metabolite_name 1 2 3 4 5 6 7 8 9 10 11 12 14 16 18 20 22 24 26 2015_03_21_B 2015_03_21_J 2015_04_07_B 2015_04_08_D 2015_04_08_J 2015_04_13_P 2015_04_14_P 2015_04_15_H 2015_04_15_P 2015_04_21_P 2015_04_22_F 2015_10_27_K 2015_10_27_N 2015_10_28_G 2015_10_28_N 2015_10_30_B 2015_10_30_D 2015_10_30_N 2015_11_02_A 2015_11_02_D 2015_11_11_E 2015_11_11_F 2015_11_13_S 2015_11_14_E 2015_11_16_B 2015_11_16_N m/z retention_indexes Factors Parent:BC240(UCD2120) Parent:BC233(YPS606) Parent:BC233(YPS606) Parent:BC240(UCD2120) Parent:BC240(UCD2120) Parent:BC233(YPS606) Parent:BC233(YPS606) Parent:BC240(UCD2120) Parent:BC240(UCD2120) Parent:BC233(YPS606) Parent:BC233(YPS606) Parent:BC240(UCD2120) Parent:no cells/no media Parent:no cells/no media Parent:no cells/no media Parent:no cells/no media Parent:no cells/no media Parent:no cells/no media Parent:no cells/no media Parent:BC233(YPS606) Parent:BC233(YPS606) Parent:BC240(UCD2120) Parent:BC233(YPS606) Parent:BC240(UCD2120) Parent:no cells/no media Parent:no cells/no media Parent:BC240(UCD2120) Parent:no cells/no media Parent:no cells/no media Parent:no cells/no media Parent:BC233(YPS606) Parent:no cells/no media Parent:BC240(UCD2120) Parent:no cells/no media Parent:BC233(YPS606) Parent:BC240(UCD2120) Parent:no cells/no media Parent:BC233(YPS606) Parent:BC240(UCD2120) Parent:BC240(UCD2120) Parent:BC233(YPS606) Parent:BC240(UCD2120) Parent:BC233(YPS606) Parent:BC233(YPS606) Parent:BC240(UCD2120) 57.02_0.1 0.01803361 0.005 0.005 0.025253836 0.041986227 0.049625536 0.05189937 0.053394245 0.058438864 0.056548295 0.056150065 0.059965319 0.057359175 0.062689366 0.065420796 0.066995023 0.066106883 0.066873859 0.066490392 0.029265768 0.029931531 0.027669425 0.033200077 0.032817259 0.039076378 0.038678207 0.034104932 0.03801261 0.033682475 0.037741528 0.029148611 0.047429989 0.005 0.052013726 0.034046035 0.005 0.050576991 0.020631565 0.019560822 0.005 0.061030787 0.005 0.056370397 0.036546004 0.005 57.02 0.1 59_0.1 0.044489212 0.005 0.041575271 0.043128649 0.045989143 0.046737418 0.005 0.04386771 0.040126878 0.044643104 0.044622406 0.043860708 0.042681161 0.005 0.005 0.005 0.005 0.005 0.005 0.042322138 0.039632082 0.005 0.043801278 0.042235665 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.046140244 0.005 0.046014631 0.049661331 0.005 0.045554566 0.039358643 0.028734399 0.005 0.033956338 0.031930959 0.037360043 0.041008542 59 0.1 59.04_0.1 0.005 0.039586889 0.005 0.005 0.049520058 0.057237632 0.058559705 0.060405355 0.063388916 0.064319841 0.064587716 0.066107733 0.065937014 0.075971879 0.079693857 0.080898071 0.079603715 0.085147387 0.083242844 0.005 0.041583529 0.039483665 0.040349052 0.005 0.049707333 0.050171784 0.043557662 0.046237637 0.0378853 0.046011004 0.047963293 0.058889325 0.005 0.062407969 0.049434727 0.005 0.061897624 0.005 0.005 0.005 0.066748216 0.005 0.059612884 0.041932318 0.005 59.04 0.1 60.98_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.013953474 0.005 0.014867932 0.005 0.005 0.016331007 0.012104277 0.005 0.005 0.014975122 0.01604264 0.005 0.021198852 0.018219123 0.005 0.017437399 0.016216683 0.018233241 0.005 0.018661946 0.005 0.020830441 0.020851665 0.005 60.98 0.1 66.07_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.019952383 0.017866908 0.01992722 0.0223887 0.019971198 0.01691422 0.020205467 0.016306713 0.017170486 0.019038213 0.01926858 0.020140352 0.016779634 0.020270905 0.02014005 66.07 0.1 68.98_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.028742231 0.005 0.005 0.005 0.005 0.005 0.005 0.028144409 0.005 0.023846808 0.005 0.005 0.005 68.98 0.1 71_0.1 0.056123955 0.051669628 0.051740419 0.05457155 0.059899681 0.062273863 0.059969987 0.060135613 0.055964964 0.059549627 0.059948992 0.057942039 0.059840805 0.020565437 0.019512261 0.021592522 0.020936066 0.013736262 0.018398764 0.058173754 0.054034427 0.043038503 0.062055177 0.057877559 0.005 0.005 0.038475715 0.005 0.048412213 0.005 0.047784774 0.005 0.049581227 0.005 0.052296106 0.053304586 0.005 0.04916752 0.042911571 0.035019034 0.044178489 0.042678059 0.042394722 0.045961534 0.046123439 71 0.1 72.85_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.041516562 0.005 0.039072277 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.046911605 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.038533708 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 72.85 0.1 72.9_0.1 0.047730563 0.005 0.052239697 0.051127658 0.048472788 0.048750545 0.044762381 0.005 0.051057962 0.046165671 0.047900454 0.046493807 0.051096441 0.045772449 0.005 0.049748795 0.050476571 0.055056267 0.005 0.005 0.041174137 0.005 0.005 0.041357172 0.044328296 0.041479924 0.042217598 0.04336848 0.043657767 0.040130018 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 72.9 0.1 72.93_0.1 0.005 0.044793716 0.005 0.005 0.005 0.005 0.005 0.04304247 0.005 0.005 0.005 0.005 0.005 0.005 0.051098032 0.005 0.005 0.047840784 0.005 0.005 0.005 0.005 0.039596282 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 72.93 0.1 72.95_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.040579407 0.005 0.039642169 0.005 0.005 0.005 0.040213349 0.005 0.045456511 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 72.95 0.1 74.01_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.01353608 0.005 0.005 0.005 0.005 0.005 74.01 0.1 75.95_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.012269798 0.011891809 0.014909652 0.005 0.005 0.015030618 0.015354204 0.01556227 0.015311632 0.014303675 0.019733661 0.005 0.018192527 0.005 0.018798832 0.005 0.005 0.020006506 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 75.95 0.1 76.96_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.135135204 0.13569483 0.142081018 0.132139779 0.131049103 0.16748894 0.165156925 0.13766446 0.164297645 0.145212156 0.161254087 0.097358416 0.184133442 0.05717354 0.192638154 0.114211433 0.07597294 0.187750768 0.094983371 0.109862463 0.005 0.101392773 0.005 0.12566746 0.108079086 0.055764661 76.96 0.1 77.96_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.01898008 0.01932919 0.018549661 0.018156631 0.016501735 0.022990885 0.025012542 0.01793004 0.022880284 0.019772507 0.021684769 0.005 0.026062967 0.005 0.02516435 0.005 0.005 0.024908693 0.005 0.012194869 0.005 0.005 0.005 0.014125914 0.005 0.005 77.96 0.1 78.95_0.1 0.031055451 0.027457559 0.03159391 0.033770302 0.035695753 0.034085564 0.033335589 0.032650779 0.031672777 0.029474408 0.030880848 0.034173075 0.033168479 0.005 0.005 0.005 0.005 0.005 0.005 0.054774744 0.054109881 0.054802376 0.05929107 0.06049115 0.022586026 0.020938274 0.053203949 0.020521197 0.048612381 0.020538262 0.048862804 0.025073762 0.051372857 0.027986237 0.053133053 0.055781662 0.028208882 0.048751762 0.052781305 0.041686271 0.042063252 0.048552382 0.045897475 0.045680862 0.046914233 78.95 0.1 79.95_0.1 0.074630243 0.07480847 0.07510958 0.080021947 0.082991289 0.086015741 0.080790208 0.082688781 0.077694112 0.079243446 0.081511535 0.07824432 0.092967267 0.005 0.005 0.005 0.005 0.005 0.005 0.177570351 0.156354782 0.14204588 0.173206172 0.160553039 0.030675899 0.032049397 0.109344538 0.029743552 0.166961157 0.028465903 0.129533242 0.031408098 0.12063284 0.030771586 0.134986053 0.13125311 0.02749564 0.127945836 0.110007213 0.07154929 0.105770954 0.114556088 0.108452146 0.113000752 0.104240421 79.95 0.1 80.95_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.012617889 0.005 0.015711297 0.005 0.013786914 0.013516064 80.95 0.1 81.95_0.1 0.005 0.0134636 0.005 0.005 0.005 0.005 0.005 0.015483966 0.005 0.005 0.013266576 0.005 0.015847471 0.005 0.005 0.005 0.005 0.005 0.005 0.027215866 0.023449924 0.022415691 0.028626799 0.024773217 0.005 0.005 0.016633549 0.005 0.027348032 0.005 0.019923606 0.005 0.017237013 0.005 0.020960571 0.018675976 0.005 0.020747833 0.017472735 0.005 0.015119417 0.016348939 0.014830985 0.018069931 0.017436754 81.95 0.1 83.02_0.1 0.005 0.005 0.005 0.005 0.005 0.016612671 0.014639914 0.014893993 0.014270838 0.005 0.013930234 0.014048316 0.018106766 0.005 0.005 0.005 0.005 0.005 0.005 0.016335021 0.014313468 0.005 0.017261686 0.015449048 0.014569976 0.017185383 0.012641258 0.014427946 0.014324356 0.014144008 0.005 0.013907905 0.005 0.017179723 0.005 0.014186623 0.015951785 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 83.02 0.1 85.02_0.1 0.029621669 0.029057658 0.025175692 0.029292544 0.034016897 0.035124977 0.0346907 0.036348972 0.032310288 0.034928298 0.032687354 0.037282006 0.036766732 0.020242771 0.023286483 0.022059832 0.020669421 0.023083154 0.021006309 0.030082476 0.027393653 0.024151081 0.032691884 0.031296459 0.005 0.005 0.024094343 0.005 0.024738415 0.005 0.024346033 0.005 0.029785771 0.005 0.027100049 0.031281722 0.005 0.02793562 0.02748045 0.029234673 0.029616938 0.030071066 0.024209466 0.026264906 0.029609725 85.02 0.1 86.99_0.1 0.019761468 0.016477278 0.015741646 0.022228113 0.024973895 0.027868076 0.025923773 0.029326572 0.027199011 0.026809187 0.025467028 0.026579776 0.022822209 0.005 0.005 0.005 0.005 0.005 0.005 0.024070142 0.022716178 0.020852388 0.028270559 0.027269295 0.005 0.005 0.023707232 0.005 0.013764695 0.005 0.024264474 0.005 0.025059336 0.005 0.021906542 0.028331455 0.005 0.022025728 0.027328689 0.038300978 0.026726959 0.034637418 0.028187601 0.023385683 0.025645167 86.99 0.1 87.44_0.1 0.027196843 0.028583255 0.026797216 0.027516149 0.02937144 0.027156198 0.025286946 0.027560466 0.026828041 0.030201175 0.027055606 0.026516063 0.026389788 0.029626082 0.028993725 0.030196129 0.028365959 0.02995898 0.030903157 0.019214565 0.015273736 0.02096983 0.020527798 0.015705886 0.020563902 0.019879059 0.016797862 0.016959696 0.019950063 0.020063069 0.016481393 0.014010731 0.017999745 0.005 0.016858409 0.014814949 0.019992099 0.013434856 0.01285766 0.015583705 0.017751245 0.016486636 0.014804704 0.005 0.015302347 87.44 0.1 88.03_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.014094076 0.015984751 0.005 0.012757493 0.005 0.012849732 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.015443923 0.01446749 0.01856786 0.005 0.014473852 0.005 0.005 0.019197562 0.005 0.005 0.005 0.02003276 0.005 0.022503408 0.005 0.020340956 0.029276595 0.005 0.021577639 0.028337453 0.026618396 0.017909965 0.028323894 0.021862478 0.022285579 0.025585056 88.03 0.1 89.01_0.1 0.072619631 0.067443077 0.06611667 0.068622462 0.073225258 0.076768746 0.07574407 0.076281209 0.067637769 0.07384748 0.074067581 0.073425135 0.074251199 0.016856511 0.022486293 0.021708002 0.02457601 0.016637104 0.019916277 0.071772761 0.067185399 0.057462595 0.075622642 0.070871316 0.005 0.005 0.050215346 0.005 0.0615773 0.005 0.067395918 0.005 0.069376212 0.005 0.076437666 0.074932376 0.005 0.075811546 0.061862309 0.047476715 0.059827678 0.054978067 0.057516057 0.064395977 0.062957963 89.01 0.1 91.03_0.1 0.005 0.005 0.005 0.005 0.016432476 0.032218757 0.034868701 0.026176147 0.023042774 0.031295969 0.042347434 0.028323401 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.013918296 0.018158987 0.010980062 0.019732504 0.014236932 0.012706093 0.012950762 0.014711918 0.005 0.005 0.005 0.014605788 0.005 0.005 0.005 0.019900244 0.005 0.005 0.014700723 0.005 0.005 0.013960871 0.005 0.026952422 0.022969761 0.005 91.03 0.1 93.02_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.012692005 0.014301338 0.005 0.005 0.005 0.016992321 0.015090195 0.017324624 0.01774823 0.024304201 0.02005852 0.02304399 0.025454245 0.035776843 0.035774734 0.035710945 0.037572691 0.036337396 0.045620828 0.043963489 0.03743961 0.04344873 0.036669075 0.04124606 0.01232002 0.039399173 0.005 0.037460918 0.016110426 0.005 0.036314115 0.012984433 0.011996735 0.005 0.025103315 0.005 0.035059957 0.025983255 0.005 93.02 0.1 94.99_0.1 0.027351003 0.027022272 0.02267156 0.029951744 0.035098545 0.0381313 0.03983239 0.043271812 0.041717679 0.041478021 0.039585014 0.041540477 0.04070644 0.023211483 0.029125864 0.025911964 0.024592333 0.027759215 0.024455974 0.225055084 0.232502541 0.240713492 0.230997569 0.232439896 0.286557888 0.286030272 0.243776277 0.280136928 0.246986715 0.275414373 0.185292408 0.331226053 0.113635483 0.346877512 0.21889189 0.149178166 0.340359874 0.18574824 0.209561345 0.024317097 0.209721153 0.022469523 0.251193931 0.218545831 0.122075701 94.99 0.1 95.97_0.1 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.005 0.042838997 0.045621104 0.046566826 0.043448969 0.04457977 0.058396602 0.056142715 0.045488584 0.054267702 0.048650965 0.054232272 0.032134218 0.063952528 0.01272959 0.065801568 0.039624359 0.022991148 0.066904203 0.033106138 0.037246689 0.005 0.038907919 0.005 0.048197418 0.040253379 0.014085027 95.97 0.1 96.96_0.1 0.249373816 0.238787766 0.23891064 0.255489071 0.263800198 0.268636548 0.262245136 0.267879305 0.253326044 0.256281143 0.265495977 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