metabolite":"D-Fructose 6-phosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.5","ri_type":"","moverz_quant":"283.0186","":""},{"Metabolite":"D-Glucosamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"162.0757","":""},{"Metabolite":"D-Glucose 6-phosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.7","ri_type":"","moverz_quant":"243.026_283.0184","":""},{"Metabolite":"Dicyclohexylamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.4","ri_type":"","moverz_quant":"182.1899","":""},{"Metabolite":"Digalacturonic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"10.2","ri_type":"","moverz_quant":"388.1078_393.0633","":""},{"Metabolite":"(+)-Dihydrocervone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"3.5","ri_type":"","moverz_quant":"153.127","":""},{"Metabolite":"Dikegulac acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.3","ri_type":"","moverz_quant":"275.1097","":""},{"Metabolite":"Dimethyl succinate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.4","ri_type":"","moverz_quant":"115.0388","":""},{"Metabolite":"DL-2-Methylglutamic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8","ri_type":"","moverz_quant":"144.0652","":""},{"Metabolite":"DL-.alpha.-Aminopimelic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8","ri_type":"","moverz_quant":"176.0913","":""},{"Metabolite":"DL-Arginine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.5","ri_type":"","moverz_quant":"130.0972","":""},{"Metabolite":"DL-.beta.-Homoleucine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.7","ri_type":"","moverz_quant":"146.1172","":""},{"Metabolite":"DL-Lanthionine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.7","ri_type":"","moverz_quant":"120.0111","":""},{"Metabolite":"DL-Octopamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.2","ri_type":"","moverz_quant":"136.0755","":""},{"Metabolite":"DL-Ornithine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.6","ri_type":"","moverz_quant":"116.0704","":""},{"Metabolite":"DL-Phenylalanine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.1","ri_type":"","moverz_quant":"166.0859","":""},{"Metabolite":"D-Mannosamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.6","ri_type":"","moverz_quant":"162.0757","":""},{"Metabolite":"D-myo-Inositol-1-phosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"10.1","ri_type":"","moverz_quant":"261.0367","":""},{"Metabolite":"D-Psicose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"127.0387","":""},{"Metabolite":"D-Pyroglutamic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"130.0496","":""},{"Metabolite":"D-Sorbitol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.7","ri_type":"","moverz_quant":"183.086","":""},{"Metabolite":"D-(+)-Trehalose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"360.1491","":""},{"Metabolite":"D-Turanose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.2","ri_type":"","moverz_quant":"325.1121_360.1491","":""},{"Metabolite":"D-Xylulose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"115.0387","":""},{"Metabolite":"Eleutheroside B","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.1","ri_type":"","moverz_quant":"395.1304","":""},{"Metabolite":"Ergothioneine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.8","ri_type":"","moverz_quant":"230.0954","":""},{"Metabolite":"Erlose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.4","ri_type":"","moverz_quant":"543.131_527.1572","":""},{"Metabolite":"Erythrodiol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"413.3771","":""},{"Metabolite":"Ethanolamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.2","ri_type":"","moverz_quant":"62.0601","":""},{"Metabolite":"Ethyl 4-hydroxyquinoline-2-carboxylate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.9","ri_type":"","moverz_quant":"218.0761","":""},{"Metabolite":"Farnesal","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.7","ri_type":"","moverz_quant":"203.1789","":""},{"Metabolite":"Feruloylputrescine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.9","ri_type":"","moverz_quant":"265.1543","":""},{"Metabolite":"Galactinol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.7","ri_type":"","moverz_quant":"343.1229","":""},{"Metabolite":"Galactosamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"180.0862","":""},{"Metabolite":".gamma.-Aminobutyric acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.8","ri_type":"","moverz_quant":"86.0599_104.0704","":""},{"Metabolite":"gamma-Glutamylleucine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8","ri_type":"","moverz_quant":"261.1441","":""},{"Metabolite":"gamma-Glutamylmethionine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"279.1004","":""},{"Metabolite":".gamma.-Glutamyl-(S)-allyl-L-cysteine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.2","ri_type":"","moverz_quant":"162.058_291.1002","":""},{"Metabolite":"gamma-Glutamyltyrosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.6","ri_type":"","moverz_quant":"311.1231","":""},{"Metabolite":"Geranic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"169.122","":""},{"Metabolite":"Geraniol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.1","ri_type":"","moverz_quant":"137.1322","":""},{"Metabolite":"Ginkgotoxin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.9","ri_type":"","moverz_quant":"152.0703","":""},{"Metabolite":"Glabridin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.7","ri_type":"","moverz_quant":"189.094","":""},{"Metabolite":"Gln-Ala","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"218.1131","":""},{"Metabolite":"Gln-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.8","ri_type":"","moverz_quant":"303.177","":""},{"Metabolite":"Gln-Gln","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"275.1344","":""},{"Metabolite":"Gln-Leu-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.1","ri_type":"","moverz_quant":"416.2607","":""},{"Metabolite":"Glucose 1-phosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.7","ri_type":"","moverz_quant":"283.0184_261.0367","":""},{"Metabolite":"Glucose-6-phosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.8","ri_type":"","moverz_quant":"261.0367","":""},{"Metabolite":"Glu-Gly-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"361.1821","":""},{"Metabolite":"Glu-Phe","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.1","ri_type":"","moverz_quant":"295.1282","":""},{"Metabolite":"Glu-Phe-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"451.2289","":""},{"Metabolite":"Glutamic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"148.06","":""},{"Metabolite":"Glutamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.5","ri_type":"","moverz_quant":"147.076","":""},{"Metabolite":"Glutathione (reduced)","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9","ri_type":"","moverz_quant":"308.0905","":""},{"Metabolite":"Glu-Thr","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.3","ri_type":"","moverz_quant":"249.1076","":""},{"Metabolite":"Gly-Ala-Lys","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.7","ri_type":"","moverz_quant":"275.1707","":""},{"Metabolite":"Gly-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.7","ri_type":"","moverz_quant":"232.14","":""},{"Metabolite":"Glycine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.3","ri_type":"","moverz_quant":"76.0392","":""},{"Metabolite":"Glycyl-L-4-hydroxyproline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"189.0866","":""},{"Metabolite":"Gly-Glu-Lys","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"333.1762","":""},{"Metabolite":"Gly-Leu-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.9","ri_type":"","moverz_quant":"345.2238","":""},{"Metabolite":"Guanine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.1","ri_type":"","moverz_quant":"152.0564","":""},{"Metabolite":"Guanosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.1","ri_type":"","moverz_quant":"284.0984","":""},{"Metabolite":"H-gamma-glutamyl-glutamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.6","ri_type":"","moverz_quant":"276.1186","":""},{"Metabolite":"His-Pro","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.8","ri_type":"","moverz_quant":"235.1185","":""},{"Metabolite":"Histamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.1","ri_type":"","moverz_quant":"112.0867","":""},{"Metabolite":"Histidine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.4","ri_type":"","moverz_quant":"156.0764","":""},{"Metabolite":"His-Val","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.6","ri_type":"","moverz_quant":"255.1447","":""},{"Metabolite":"Homoarginine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.3","ri_type":"","moverz_quant":"189.1342","":""},{"Metabolite":"Hypoxanthine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.2","ri_type":"","moverz_quant":"137.0455","":""},{"Metabolite":"Iberin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.2","ri_type":"","moverz_quant":"105.0367","":""},{"Metabolite":"Ile-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.9","ri_type":"","moverz_quant":"288.2025","":""},{"Metabolite":"Ile-Ile","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6","ri_type":"","moverz_quant":"245.1855","":""},{"Metabolite":"Indole-3-carboxaldehyde","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"146.0597","":""},{"Metabolite":"Indole-3-pyruvic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.8","ri_type":"","moverz_quant":"204.0651","":""},{"Metabolite":"Inosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.2","ri_type":"","moverz_quant":"291.0695","":""},{"Metabolite":"Isoeugenyl acetate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"0.9","ri_type":"","moverz_quant":"189.0906","":""},{"Metabolite":"Isoleucine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.1","ri_type":"","moverz_quant":"132.1016","":""},{"Metabolite":"Isovaleryl-L-carnitine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.3","ri_type":"","moverz_quant":"246.1695","":""},{"Metabolite":"Kaempferol-3-O-rutinoside","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.1","ri_type":"","moverz_quant":"595.1646","":""},{"Metabolite":"Kaempferol-7-O-neohesperidoside","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.1","ri_type":"","moverz_quant":"617.1459","":""},{"Metabolite":"Lactitol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.6","ri_type":"","moverz_quant":"367.1201","":""},{"Metabolite":"L-(.+/-.)-Alliin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.7","ri_type":"","moverz_quant":"178.0528_200.0348","":""},{"Metabolite":"L-Asparagine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"116.034","":""},{"Metabolite":"L-Aspartic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"134.0445_116.034","":""},{"Metabolite":"L-beta-Homothreonine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.8","ri_type":"","moverz_quant":"134.0809","":""},{"Metabolite":"L-Citrulline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"176.1027_159.0761","":""},{"Metabolite":"Leu-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"288.2024","":""},{"Metabolite":"Leu-Phe","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.2","ri_type":"","moverz_quant":"279.1698","":""},{"Metabolite":"L-.gamma.-Glutamyl-L-glutamic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.4","ri_type":"","moverz_quant":"277.1027","":""},{"Metabolite":"L-Glutamic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"148.0601","":""},{"Metabolite":"L-Glutamic acid, dimethyl ester","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.9","ri_type":"","moverz_quant":"144.0652","":""},{"Metabolite":"L-Glutamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.5","ri_type":"","moverz_quant":"130.0496","":""},{"Metabolite":"L-Histidine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.3","ri_type":"","moverz_quant":"156.0765","":""},{"Metabolite":"L-Histidinol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.3","ri_type":"","moverz_quant":"142.0972","":""},{"Metabolite":"Linalool oxide","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2","ri_type":"","moverz_quant":"153.1271","":""},{"Metabolite":"Linamarin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.5","ri_type":"","moverz_quant":"248.1125","":""},{"Metabolite":"L-Leucyl-L-leucine methyl ester","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.5","ri_type":"","moverz_quant":"146.1172","":""},{"Metabolite":"L-Methionine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.3","ri_type":"","moverz_quant":"133.0314","":""},{"Metabolite":"L-NG-Monomethylarginine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.9","ri_type":"","moverz_quant":"144.1128","":""},{"Metabolite":"L-Saccharopine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.8","ri_type":"","moverz_quant":"277.1389","":""},{"Metabolite":"L-Tryptophan","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.8","ri_type":"","moverz_quant":"188.0703","":""},{"Metabolite":"Luteolin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.9","ri_type":"","moverz_quant":"287.0546","":""},{"Metabolite":"Luteolin 7-glucoside","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.8","ri_type":"","moverz_quant":"471.089","":""},{"Metabolite":"Lys-Ala","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.6","ri_type":"","moverz_quant":"218.1494","":""},{"Metabolite":"Lys-Gln","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.8","ri_type":"","moverz_quant":"275.1707","":""},{"Metabolite":"Lys-Gly","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.8","ri_type":"","moverz_quant":"204.1338","":""},{"Metabolite":"Lysine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.5","ri_type":"","moverz_quant":"147.1125","":""},{"Metabolite":"Lys-Leu","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"260.1965","":""},{"Metabolite":"Lys-Val","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"246.1807","":""},{"Metabolite":"Maltitol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9","ri_type":"","moverz_quant":"367.1203","":""},{"Metabolite":"Maltotriose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.6","ri_type":"","moverz_quant":"505.1755_527.1573","":""},{"Metabolite":"Melezitose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.3","ri_type":"","moverz_quant":"527.157","":""},{"Metabolite":"Melibiose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.7","ri_type":"","moverz_quant":"360.1494","":""},{"Metabolite":"Met-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.1","ri_type":"","moverz_quant":"306.159","":""},{"Metabolite":"Methacholine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.6","ri_type":"","moverz_quant":"160.1329","":""},{"Metabolite":"Methionine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.3","ri_type":"","moverz_quant":"150.058","":""},{"Metabolite":"Methionine sulfoxide","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.5","ri_type":"","moverz_quant":"188.0348","":""},{"Metabolite":"Methioninesulfoxide A","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.5","ri_type":"","moverz_quant":"166.0529","":""},{"Metabolite":"Mevalonic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4","ri_type":"","moverz_quant":"131.07","":""},{"Metabolite":"Monolinolenin (9c,12c,15c)","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.6","ri_type":"","moverz_quant":"353.2679_335.2573","":""},{"Metabolite":"N-2-Hydroxycyclopentyladenosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"3.1","ri_type":"","moverz_quant":"352.1611","":""},{"Metabolite":"N2,N2-Dimethylguanosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.5","ri_type":"","moverz_quant":"312.1296","":""},{"Metabolite":"N-3-Hydroxydecanoyl-L-homoserine lactone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.2","ri_type":"","moverz_quant":"102.0547","":""},{"Metabolite":"N6-Isopentenyladenosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"336.1646","":""},{"Metabolite":"N8-Acetylspermidine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"188.1754","":""},{"Metabolite":"N-Acetyl-D-galactosaminitol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.2","ri_type":"","moverz_quant":"206.102","":""},{"Metabolite":"N-Acetyl-D-glucosamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.3","ri_type":"","moverz_quant":"244.0788","":""},{"Metabolite":"N-Acetyl-D-lactosamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"204.0862","":""},{"Metabolite":"N-Acetyl-DL-valine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.6","ri_type":"","moverz_quant":"160.0965","":""},{"Metabolite":"N-Acetylhistidine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8","ri_type":"","moverz_quant":"198.087","":""},{"Metabolite":"N-Acetylneuraminic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.3","ri_type":"","moverz_quant":"310.1128","":""},{"Metabolite":"N-acetyl putrescine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.8","ri_type":"","moverz_quant":"131.1176","":""},{"Metabolite":"N-.alpha.-Acetyl-L-arginine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8","ri_type":"","moverz_quant":"217.1291","":""},{"Metabolite":"N-.alpha.-Acetyl-L-ornithine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9","ri_type":"","moverz_quant":"115.0864_175.1073","":""},{"Metabolite":"N.alpha.-Methyl-L-lysine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.9","ri_type":"","moverz_quant":"144.1015","":""},{"Metabolite":"N-.alpha.-(tert-Butoxycarbonyl)-L-histidine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.4","ri_type":"","moverz_quant":"110.071","":""},{"Metabolite":"N-Carboxyethyl-.gamma.-aminobutyric acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.1","ri_type":"","moverz_quant":"176.0914","":""},{"Metabolite":"N-epsilon-Acetyllysine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8","ri_type":"","moverz_quant":"189.123","":""},{"Metabolite":"N.epsilon.-Methyl-L-lysine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.3","ri_type":"","moverz_quant":"161.1281","":""},{"Metabolite":"Nicotinamide","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.6","ri_type":"","moverz_quant":"123.055","":""},{"Metabolite":"Nicotinamide riboside","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.4","ri_type":"","moverz_quant":"123.055_255.097","":""},{"Metabolite":"Nicotinic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4","ri_type":"","moverz_quant":"124.0391","":""},{"Metabolite":"Nipecotic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.1","ri_type":"","moverz_quant":"130.086","":""},{"Metabolite":"N-Methylalanine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.7","ri_type":"","moverz_quant":"104.0703","":""},{"Metabolite":"N-Methylanthranilic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"152.0703","":""},{"Metabolite":"N-Methylglutamic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.2","ri_type":"","moverz_quant":"162.0758","":""},{"Metabolite":"N-Methyl-L-proline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.5","ri_type":"","moverz_quant":"130.086","":""},{"Metabolite":"N-Methyl-L-threonine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.1","ri_type":"","moverz_quant":"134.0808","":""},{"Metabolite":"N-Methyllysine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"161.1281","":""},{"Metabolite":"N-Methylphenylalanine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.1","ri_type":"","moverz_quant":"180.1016","":""},{"Metabolite":"N-Methylproline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.1","ri_type":"","moverz_quant":"130.0859","":""},{"Metabolite":"N-Methyltryptamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.7","ri_type":"","moverz_quant":"144.0805","":""},{"Metabolite":"N-Methylvaline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.9","ri_type":"","moverz_quant":"132.1016","":""},{"Metabolite":"N,N-Dimethylarginine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.9","ri_type":"","moverz_quant":"203.1499","":""},{"Metabolite":"N-omega-Acetylhistamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.9","ri_type":"","moverz_quant":"154.0971","":""},{"Metabolite":"N-Tetradecanoyl-DL-homoserine lactone","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.4","ri_type":"","moverz_quant":"102.0547","":""},{"Metabolite":"Oleamide","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"282.2786","":""},{"Metabolite":"O-Methyl-L-threonine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.3","ri_type":"","moverz_quant":"134.0809","":""},{"Metabolite":"Ornithine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.6","ri_type":"","moverz_quant":"133.0969","":""},{"Metabolite":"Palatinose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"289.0914","":""},{"Metabolite":"Pantothenic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"3.4","ri_type":"","moverz_quant":"220.1175","":""},{"Metabolite":"p-Coumaric acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"3.6","ri_type":"","moverz_quant":"165.0543","":""},{"Metabolite":"Pelargonidin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.8","ri_type":"","moverz_quant":"289.0701","":""},{"Metabolite":"Phe-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"322.1866","":""},{"Metabolite":"Phe-Lys","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"294.1807","":""},{"Metabolite":"Phenylacetaldehyde","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.3","ri_type":"","moverz_quant":"121.0646","":""},{"Metabolite":"Phenylacetaldehyde isomer a","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.5","ri_type":"","moverz_quant":"103.054","":""},{"Metabolite":"Phenylacetaldehyde isomer b","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.5","ri_type":"","moverz_quant":"121.0645","":""},{"Metabolite":"Phenylalanine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.8","ri_type":"","moverz_quant":"166.0859","":""},{"Metabolite":"Phenylethanolamine B","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.5","ri_type":"","moverz_quant":"138.0911","":""},{"Metabolite":"Pheophorbide a","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.1","ri_type":"","moverz_quant":"593.2745","":""},{"Metabolite":"Phloretin","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6","ri_type":"","moverz_quant":"275.0909","":""},{"Metabolite":"Phytosphingosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.1","ri_type":"","moverz_quant":"318.2997","":""},{"Metabolite":"Pipecolic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.7","ri_type":"","moverz_quant":"130.086","":""},{"Metabolite":"Pro-Glu","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.9","ri_type":"","moverz_quant":"245.1145","":""},{"Metabolite":"Pro-Leu-Lys","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.1","ri_type":"","moverz_quant":"357.2491","":""},{"Metabolite":"Proline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.7","ri_type":"","moverz_quant":"116.0704","":""},{"Metabolite":"Proline-hydroxyproline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.6","ri_type":"","moverz_quant":"229.1178","":""},{"Metabolite":"Propanoic acid, 2-(1H-benzimidazol-2-ylthio)-, 2-[(5-bromo-2-hydroxyphenyl)methylene]hydrazide","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.2","ri_type":"","moverz_quant":"205.0492","":""},{"Metabolite":"Propionylcarnitine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.3","ri_type":"","moverz_quant":"218.1382","":""},{"Metabolite":"Putrescine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"89.1071","":""},{"Metabolite":"Pyridoxal phosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2","ri_type":"","moverz_quant":"150.0546","":""},{"Metabolite":"Pyridoxamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.5","ri_type":"","moverz_quant":"169.0944","":""},{"Metabolite":"Pyridoxine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"3.5","ri_type":"","moverz_quant":"170.0808","":""},{"Metabolite":"PyroGlu-Pro","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.5","ri_type":"","moverz_quant":"227.0998","":""},{"Metabolite":"Pyroglutamic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"130.0496","":""},{"Metabolite":"Quercetin-3,7,3',4'-tetramethyl ether","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"359.1118","":""},{"Metabolite":"(R)-Butyrylcarnitine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.7","ri_type":"","moverz_quant":"232.1539","":""},{"Metabolite":"Retinoic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"301.2159","":""},{"Metabolite":"roseoside","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"3.6","ri_type":"","moverz_quant":"387.2005","":""},{"Metabolite":"S-Adenosyl-homocysteine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.7","ri_type":"","moverz_quant":"385.1279","":""},{"Metabolite":"S-Adenosyl-L-methionine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.9","ri_type":"","moverz_quant":"399.1436","":""},{"Metabolite":"S-Allyl-L-Cysteine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.2","ri_type":"","moverz_quant":"162.0579","":""},{"Metabolite":"(S)-(-)-.alpha.-Methylbenzylamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.5","ri_type":"","moverz_quant":"105.0697","":""},{"Metabolite":"Sedanolide","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"149.1321","":""},{"Metabolite":"Ser-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.8","ri_type":"","moverz_quant":"262.1506","":""},{"Metabolite":"Serine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.6","ri_type":"","moverz_quant":"106.0496","":""},{"Metabolite":"Shikimic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"121.0316","":""},{"Metabolite":"Sinapyl alcohol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.4","ri_type":"","moverz_quant":"193.0856","":""},{"Metabolite":"S-Methyl-L-cysteine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"119.0159","":""},{"Metabolite":"Stachyose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"10","ri_type":"","moverz_quant":"689.2094","":""},{"Metabolite":"Stearidonic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"259.2053","":""},{"Metabolite":"Sucrose","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.8","ri_type":"","moverz_quant":"365.1047_307.1017","":""},{"Metabolite":"Swainsonine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.3","ri_type":"","moverz_quant":"174.1122","":""},{"Metabolite":"Targinine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"189.1342","":""},{"Metabolite":"Tetradonium","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.6","ri_type":"","moverz_quant":"256.2994","":""},{"Metabolite":"Thiamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.7","ri_type":"","moverz_quant":"265.1113","":""},{"Metabolite":"Thr-Ala","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.5","ri_type":"","moverz_quant":"191.1022","":""},{"Metabolite":"Thr-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.7","ri_type":"","moverz_quant":"276.1662","":""},{"Metabolite":"Threonine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.2","ri_type":"","moverz_quant":"120.0653","":""},{"Metabolite":"Thymol","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.4","ri_type":"","moverz_quant":"151.1114","":""},{"Metabolite":"Tiliroside","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"3.1","ri_type":"","moverz_quant":"595.1431","":""},{"Metabolite":"trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2.6","ri_type":"","moverz_quant":"209.0804","":""},{"Metabolite":"trans-4-Hydroxy-L-proline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4","ri_type":"","moverz_quant":"132.0652","":""},{"Metabolite":"trans-Ferulic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.7","ri_type":"","moverz_quant":"177.0542","":""},{"Metabolite":"trans-Traumatic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"5.3","ri_type":"","moverz_quant":"193.122","":""},{"Metabolite":"Tributylamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.7","ri_type":"","moverz_quant":"186.2213","":""},{"Metabolite":"Triethanolamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.5","ri_type":"","moverz_quant":"150.1122","":""},{"Metabolite":"Tri(ethylene glycol) monoethyl ether","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.2","ri_type":"","moverz_quant":"179.1274","":""},{"Metabolite":"Triethyl phosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1","ri_type":"","moverz_quant":"183.0777","":""},{"Metabolite":"Tripropylamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"2","ri_type":"","moverz_quant":"144.1743","":""},{"Metabolite":"Tris(hydroxymethyl)aminomethane","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.8","ri_type":"","moverz_quant":"122.0809","":""},{"Metabolite":"Tryptamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.8","ri_type":"","moverz_quant":"161.1069","":""},{"Metabolite":"Tryptophan","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"6.8","ri_type":"","moverz_quant":"205.0969","":""},{"Metabolite":"Tyr-Lys","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"310.1754","":""},{"Metabolite":"Tyrosine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"7.6","ri_type":"","moverz_quant":"182.0809","":""},{"Metabolite":"Uracil","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.8","ri_type":"","moverz_quant":"113.0343","":""},{"Metabolite":"Uridine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"4.8","ri_type":"","moverz_quant":"267.0585","":""},{"Metabolite":"Uridine 5'-monophosphate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.1","ri_type":"","moverz_quant":"347.0244_325.0425","":""},{"Metabolite":"Val-Arg","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.2","ri_type":"","moverz_quant":"274.1869","":""},{"Metabolite":"Valerenic acid","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"1.7","ri_type":"","moverz_quant":"235.1688","":""},{"Metabolite":"Val-Gln","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"8.4","ri_type":"","moverz_quant":"246.1444","":""},{"Metabolite":"Val-Lys","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"","ri":"9.3","ri_type":"","moverz_quant":"246.1808","":""}]
}

}