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{"sheet":"Table S23","index":0,"n_rows":118,"n_cols":13,"rows_kept":118,"merged":[[0,0,0,12]],"flags":["formulas_cached_only"]}
["Table S23. Differential metabolites of 3 DPA ovule versus -1.5 DPA ovule"]
["m/z","KEGG","Adduct","Metabolites","FC","Trend chart","-1.5 DPA.raw","-1 DPA.raw","0 DPA.raw","1 DPA.raw","2 DPA.raw","3 DPA.raw","5 DPA.raw"]
[277.21728,"C06427","-H","alpha-Linolenic acid",3.97123,null,4.84742212574259,1.92882527709007,4.98169141347537,4.17796998635515,1.7843712722433,19.2502082541182,2.52906407207571]
[277.07221,null,"+Cl","D-erythro-D-galacto-octitol",4.04653,null,3.73114527472489,1.91602492082951,3.92340487170362,3.59457493757273,1.72022868435958,15.0981884157335,3.84217922149166]
[189.00347,"C05379","-H","Oxalosuccinic acid",0.28526,null,11.6248166200926,14.0892491274102,6.91671376742289,5.4214675829008,7.57283473836965,3.31607711411811,8.87595540733748]
[215.03235,"C07130","+Cl","Theophylline",2.37667,null,5.15979263593825,7.32985112944315,5.53464823711418,7.95157257922284,7.7943647072233,12.2631165401356,33.4166698045628]
[189.03994,"C00944","-H","3-Dehydroquinic acid",0.26399,null,8.22236617692083,10.01767819205,4.83331615981941,3.81446511404855,5.37123888114403,2.1706037985312,6.34726598185878]
[279.23287,"C01595","-H","Linoleic acid",1.86893,null,9.44726375152739,3.11342557308286,8.1652312608893,5.85073360297587,1.92156046783102,17.6562938020036,1.01011425653292]
[273.07691,"C12128","-H","(-)-Epiafzelechin",0.11311,null,11.1802571720357,9.0846586227417,3.4476057904923,0.425470898484255,0.303942354460215,1.2645708904073,0.277127106583887]
[279.03819,"C02067","+Cl","Pseudouridine",2.00802,null,6.95871735648286,2.26900285045768,6.03043007823879,4.36744456244754,1.45909803129476,13.9732259995229,0.839364579448136]
[209.04505,"C05619","-H","5-Hydroxyferulic acid",0.41087,null,6.15662841488132,7.062357580939,4.47495589213457,4.44062022419719,4.24743475174082,2.52959172266561,4.26215169506688]
[209.0298,"C00879","-H","Galactaric acid",0.42361,null,5.78474800192195,6.64680582645328,4.14053502982248,3.85896003710759,3.5356112204749,2.45048609130286,3.9823099874681]
[327.21767,null,"-H","Corchorifatty acid F",2.59468,null,2.38788716419995,1.34125186745511,1.25574548346197,3.7184227410849,2.4387269662372,6.19579385406262,1.49806616831851]
[281.24849,"C01712","-H","Elaidic acid",4.35974,null,0.941608935728562,0.27377500232569,0.94239028806458,0.59034325937172,0.280587955538569,4.10517044373461,0.332821262139146]
[132.02928,"C00049","-H","L-Aspartic acid",0.70033,null,12.7795673274308,16.5756290923717,14.9377111988867,21.3205495685726,19.1023782203937,8.94992253071553,13.7570578975062]
[179.03409,null,"-H","3,5-Dihydroxycinnamic acid",2.41903,null,1.54588758388012,2.00951939183612,1.95837153878041,2.23524837215225,1.8543499543749,3.73954984561817,4.72908631447823]
[327.10882,null,"-H","Dihydromelilotoside",2.56763,null,1.73524527884216,0.987315073955891,0.935787063694286,2.72608707090477,1.78273205356351,4.45547358860841,1.10675610425652]
[293.24871,null,"-H","Methyl linoleate",1.85757,null,3.89994911967422,1.80140867850115,2.97723439094906,3.21996331834174,1.82660661380866,7.24444071215552,0.560724658430905]
[269.08783,null,"-H","D-erythro-L-galacto-Nonulose",6.5284,null,0.339493003921758,0.555743772189978,0.713766787045016,0.969755783096536,0.627110912368215,2.2163452895912,1.95949148619047]
[226.99607,"C04617","+Cl","(1R,2R)-Isocitric acid",0.32536,null,3.01999564479581,4.07517798556838,2.76186277016908,3.45015957293572,3.09736193254076,0.982571399513934,3.46926273197256]
[669.05656,"C10219","+Cl","Corilagin",9.89545,null,0.213770822440978,0.192655804216169,0.28316703429836,0.278151384808801,0.0611011247182715,2.11535849164467,0.524802405907903]
[207.01419,null,"-H","Garcinia acid",0.21648,null,1.92975079573745,1.94360987349998,1.14002814103743,0.672684461071894,0.563051619920237,0.417745432277789,0.641409330630815]
[328.15552,"C02105","-H","(S)-Reticuline",2.86193,null,0.944045087577199,0.484845178279766,0.445237503526453,1.51500824635679,0.918656354834294,2.70178950537701,0.524354260615123]
[557.16264,null,"-H","Physalin K",3.4191,null,0.753033448117886,0.124220793295739,0.929233288782799,0.705335514305474,0.169492468880169,2.57469915328799,0.0600056496038243]
[259.0224,null,"-H","Urolithin D",0.55947,null,3.36927911274725,4.01729455215986,3.74236328516178,2.43135589283782,3.10394286903842,1.8850112006471,2.79003136773263]
[227.06567,"C00526","-H","Deoxyuridine",0.44586,null,2.30602178942385,2.99553695723068,2.03280128047852,2.61037826383269,2.32423114365545,1.02817248629557,2.51188947821176]
[214.04815,"C08349","+Cl","beta-D-Glucosamine",0.73635,null,7.7202897715054,8.08009867224582,6.86467564605667,9.12255005093364,9.95901300167215,5.68481315664343,8.49213343538264]
[196.0539,"C00955","+Cl","Tryptophol",0.54423,null,2.32339587914858,3.18242999287539,2.02908053012665,2.47441159285508,2.80332672184911,1.26445552738937,2.20125034932167]
[146.04499,"C00979","-H","O-Acetylserine",0.57573,null,2.76772606115547,3.35426851815956,3.5456698386969,3.8587378124138,4.8814372235331,1.5934495250921,5.51016731159661]
[555.14666,null,"+Cl","Citrusin F",11.3768,null,0.127539406684663,0.0230394673555403,0.223281856715501,0.156179928789278,0.0506763650939386,1.4509898753585,0.040607538835336]
[165.01852,"C01606","-H","Phthalic acid",0.55545,null,2.06482024244267,2.37573116491007,1.7367177580645,1.55288845145857,1.82031443817862,1.14690760728475,2.11025431848341]
[327.05642,null,"-H","Cabbage identification factor 2",2.50894,null,0.684337967323314,0.415202469396037,0.409229636036172,1.09765086816503,0.707587806829091,1.71696418664745,0.466675953198505]
[131.03403,"C06010","-H","(S)-2-Acetolactate",1.92794,null,0.891944475096764,1.3793157158896,1.52966736890599,2.82089326753245,3.48504676695528,1.71961625266719,1.34277849684479]
[457.18682,null,"+Cl","1-Octen-3-yl primeveroside",50.9668,null,0.0160266424951368,0.0193334015736058,0.0384763728626478,0.0976560623808343,0,0.816826984246035,0.139289940517116]
[461.18457,null,"-H","13-Hydroxy-5'-O-methylmelledonal",17.6218,null,0.0462058183851002,0,0,0.104697881387426,0,0.814228817035217,0]
[559.19658,null,"+Cl","Gibberellin A38 glucosyl ester",2.25486,null,0.856940734032676,0.136286047724792,0.924282307686386,0.683886174015799,0.128916709587495,1.93228106740359,0.0513730999683218]
[281.13946,null,"-H","Cynaratriol",3.47827,null,0.320169869609338,0.138947341738399,0.345466276998827,0.320576287225469,0.151865165102585,1.11363741610501,0.104573127082599]
[161.04473,"C03761","-H","3-Hydroxymethylglutaric acid",0.65728,null,2.46157886355901,2.75661897714748,2.88662175075737,1.83926527608525,1.4394455069098,1.61793491099332,3.05770809676058]
[259.06108,null,"-H","Orientalone",0.62175,null,1.94080919627663,2.35478206956109,2.15287808672397,1.45459020989282,1.8235406855057,1.20669617669002,1.56045606187595]
[160.06072,"C00956","-H","Aminoadipic acid",0.65054,null,1.8258793954369,2.04821659853292,2.12101932896112,1.35050394086095,1.05496456602524,1.18780215914185,2.23277818900283]
[561.13997,null,"-H","Epifisetinidol-(4beta->8)-catechin",2.80948,null,0.355430065861925,0.0333176358148144,0.386968813390433,0.26980383447432,0.0287792477114467,0.998574352848369,0.0204418138150265]
[577.13539,null,"-H","Epicatechin-(6'->8)-epicatechin",5.4056,null,0.14526443756956,0.0613673745026428,0.0481223860521343,0.0582383155532479,0.0207314088555256,0.785241810131717,0.0174105783063247]
[161.06324,null,"-H","3-Mercapto-3-methyl-1-butyl acetate",0.66114,null,1.79051610248552,1.99916837658993,2.09734678607501,1.3313052731675,1.04078268593755,1.18378307158883,2.21623930751636]
[193.0348,"C08348","-H","Galacturonic acid",0.24535,null,0.578344378218376,0.791125176535096,0.479726086342763,0.311000189707651,0.362525389369192,0.141896728204714,0.229710992545851]
[224.04899,null,"+Cl","Indole-3-propionic acid",0.61883,null,1.45179265094318,1.6460296447887,1.21868152782589,1.77598183805292,1.84291129482204,0.898418385273701,1.62841266521843]
[517.23031,null,"-H","6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside]",0.10549,null,1.16681697021285,0.695543068413472,0.448049277714092,1.06764659271031,0.0602942855450628,0.123089829308762,0.0289657100314106]
[559.07712,"C16797","+Cl","Sennidin C",3.25447,null,0.254692125020269,0.0257290237821499,0.311706381019005,0.239294213230735,0.0513874734270179,0.828888065831081,0.0244533225733761]
[329.23331,"C14835","-H","9,10,13-TriHOME",1.45658,null,1.88862027067075,1.33528339852427,0.7436417778452,2.3248980587179,1.9180389884217,2.7509210786304,1.07352892509712]
[211.13357,null,"-H","Dihydrojasmonic acid",1.55197,null,1.12160204168704,0.913661078103753,0.804971929974185,0.689229666799694,0.757014071376159,1.74068882658675,0.55293600305274]
[118.08643,"C19238","+NH4","Ethyl acrylate",0.47791,null,179.794267498079,204.984679954639,154.836396639464,134.272300639051,188.544030380249,85.9249067258353,96.7532859134235]
[221.1301,"C09675","+Na","7-Isopropyl-1,4-dimethylazulene",0.18853,null,79.2041818587507,39.0988090003746,32.2919145294877,18.5112192224949,41.7634976387024,14.9324867045036,16.1801240191482]
[257.0606,null,"+K","S-[1-[2-(Acetyloxy)ethyl]butyl] ethanethioate",1.44938,null,70.0316693040191,71.9610043677731,81.0664316396244,77.5893027122984,65.6032072067261,101.502715563533,89.6926782142182]
[257.04177,null,"+Na","7-Acetoxy-6-methoxycoumarin",1.44257,null,71.1427251471848,71.8498724232549,83.6281101664559,85.46478758467,67.2681411743164,102.628075994626,93.5370680989208]
[273.12069,null,"+Na","4-Coumaroyl-2-hydroxyputrescine",0.34054,null,36.9178816998591,19.8540476197782,20.0209867328894,10.0078582560762,22.1331223487854,12.5721042758287,8.35893522209835]
[235.13042,null,"+Na","Dihydrojasmonic acid",0.2956,null,31.0241059787938,30.7346393163653,17.4266853195722,12.0392240818511,24.3770692825317,9.17080472304363,7.61197741679882]
[257.0795,null,"+Na","Artemidiol",1.46095,null,51.8494028810595,54.5093474180802,58.7494050010306,50.9622749166286,48.0539914131165,75.7493709217418,64.2220423825875]
[358.20063,null,"+H","5-hydroxypropafenone",1.93815,null,28.6396987477287,38.825183108233,40.429389062475,40.4353178308365,36.5600896835327,55.5081297556559,50.0268811520344]
[358.13503,"C05403","+NH4","3'-Ketolactose",1.81141,null,32.4605712890625,42.5128699454708,43.3797991549382,42.4767218244837,39.804687833786,58.7993031896726,53.9919613429478]
[187.07293,"C10469","+Na","Isoeugenol",1.42169,null,62.6826783477283,65.9502304325933,78.3019444825219,92.1131142149581,67.222416973114,89.115169332485,91.4755326723723]
[273.10964,null,"+H","Isovestitol",0.34322,null,26.8496836521586,14.3913402090902,14.5855244534915,7.32594253408148,16.0622359275818,9.21525791678766,6.12873782979728]
[358.11365,null,"+NH4","Cichoriin",1.72073,null,20.908495418361,26.6994346812151,26.8339555458944,25.8338099540548,24.9149147987366,35.9778923843846,33.547292559927]
[257.11458,null,"+Na","(10S,11S)-Pterosin C",1.4432,null,26.4956220095275,28.3936438629593,29.2280825005203,22.5234278009293,24.7001223564148,38.2384618219703,30.9814945607691]
[255.06248,null,"+NH4","S-Cysteinosuccinic acid",1.46726,null,23.1953780064817,24.0071909669517,28.5143522043697,27.6138490717462,21.5972412109375,34.0336033984868,29.0077231270926]
[235.10916,null,"+Na","11,12-Dihydrolactaroviolin",0.30782,null,11.9145315983256,11.8333983542263,6.77197003657701,4.65416571180871,9.3761633515358,3.66757460405128,2.99653072181385]
[171.04161,"C10438","+Na","Cinnamic acid",1.82263,null,9.74457243622327,13.73344535413,13.6399517372006,18.730419361845,15.3300503730774,17.7607604229089,17.8793085643223]
[222.14853,null,"+NH4","cis-3-Hexenyl benzoate",0.20016,null,8.21514464988083,4.14289084551991,3.43953772499913,2.00750920366734,4.32432174086571,1.64436933511134,1.76244574373219]
[279.15874,"C14214","+H","Dibutyl phthalate",1.63666,null,17.4134480992302,22.9290237772292,21.7965289725632,20.5433110582068,20.3178570747376,28.4999259120286,26.191770035001]
[219.07782,"C16014","+Na","Cis-stilbene oxide",1.91473,null,8.99838428028294,13.1037071269491,12.1726916149014,10.8561764980884,10.9564593672752,17.2295087130383,14.1491968884446]
[241.047,"C03837","+Na","4-Methylumbelliferyl acetate",1.92369,null,7.55464978296249,10.6681701169498,10.1942360088473,13.2641145827922,10.4166472673416,14.532775455051,13.8069425442252]
[187.03669,"C00522","+K","Pantoic acid",1.4293,null,17.6963751589666,18.6724811014922,22.1720926019012,26.0638313699276,18.9502941608429,25.2935030339944,25.9078570247246]
[408.04693,null,"+K","6-Hydroxy-R-acenocoumarol",2.58653,null,2.52766300811142,3.88423758054125,4.1015893279529,5.82625755350641,4.72789716124535,6.53788782129384,6.52559740092897]
[280.0964,null,"+H","Avenalumin II",1.55248,null,12.0071623129923,15.2970124396725,14.4018893945413,13.8299406132799,13.1373101472855,18.6408563960682,17.4692781334099]
[318.11796,null,"+NH4","Dimethyl fukiic acid",1.47341,null,8.57636825373915,8.34908016177191,9.43062994128368,9.27531835880685,7.95601127147675,12.6364668210348,10.8495361486338]
[140.06808,"C00183","+Na","L-Valine",0.71856,null,23.871639439317,28.6903091098951,23.046440867127,22.0552945238479,30.8604810714722,17.1532383711651,16.6874617079985]
[219.02639,"C07130","+K","Theophylline",8.9517,null,0.563665267385421,0.680378401840944,0.795151567117113,0.829907746391094,0.473225013911724,5.0457648674045,2.8900699780284]
[157.07552,"C02938","+H","3-Indoleacetonitrile",0.75277,null,14.4966528532935,12.0288178540658,11.6308053516951,10.1964336354682,10.97150785923,10.9127136071523,8.96268765497867]
[255.09898,null,"+Na","Marindinin",1.45641,null,9.13468518022631,9.25517398378123,10.8909353232775,10.9224644113094,8.4658057808876,13.3038807710012,11.4366580198437]
[253.11969,null,"+Na","Cyclohexyl cinnamate",1.43913,null,10.0574132731703,9.91809602751248,11.5077808489565,11.1096850861894,8.57393523454666,14.4739007395927,11.6248485855243]
[611.18376,null,"+K","5alpha-Ethoxy-6beta-hydroxy-5,6-dihydrophysalin B",1.90306,null,3.42257370323431,5.13325118154719,5.48566955230275,6.21586672803189,4.77855371832848,6.51337218284607,6.89315438050828]
[173.05744,null,"+Na","4-Ethoxybenzaldehyde",1.42052,null,9.75460341719331,10.1044305511143,11.4698080664775,10.528494449372,7.78317574262619,13.8566099104255,10.4056893999126]
[359.1384,null,"+Na","Nb-Feruloyltryptamine",1.67851,null,6.65219263170586,8.5127091338669,8.55942558851398,8.16757792614876,7.80609778165817,11.1657911262127,10.6737754026316]
[239.06777,null,"+Na","Artemidinol",1.60516,null,5.41022185810277,6.75174283635789,6.51290360825961,7.76827789874787,6.19670798778534,8.68425936891575,7.95429951584284]
[408.14139,null,"+Na","Papaverrubine B",2.50433,null,1.88844383935459,2.86880209134973,2.98440514040775,4.21720901448676,3.48384398818016,4.72928573748078,4.73470011834175]
[164.07371,null,"+H","S-Propyl-L-cysteine",4.18078,null,0.978083691880351,2.34501725197702,2.09174802361942,2.50282016713568,3.90556354224682,4.08915080416082,2.63693377334401]
[380.27871,null,"+NH4","Annosquamosin A",2.20105,null,3.0458056066857,3.43711475358493,12.0033661224803,12.4839469118321,3.38180350065231,6.7039770953583,7.61384619875438]
[241.11946,null,"+Na","(R)-Pterosin B",1.36168,null,15.9881471415035,17.6851555229961,15.7541755926414,18.2049389697136,16.7407095909119,21.7707623905606,20.5517150993171]
[257.13444,null,"+H","Decarbamoylsaxitoxin",1.30647,null,13.0165531752539,13.6528031307718,14.1338097931909,11.0404622909871,13.0107329368591,17.0057986866344,13.7563438789086]
[140.10684,"C13637","+NH4","4-Ethylphenol",0.72007,null,17.3095556634371,20.7418628084487,16.7286208887569,16.0363521677382,22.4048825263977,12.4641665545377,12.1348381284195]
[146.16505,"C00315","+H","Spermidine",3.49288,null,1.22470186382043,1.39245230153851,1.44937365807471,0.998094921416425,1.23888762742281,4.27773189665091,2.14145594945152]
[381.10848,null,"+K","Austrobailignan 7",2.27536,null,2.81363722730856,3.10112304445626,11.6971924695812,12.1222419130041,3.02642408907414,6.40203382902675,7.16314675071822]
[318.1359,"C00542","+NH4","Melilotocarpan A",1.49638,null,5.39943001700229,5.25331239769424,6.01131901584688,6.05477227555945,5.03731217980385,8.07957688967387,6.91610181826051]
[357.23964,null,"+Na","1-(3,5-Dihydroxyphenyl)-2-pentadecanone",1.59447,null,6.88019245178973,8.48203368808912,8.3522379554686,7.82171473604568,7.89341750144959,10.9702839273395,10.5004126311447]
[220.12696,"C08271","+NH4","L-Coprine",1.91352,null,3.62868168314949,5.3035969786022,4.97242390718616,4.5663179032346,4.51775640845299,6.94357226352499,5.84905002523677]
[611.21826,"C16305","+NH4","Pelargonidin 3-sophoroside",1.90429,null,2.48553352473212,3.72794597563536,3.98474103212357,4.51405331429015,3.47694047689438,4.73316975555035,5.00604456031377]
[366.22739,null,"+NH4","3b-Hydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8b-olide",0.39457,null,3.61080017441609,5.45547408642976,2.18550030764986,5.07800634363864,3.55628613829613,1.42469958133168,2.11963502822384]
[611.12035,null,"+K","2'',4'',6''-Triacetylglycitin",1.90323,null,2.48517470867907,3.72796595442122,3.98281156528191,4.51514216686817,3.48300647139549,4.72987068783153,5.00597726474709]
[296.14896,null,"+NH4","11-Hydroxy-12-methoxydihydrokawain",2.45057,null,1.50712884840418,2.46209467709928,2.82345894321066,2.87211747118767,2.2645460665226,3.69331889200692,3.15786500900022]
[255.13536,"C17488","+Na","Furanogermenone",1.40336,null,7.48765695290487,7.16677483441173,8.13306180766371,9.2398409437626,7.12356106042862,10.5078500111898,9.61565182066184]
[409.27095,null,"+H","Apo-10'-violaxanthal",2.16005,null,1.55855951641427,1.97703289467355,2.23856396264717,3.18123756063745,2.42637230157852,3.36655887690457,3.54272070458408]
[274.16574,null,"+NH4","1-Methoxy-1-(2,4,5-trimethoxyphenyl)-2-propanol",0.31509,null,2.75250542750124,1.52254156746726,1.48089474659474,0.723105556787328,1.62678948938847,0.867279317192357,0.575898371774205]
[483.146,null,"+Na","Methyl salicylate O-[rhamnosyl-(1->6)-glucoside]",1.37852,null,7.04247401972286,6.53457150943037,7.41727475650975,8.8294696199133,6.87014782428741,9.70819403667643,9.61509386844899]
[131.11787,null,"+NH4","2-Acetylpyrrolidine",0.12851,null,2.04089918976925,2.53311344484488,0.933229840330047,1.17412236206075,1.88667787760496,0.262272463321234,0.3425530008285]
[325.17722,"C05290","+Na","19-Hydroxyandrost-4-ene-3,17-dione",1.35833,null,6.83694055432179,7.07392031731813,8.35524138075406,8.74860374978248,7.26944552659988,9.28679447222238,8.37951518423546]
[291.08378,null,"+K","2,3-Butanediol glucoside",0.03677,null,1.59748145107363,0.0963085381638097,0.0902965281189221,0.108228150002183,0.165828719735145,0.0587438591991109,0.0519367284077104]
[239.16154,"C02029","+NH4","Dihydrozeatin",1.86921,null,2.49934034269364,3.43795737494593,3.2599901029321,4.30820029339892,3.43528323173523,4.67178411917253,4.41366517488858]
[558.09483,null,"+Na","Cyanidin 3-(6''-malonylglucoside)",1.28201,null,8.83179858473481,9.31276147607444,10.568455954067,12.3319774790013,8.69491894245148,11.3224931389394,12.3710120724094]
[146.11752,null,"+NH4","1-Methoxy-3-methylene-2-pentanone",4.43578,null,0.600846060292154,0.641766582980104,0.624182888474621,0.236847054134024,0.543163831718266,2.66522256894545,1.07863779922235]
[537.12673,null,"+H","Jaceidin 4'-glucuronide",2.00521,null,1.73349735580507,2.57575718389041,2.78872174806282,3.17063135289131,2.3671858638525,3.47602421225923,3.40021494511635]
[163.12277,"C06180","+H","Anabasine",2.52874,null,1.16243477580977,2.36797415065593,2.06263776489946,3.81493632844154,3.34837100803852,2.93950024939547,3.50229711631476]
[296.06549,null,"+K","Pyro-L-glutaminyl-L-glutamine",2.45505,null,1.14559177492486,1.92783686086751,2.16539566145569,2.17710443253213,1.69012349843979,2.81248661905828,2.41327558190043]
[325.15433,null,"+NH4","N-Acetylanonaine",1.38304,null,5.3797119171893,5.42243164864139,6.17262435350262,6.62438352057274,5.49685881733894,7.44034850717795,6.70339393176241]
[316.28433,null,"+H","Dehydrophytosphingosine",1.39967,null,5.00299833641678,5.08360107048698,5.2029393227374,4.33840772953439,4.56630744338036,7.00253118649878,6.06324336495817]
[185.03219,"C05100","+K","Ureidoisobutyric acid",1.77512,null,2.32681863620633,2.65285725783611,3.90988971170832,4.38600510231992,3.22050275206566,4.13037621132051,3.65571764207655]
[239.12505,"C01074","+NH4","N-Acetylgalactosamine",1.70903,null,2.55844505106817,3.32826107654019,3.21034180727161,3.89445922729817,3.07138365805149,4.37247169860686,3.97938170081459]
[229.08352,"C10476","+Na","Ethyl trans-p-methoxycinnamate",1.27843,null,9.96337670967227,10.6017703215281,13.1196195258469,5.64811639582857,4.23790400028229,12.7374589756282,9.20465507155739]
[405.18973,null,"+H","Dihydroclusin",2.55036,null,0.919130709816198,1.42407535340475,1.64906204723921,2.12257907238412,1.64549148976803,2.34411143774938,2.32298355717813]
[612.14372,null,"+H","Delphinidin 3-(6-p-coumaroylgalactoside)",1.86244,null,1.70969328528545,2.49894888763842,2.66588400915021,3.17321255866517,2.38436135649681,3.18420540804815,3.40664282482341]
[298.16589,null,"+NH4","Nigellic acid",1.8345,null,2.08860169864092,2.65183319216189,2.81408405694805,2.62653182922526,2.44906335473061,3.8315354742185,3.30010498723676]