#METABOLOMICS WORKBENCH hshcao_20221024_225934 DATATRACK_ID:3535 STUDY_ID:ST002419 ANALYSIS_ID:AN003940 PROJECT_ID:PR001557 VERSION 1 CREATED_ON December 11, 2022, 4:45 am #PROJECT PR:PROJECT_TITLE Metabolomic changes in growth of E. coli at four timepoints in MOPS rich and PR:PROJECT_TITLE minimum medium PR:PROJECT_TYPE MS quantitative analysis PR:PROJECT_SUMMARY Metabolomic changes were profiled using untargeted metabolomics in E coli PR:PROJECT_SUMMARY following its growth in two medium types: MOPS rich and minimum medium. the PR:PROJECT_SUMMARY samples were taken at the beginning of lag phase, end of lag phase, middle log PR:PROJECT_SUMMARY phase, beginning of stationary phase. the goal was to follow the metabolic PR:PROJECT_SUMMARY changes during a complete growth cycle. PR:INSTITUTE Duke Kunshan University PR:DEPARTMENT Division of Natural and Applied Sciences PR:LAST_NAME Cao PR:FIRST_NAME Huansheng PR:ADDRESS 8 Duke Ave, Kunshan, 215316, China; City: Kunshan PR:EMAIL hc284@duke.edu PR:PHONE 36657030 PR:FUNDING_SOURCE NSF of China (NSFC) #STUDY ST:STUDY_TITLE Metabolomic changes in growth of E. colik at four timespoints in MOPS rich and ST:STUDY_TITLE minimum medium ST:STUDY_TYPE MS quantitative analysis ST:STUDY_SUMMARY Metabolomic changes were profiled using untargeted metabolomics in E. coli ST:STUDY_SUMMARY following its growth in two medium types. E. coli strain was grown in MOPS rich ST:STUDY_SUMMARY and minimum medium and samples were taken at four timepoints: the beginning of ST:STUDY_SUMMARY lag phase, end of lag phase, mid-log phase, and beginning of the stationary ST:STUDY_SUMMARY phase. ST:INSTITUTE Duke Kunshan University ST:LAST_NAME Cao ST:FIRST_NAME Huansheng ST:ADDRESS 8 Duke Ave, Kunshan, 215316, China ST:EMAIL hc284@duke.edu ST:PHONE 04803885366 #SUBJECT SU:SUBJECT_TYPE Bacteria SU:SUBJECT_SPECIES Escherichia coli SU:TAXONOMY_ID 562 #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS 383222 383228 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa01_1; label=R2-5/t2_020; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383241 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa02_1; label=M1-5/t3_010; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383227 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa03_1; label=R1-5/t2_019; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383237 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa04_1; label=M3-5/t1_006; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383243 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa05_1; label=M3-5/t3_012; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383242 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa06_1; label=M2-5/t3_011; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383223 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa07_1; label=R3-3/t0_015; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383244 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa08_1; label=R2-5/t0_014; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383245 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa09_1; label=R1-2/t0_013; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383238 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa10_1; label=M1-5/t2’_007; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383246 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa11_1; label=M2-5/t0_002; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383247 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa12_1; label=M1-5/t0_001; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383225 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa13_1; label=R2-5/t1_017; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383230 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa14_1; label=R1-5/t3_022; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383224 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa15_1; label=R1-5/t1_016; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383229 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa16_1; label=R3-5/t2_021; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383240 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa17_1; label=M3-5/t2’_009; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383236 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa18_1; label=M2-5/t1_005; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383239 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa19_1; label=M2-5/t2’_008; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383231 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa20_1; label=R2-5/t3_023; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383235 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa21_1; label=M1-5/t1_004; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383233 383234 treatment:MOPS minimal medium - E. coli cells RAW_FILE_NAME=180626dCSsa22_1; label=M3-5/t0_003; comment=MOPS minimal medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383226 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa23_1; label=R3-5/t1_018; comment=MOPS Rich medium; species=E. coli; organ=cells SUBJECT_SAMPLE_FACTORS 383222 383232 treatment:MOPS Rich medium - E. coli cells RAW_FILE_NAME=180626dCSsa24_1; label=R3-5/t3_024; comment=MOPS Rich medium; species=E. coli; organ=cells #COLLECTION CO:COLLECTION_SUMMARY metabolomic changes were profiled using untargeted metabolomics in E coli CO:COLLECTION_SUMMARY following its growth in two medium types CO:SAMPLE_TYPE Bacterial cells #TREATMENT TR:TREATMENT_SUMMARY two growth conditions are set up: minimal and rich MOPS medium #SAMPLEPREP SP:SAMPLEPREP_SUMMARY metabolomic changes were profiled using untargeted metabolomics in E coli SP:SAMPLEPREP_SUMMARY following its growth in two medium types #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY GCTOF MS CH:CHROMATOGRAPHY_TYPE Normal phase CH:INSTRUMENT_NAME Leco Pegasus IV GC CH:COLUMN_NAME Restek Rtx-5Sil MS (30 x 0.25mm, 0.25um) CH:METHODS_FILENAME Data_Dictionary_Fiehn_laboratory_GCTOF_MS_primary_metabolism_10-15-2013_general.pdf #ANALYSIS AN:ANALYSIS_TYPE MS AN:ANALYSIS_PROTOCOL_FILE Data_Dictionary_Fiehn_laboratory_GCTOF_MS_primary_metabolism_10-15-2013_general.pdf #MS MS:INSTRUMENT_NAME Leco Pegasus IV TOF MS:INSTRUMENT_TYPE GC-TOF MS:MS_TYPE EI MS:ION_MODE POSITIVE MS:MS_COMMENTS see protocol file #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS mmol/L MS_METABOLITE_DATA_START Samples 383247 383235 383238 383241 383246 383236 383239 383242 383234 383237 383240 383243 383245 383224 383227 383230 383244 383225 383228 383231 383223 383226 383229 383232 Factors treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS minimal medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells treatment:MOPS Rich medium - E. coli cells xylose 4570 3071 3275 6671 4142 2380 7074 6802 6575 2449 6126 6920 372 424 1007 1760 497 131 807 3604 563 356 855 2948 xanthine 951 988 1095 537 1148 439 543 905 780 738 1413 685 2688 442 319 11072 1018 605 280 14700 143 725 289 7081 valine 135562 211857 60117 192868 126961 130150 96207 127235 200754 145701 86402 155680 1091185 1757745 1676879 770578 1239271 2654300 2120729 788015 1091188 1641485 1637535 713807 uridine 7162 50795 8342 51885 7639 17946 14287 77848 8368 32927 11044 42932 1071 2643 2885 3010 1640 1535 2841 4767 1652 4497 1608 5090 urea 2563 62070 101137 121774 45782 53562 104435 126094 75326 58490 122648 124411 53644 56661 98859 518915 78537 11768 145314 530924 125257 35135 139522 468276 uracil 357956 1144359 152079 1189907 182308 536952 437791 990145 621115 544666 387314 1410715 392120 955431 623912 457523 455748 757456 615975 595710 466794 984838 936435 684710 tyrosine 204119 247992 175586 110288 258508 192924 138147 106258 210170 294942 149911 135793 831476 763680 872163 165188 838731 1236568 789647 201088 665944 996384 918055 224757 tryptophan 4528 5601 4657 3918 4097 5383 3837 4981 5460 5438 3825 4236 176341 201675 155228 23982 192865 264204 130597 28181 113879 256155 218008 32691 trehalose 22081 69571 53115 10543 27644 60579 69699 12110 35008 107207 90111 6051 274480 9211 17005 2076 90321 20198 4237 851 104065 8345 6137 1363 thymine 76819 141755 121456 281329 69658 137923 194060 246110 140328 118309 211067 258591 11172 24581 28522 73756 11284 12006 31310 102918 15367 38894 29561 136797 threonine 9975 93960 21010 189271 11512 114535 28703 133046 24267 100755 27377 119014 344572 611257 422146 10362 392478 808734 545030 13059 328098 717660 528376 17583 tartaric acid 1662 1298 1420 3223 2769 669 2099 2054 3714 3017 3248 2253 336 250 1032 410 300 282 679 597 502 462 565 1227 tagatose 80022 57716 34136 87938 18392 37887 66103 56740 73085 24444 74640 66234 4548 8448 8961 11425 6373 2755 9598 14850 10251 8208 3030 17880 succinic acid 177933 802664 176930 866189 144750 540403 436333 694109 271462 620394 410807 749091 60238 188001 194816 783880 92737 84703 207793 795698 166378 232619 290047 954818 sophorose 2559 1440 2321 2090 2575 1591 678 1648 2306 1415 534 1024 165 148 753 101 247 348 656 144 158 220 499 229 serine 29696 120490 52393 82865 33262 312476 65151 74197 88174 269217 56828 67319 11978844 8868674 2192238 31440 10282593 4201839 557951 26342 11952232 5053061 3840648 26576 salicylaldehyde 6452 7928 4335 4924 4980 3829 4077 2848 15827 4769 2788 5047 1487 1110 2722 1124 2094 482 1574 1208 2034 3672 1219 945 ribulose-5-phosphate 1217 4062 2318 3981 1786 4171 2314 3458 1511 6800 3111 4359 158 563 620 210 217 210 494 197 241 683 562 301 ribose-5-phosphate 3581 13006 2822 1151 3423 10883 6678 2766 2798 12534 6277 5318 781 1707 3825 881 755 460 3638 1563 1019 1560 4736 2884 ribose 70056 92757 29265 32022 40687 43095 37764 33579 49734 29249 37020 43576 10261 10422 14813 6179 8378 9187 13567 10665 8418 13506 9222 24224 ribitol 8201 8368 7385 6003 9546 6234 11419 8274 11465 10028 13453 8348 4114 1251 1747 4591 1194 4715 1772 5553 1876 2326 1759 9395 pyrrole-2-carboxylic acid 3810 5136 3783 3859 5314 3462 4336 3069 5948 3889 4342 2955 3569 5466 4338 2663 3090 3447 4293 4625 3288 5979 7356 4011 pyrophosphate 56467 307207 114399 167214 94876 380634 196196 252468 277709 504379 197604 193072 26203 64730 45660 46978 20384 15020 35230 52114 39195 96356 55407 82411 pyrogallol 53434 37126 44430 31526 44524 22504 33527 31518 46858 19902 41537 24579 7285 5429 11993 8699 5584 3439 9234 10988 8553 6334 6994 10566 putrescine 1795369 3018990 3597424 7619041 1838929 2713659 5123851 8130914 2400548 1574178 4755935 8010136 601859 1615253 1520684 9434876 710491 1907009 1713984 8511695 806113 2332165 1817913 8417435 proline 5380 26424 31172 39289 4820 27069 35388 45839 11757 23410 40833 57174 253164 419801 667569 471440 309581 1079460 1358159 854179 266186 289696 736328 722934 phosphoenolpyruvate 18973 18760 52610 56615 31536 69006 40635 58137 31804 65375 35135 43117 6170 9826 22061 15688 3564 1822 23298 20541 13597 7776 15366 25256 phosphate 7314396 4918093 5388277 5328347 6897311 4221797 4975836 5541488 7524510 5055092 5267999 5489230 773914 1443016 1156846 1563114 862877 661530 981228 1375223 1037747 949409 1251451 1675684 phenylpyruvate 17158 6486 14163 10331 16312 7641 14841 13986 25471 8069 16652 13806 1859 3156 11564 3772 2140 1651 9157 10580 2417 4914 13156 9504 phenylalanine 30909 99667 30084 68278 31581 98870 35656 61517 59595 145182 33018 75883 1068735 1170769 1123301 1315790 1086611 1464358 1051143 1600279 927589 1553315 1293150 1482563 pelargonic acid 329220 354991 321685 192976 295842 400440 320880 199858 359682 247129 260823 258214 65452 137514 124081 86836 51081 30287 67789 93182 127467 125567 187610 80330 pantothenic acid 20643 9424 4933 21619 19515 5974 8686 23169 27763 3767 7947 21822 22679 17515 27712 59136 24400 24156 23778 72366 21037 24822 29038 76694 palmitoleic acid 12492 43142 15590 21334 12979 25525 42157 22087 73078 33636 30283 36385 2029 7694 10416 6664 2648 2177 3138 10963 6105 7690 7267 15724 oxoproline 694422 4114027 2727590 5445978 808755 7104271 4049141 5476564 1574053 5553599 3693635 5551467 1809962 2581035 1858685 2433328 1499271 2685100 1865476 3467664 1717257 4100980 2472779 4210458 oxalic acid 16884 6596 13358 13874 17704 6947 7587 11705 15692 6541 12698 9981 1443 1816 4032 2906 1794 1359 7163 2508 2489 1722 2568 2756 orotic acid 2139047 839337 3475370 5892517 1975770 937645 4261982 6415690 2966829 1085581 4090958 6511526 2962 2674 6285 8603 3372 2231 2344 16142 7738 5727 3849 11548 ornithine 102722 734513 386918 531932 99776 545723 209437 458889 253934 757826 308672 390477 6249266 4132356 6599344 13170298 6818800 6627951 6157666 11942063 5325616 5228143 7252241 10606783 oleic acid 14453 64489 20550 36102 16851 28021 41079 57220 76167 41467 36059 46292 4609 11324 18156 11750 5155 1827 5317 16482 10850 9560 10686 24140 O-acetylserine 3872 1259 6474 2392 823 700 7365 2577 1771 66150 7782 2510 1854 1126 42858 7006 1692 866 1290 10322 17939 2281 1180 7061 norvaline 7627 81475 69772 56674 7021 85293 101656 69405 9444 67707 116628 64597 1158 3805 1921 3980 1172 1541 2227 3489 1768 1705 2222 3400 nicotinic acid 71285 18720 11130 24638 26326 8672 17190 15470 25767 9550 18277 58468 1642 2427 3579 41572 2745 1516 5806 64120 6255 3202 3455 155306 nicotinamide 18520 75010 34036 129388 23796 87325 50362 124391 46423 93055 46403 106910 9486 9908 7056 50613 10075 4845 8076 69171 15568 20549 4929 79220 N-carbamoylaspartate 121570 132988 336957 755373 116118 238709 410825 661462 186894 236367 369065 631553 2170 5780 20631 14454 3552 2281 15255 3508 4956 6535 16490 13528 N-acetylputrescine 62191 462155 74511 202811 56904 449121 95825 210473 115908 374071 92119 190254 56760 47763 98588 266966 57175 33047 104025 173617 65548 85282 86365 244099 N-acetylornithine 3581 4159 4142 2239 4097 2021 9835 2471 3667 2470 18632 1815 1153 590 3167 2570 607 653 3003 2524 1551 1454 1249 3890 n-acetyl-d-hexosamine 13153 8968 3665 4423 4052 4415 13585 4347 19826 3556 3085 5468 1060 1394 1059 1481 929 1611 597 1651 1015 1054 1120 3597 N-acetylaspartic acid 95518 190339 336633 893738 94173 258104 455407 975537 150304 280469 425432 967198 1844 2160 5885 8350 2088 1172 5271 12822 1900 4897 2498 13810 myristic acid 39612 22143 28347 37091 27634 17945 26585 36255 35953 28369 39111 28544 5104 4507 7717 9128 4424 2294 12158 8463 5635 4605 5730 12119 montanic acid 8583 5802 6605 8277 6028 4244 5384 9226 5406 6265 6281 5684 1724 1329 3608 1023 1746 779 6966 750 2492 1029 965 1196 monomyristin 2576 3735 1924 3037 4127 2335 1703 1656 2962 4444 1651 2171 1670 2300 1660 955 1269 1560 1768 1428 1384 1811 781 1495 methionine 8446 53144 16377 48789 15528 60811 22076 40224 18646 70582 20640 25832 347419 443375 375266 57160 378667 582946 422960 70789 341455 596271 406640 83294 maltotriitol 4998 1948 2549 2099 2555 1217 3285 1322 4462 1257 2440 1322 447 327 795 420 373 157 555 436 519 464 567 698 maltose 44701 216140 171962 25040 38606 203719 228443 27882 61267 317654 264052 23490 146540 28551 7726 1419 16117 9770 7460 1429 21339 25324 8822 3605 malic acid 61149 198375 87302 111141 69828 365616 93739 91008 146041 323307 94864 78695 7322 36319 10458 16416 15011 14627 9622 23125 19956 48175 6055 33608 lyxose 32006 17287 19904 7339 33472 21205 18488 5449 42118 12684 17448 4482 7007 5334 12313 1267 5280 3690 17951 2007 7040 8131 10179 2000 lyxitol 13248 4852 6974 8602 12684 2949 3624 10091 12908 6411 6664 6677 4114 2214 3179 7417 3814 2413 2883 7927 5762 3484 5466 13031 lysine 50601 131410 22647 3985 42319 20508 43423 7715 45058 11792 79743 30253 202694 138638 87321 356087 185329 346168 34310 362646 73039 201638 177831 299618 levoglucosan 26734 51853 31753 55568 36530 55381 35532 44013 45119 81851 31187 30314 5357 9987 9393 6619 4696 4596 11132 8219 6653 17811 6935 8094 leucine 144519 517517 136710 165621 153332 533840 152993 140242 227904 723951 158512 140107 2772917 3180043 3453468 2659842 3120412 3251420 3835901 3006014 2623954 2805290 3376748 2424425 lactic acid 78182 120941 38965 2852 96523 32923 77678 27107 38194 35279 52595 18087 29438 81699 159855 118077 50078 21609 151275 62852 61826 74915 109407 85239 isothreonic acid 3207 3306 3361 3958 3812 2358 3837 2636 5257 1659 2417 3681 744 712 1352 2065 1328 498 847 3208 929 1346 1124 2900 isomaltose 10598 6387 8653 5290 9600 3033 10304 6751 13429 3212 13569 6814 910 858 2484 1485 739 567 1176 1791 1973 1185 869 2121 isoleucine 83263 107875 48095 257354 88799 106975 55733 222673 184652 116302 55900 209776 783153 1203692 1404131 21006 826962 1582062 1499505 15913 829972 1394220 1524032 18247 inosine 1666 21353 3865 5208 1647 24593 10256 16406 2555 51835 14094 8310 489 11177 1469 8627 2031 7410 2274 10189 1551 19222 2205 10693 indole-3-lactate 2144 1505 1720 1602 4127 2128 1431 2270 2940 1508 1439 1705 597 581 856 1265 614 242 1120 1454 578 636 567 1073 homoserine 1467 3771 9810 70706 2415 8754 10343 48113 3942 8345 10009 28883 2345 3253 5295 15553 1671 1773 7635 22441 2598 6481 5187 25535 hexose-6-phosphate 19235 55611 25048 12407 15404 48069 19818 11087 14288 38721 24419 14327 1480 3604 8027 975 1884 938 8849 808 2380 2993 6166 1921 hexose 3049 7116 7216 8869 3413 4734 12584 5362 4979 4278 11568 10594 4010 826 592 2033 4427 4359 1116 2010 4986 1217 7807 2484 heptadecanoic acid 32741 55570 25749 23605 29185 45998 56850 34382 70091 37651 24308 36498 8121 4793 14607 3927 5434 3737 13759 7167 8774 13370 2448 9730 guanine 985 542 974 343 484 570 524 692 617 462 1077 784 59707 43358 1685 2508 6256 202791 317 2457 324 67584 21307 989 glycolic acid 33588 23127 41390 121120 38092 18317 29497 102976 41487 32047 33895 103554 4998 4305 12146 14832 5741 1362 9995 10268 6047 5054 8002 11485 glycine 43983 92254 63219 397958 44250 79467 85308 285504 60330 114570 100279 334584 830138 1058832 1445774 73699 904908 1285567 1703337 70282 790754 957975 1117068 89404 glycerol-alpha-phosphate 52998 424968 271176 1365123 65596 423571 174123 1229055 50226 922484 200600 1052402 48629 71815 94539 349864 32521 18861 103537 331141 57607 91650 55187 416029 glyceric acid 12712 13324 21711 62185 7455 20403 33405 56961 13097 24123 34854 57136 1662 4942 7084 18711 2462 750 4031 24273 1874 6266 9201 26462 glutathione 5397 44262 16923 131518 6891 64574 15906 107831 9537 93525 27141 92734 4367 5570 12821 46796 4634 2500 16723 52176 9164 18795 8723 94518 glutaric acid 3170 3760 2632 4920 5464 1740 4540 5288 8799 2875 1982 3215 930 322 1362 995 844 274 1937 1242 870 465 1246 999 glutamine 9098 9611 19072 21786 13098 26113 15370 23555 16198 23515 13302 18217 16845 14041 4046 6300 22166 33480 26691 7623 19033 21538 11348 8392 glutamate 87292 1033476 592875 636293 124756 1530578 810342 795873 213327 1481039 566714 820430 52280 80028 88044 75559 37675 41551 60409 164831 53820 119247 76555 136579 glucose-6-phosphate 128903 419696 85862 253816 53591 141993 105646 219333 44381 214462 114488 364079 5297 47652 29762 14196 14225 16501 47834 16985 18615 46098 24503 41995 glucose-1-phosphate 580612 838463 481074 671894 598619 933234 936845 575128 1180639 974462 1013565 374451 55138 120996 80967 96590 54691 71176 75891 149713 51501 246882 96222 138160 glucose 15861542 10072591 15454558 15982 20133188 9324200 10543599 15883 14841723 7669176 11340464 21870 2747951 2424675 6145561 6977 2785711 1184758 5834478 9569 3872895 2011366 2471122 11101 gluconic acid 11317 49170 49208 1462 7435 26453 63303 1491 14669 20117 57986 1370 1453 678 2389 638 666 1054 2379 663 513 1771 2530 677 gamma-aminobutyric acid 6078 18891 24654 70557 13478 17775 50183 103393 12987 12875 57957 94757 4807 11837 8820 147673 6489 12399 13474 166845 7199 13228 7756 185780 galactose-6-phosphate 2385 17381 5952 5926 2390 5168 11137 6539 2174 4347 6433 5783 825 731 3804 1057 869 1270 1872 1280 723 1363 1045 1598 fumaric acid 116136 155914 191701 235122 117221 324470 227076 194366 185807 232551 268051 193031 29305 37006 15058 29584 11611 14833 14129 41726 16274 42299 17318 57674 fucose 3444 5942 4622 4996 5968 5132 3406 5351 3835 10482 3950 1397 395 654 1013 845 580 232 858 676 775 599 399 2227 fructose-6-phosphate 29251 98882 34257 33430 26311 85753 28181 28669 18240 109189 37216 43069 1897 8921 8808 927 2766 1867 9245 1050 4417 13323 5007 1509 fructose 90417 59727 25252 22305 60432 28575 59652 22461 59831 30113 57993 34656 2550 8819 5719 3829 5843 2727 5127 4848 7858 9357 5724 9050 ethanol phosphate NIST 2027 2670 1492 2577 2290 2523 2486 2825 2801 3049 2006 3749 287 488 768 987 354 130 376 1135 754 380 478 1776 erythrose 2397 1672 3257 1219 2749 939 3940 5052 2919 5827 4796 11248 409 297 715 2296 469 202 602 2124 568 339 763 2426 erythritol 4694 3602 5600 6829 4656 2230 8328 6838 6632 2843 6948 6581 1552 427 1728 1285 1129 386 7806 2074 1959 866 631 1895 dodecanol 5604 6549 15303 5583 5698 8073 6950 4363 8400 10162 5242 5222 2220 2385 5054 1679 1374 1391 3384 2141 2134 3140 4206 3039 cytosin 1637 17564 8643 11635 2525 17937 8150 13876 3992 18171 8778 4421 172906 121299 80614 5565 145284 268923 64892 7174 115115 190298 91837 6856 cytidine-5-monophosphate 146987 134520 117839 115844 128468 146520 156697 139652 170707 125251 186537 106807 20719 20798 18217 47550 19693 17165 17372 45777 21410 30240 22061 44110 cysteine-glycine 2796 2155 1599 1268 2525 1262 2939 1566 2987 1346 3624 1061 440 328 506 4156 476 527 394 3124 381 508 437 4689 cysteine 1541 1997 1662 14731 1647 1894 1980 6267 1650 2392 1977 6126 48096 63337 35408 22697 51971 62895 65062 35080 52336 116570 38464 32152 cyanoalanine 2289 3703 2580 4644 3692 2726 3745 3049 4501 2830 3893 1866 6686 6912 2050 655 5321 7209 3936 671 2791 3256 1143 945 citrulline 22816 109136 136714 38833 45871 33967 5618 26206 58879 39743 2563 23548 1253819 1215138 906422 1669789 1471856 791461 783693 1385801 1176203 1278202 1488867 1772814 citric acid 546487 52907 42116 257594 1030997 73814 59608 254050 1106552 55091 61385 224589 391651 59426 54045 102286 454245 62621 50170 91383 377964 129367 79345 78989 citramalic acid 4977 21360 11465 12109 5080 17370 24292 11508 7220 19618 14776 14669 343 627 2081 798 518 107 2795 1014 882 693 1267 1083 catechol 3618 3676 2770 4825 4241 2436 5146 2534 3988 2214 4727 2965 438 675 1016 890 420 223 1411 1416 668 495 722 985 caprylic acid 64555 71941 76342 51777 57148 113421 62122 52881 57443 46539 43949 49195 10291 19247 21443 18548 13027 5229 9696 11519 16613 9784 21726 11162 capric acid 10997 11564 11524 8431 7724 12313 10041 8632 8557 7932 6194 7461 4060 3480 6753 5011 4960 8426 5912 7764 5514 4843 5444 4017 butyrolactam NIST 5471 3514 5437 16022 4316 3666 6401 15285 6301 7769 6234 13957 12783 14671 17546 7800 959 6767 6666 7887 13727 1421 18588 13615 beta-glycerolphosphate 2746 12525 10360 21872 3593 9676 6165 19306 6372 19768 6775 16515 1954 2046 3078 5972 1415 966 2086 5554 1640 1693 2418 8152 beta-alanine 4159 2103 2301 3417 3144 1580 1667 6637 4034 2916 2069 6218 769 921 1313 7508 744 638 2178 13127 1000 813 1638 8982 benzoic acid 247212 276677 299460 138297 68281 346207 192959 45579 91916 104826 59205 137844 44883 35100 96010 54890 39415 11795 24294 18238 86304 13195 72811 25069 aspartic acid 20195 250258 194554 294391 33946 314362 188632 251547 47122 369842 201637 212152 197976 421582 501598 113667 427739 483537 619320 167890 400181 559719 711767 157479 asparagine 27199 8711 12163 18906 82771 15123 24949 13758 155289 12283 26383 18090 94867 75751 37811 13372 67564 129246 23299 25341 32834 136700 20883 18545 aminomalonate 2908 2904 4107 4933 2650 2782 3496 6208 2862 2871 2695 4849 3144 4711 5481 1840 3415 2909 4763 2456 4838 6877 5456 2987 alpha-aminoadipic acid 1616 1225 1444 2473 798 1177 998 2632 1440 1545 657 4640 2767 624 571 4141 2055 1305 670 4142 3351 1305 498 7120 alloxanoic acid NIST 1176 2318 1634 4310 1033 3966 2546 4044 3386 3366 1720 4794 261 737 1202 1363 339 151 646 1903 648 787 1191 4323 alanine-alanine 5052 73534 25269 35457 10983 76801 26874 48718 5225 111310 27516 39316 9243 21497 18289 149135 14970 9781 15257 223224 13042 39041 11125 258819 alanine 181901 2894491 865467 1142905 88145 2297923 662791 905160 203395 4628390 764923 749711 1060508 1455474 2773988 120647 1316606 1942142 3713059 165632 1280342 1230555 2020246 179063 adipic acid 50206 27009 50223 155304 66569 23593 42803 67225 42934 75496 33779 75171 8687 5627 34395 11682 9964 3411 82960 10854 14644 5227 7482 12840 adenosine 1774 1462 1907 1336 1407 1329 1843 1224 1636 1375 1836 1000 1592 2840 1483 3434 1764 3058 1366 4040 2996 3416 1471 3699 adenine 44469 60953 48672 44962 34799 48689 62598 92527 89607 38466 62505 71353 621013 486814 295218 55218 508179 806668 178165 53474 365327 687528 282682 69043 6-deoxyglucose 58988 19731 28519 81818 46405 22717 35145 77026 70398 41422 31235 91566 7583 11804 22918 25979 13287 9801 11559 33468 12560 15078 20056 76275 5'-deoxy-5'-methylthioadenosine 15405 20773 9482 15196 15314 19755 13880 14958 19944 14959 12955 15655 1293 5318 4862 8683 2952 4787 3613 11509 2607 7022 3969 11139 5-aminovaleric acid 4940 4778 2494 3371 4296 2086 3912 3978 5724 1999 2209 3832 1223 1677 1438 2163 3637 726 1812 1504 5686 1957 1257 2262 4-hydroxyphenylacetic acid 4395 2203 1817 4175 3498 1487 1458 4395 5531 2096 2034 2839 368 236 795 1353 345 212 709 1542 334 346 468 1523 4-hydroxybutyric acid 9248 6536 6947 4364 6881 4301 10169 4162 10054 5117 9114 4626 1181 1400 1138 3345 1030 528 979 2627 718 1656 1633 3259 4-hydroxybenzoate 14619 3042 18246 28967 14296 1323 26508 27292 20222 4801 23614 28592 27681 26646 31288 56083 29344 38683 29532 66611 24265 37055 35910 63588 3-phenyllactic acid 22808 2067 2283 4960 20294 1555 3349 4682 36341 3654 2934 5205 2959 875 1095 4968 2974 445 688 6855 2340 1418 918 6266 3-hydroxybutyric acid 19580 13100 11171 41324 28627 4027 77893 35767 15068 7388 90808 37375 5518 9864 20854 24017 6359 5261 12531 13563 17571 9633 15686 13143 3,6-anhydro-D-galactose 10149 6908 8850 2735 5060 5421 8074 25719 8967 4602 8559 22593 3582 2788 5309 4136 2680 2897 5814 4362 3514 4625 5811 3749 3,4-dihydroxycinnamic acid 3926 4723 3492 4053 5863 2704 3395 2746 3984 3179 3404 3695 647 908 1685 553 925 957 3047 558 632 669 1373 709 2-picolinic acid 26651 29010 25393 2193 33766 21274 36269 20332 50974 2088 35390 18888 6981 8395 11926 10478 7428 3458 13938 13363 10046 6910 11145 14259 2-methylglyceric acid NIST 13572 23384 7468 24209 12460 14925 12275 22630 22987 20640 12485 30023 2560 7019 6491 22185 3562 3602 6096 23033 6164 8072 8579 28522 2-ketoisovaleric acid 12949 6391 16778 19222 5758 3557 12451 12004 8250 9943 12884 15080 2786 11219 26536 2437 2968 3852 17514 2868 4122 14117 16337 3663 2-ketoisocaproic acid 31395 12911 12225 11816 40343 13621 23861 12200 51402 10186 23850 13895 2997 18229 23752 14149 3662 6033 22641 16462 5110 27854 31242 13788 2-isopropylmalic acid 20789 10318 34109 25893 20713 10636 37869 27273 31808 8074 36704 27589 1497 1847 728 458 1315 3101 761 781 1127 3128 608 712 2-hydroxyglutaric acid 12991 37324 29956 19006 12400 83199 43393 23795 24577 30676 37133 23336 3369 2523 1789 36326 2676 2403 2595 46894 2739 3113 2111 42496 2-hydroxybutanoic acid 29118 12344 45346 22887 852436 16423 50994 21745 13792 11751 36420 14073 27958 34474 57508 26348 27935 31482 62747 19364 28116 24172 34033 17540 2-aminobutyric acid 3681 18169 20764 19001 9161 22032 24626 18637 4822 17712 16494 23688 2772 2149 5235 86657 3583 22251 4827 88310 3881 3080 3750 101054 2,5-dihydroxypyrazine NIST 4940 29462 11375 75779 6257 41262 14118 63842 6882 37635 7425 64772 6908 10256 7649 19728 8193 9618 7891 23766 11530 16928 6081 37386 1-monostearin 3066 16783 2304 1927 3742 1327 2708 2093 3436 815 1828 1623 473 522 576 1395 919 5338 428 928 770 629 347 2058 1-monopalmitin 7960 58490 23431 25983 12784 31161 22657 10926 25386 36949 32310 19477 34770 29640 42742 66059 25167 18540 36323 65703 29836 36520 22348 80445 1-monoolein 19222 44523 18515 17972 11811 15800 34992 8616 13785 12100 29789 9324 13978 25527 58527 78786 8314 11681 52775 80421 12375 39690 30347 125306 1-methylgalactose NIST 4746195 409900 70680 6301 86538 60465 136780 9092 97440 27388 92738 8447 19966 41923 97582 4850 152858 349378 31757 5352 21802 50709 32228 3622 1,2,4-benzenetriol 29139 21107 25552 34545 35238 18682 23541 24818 34566 29869 22111 22309 4573 5674 8197 6038 4542 2521 16044 2411 5844 6574 4975 10260 346945 1699 1582 1582 1652 2206 1561 2690 2581 2359 1821 2020 1613 4517 2911 2455 15024 3294 9679 2353 24954 2042 5682 6688 14449 346935 1045228 616453 1034828 313171 1114078 448020 1629253 543378 1777127 99940 2120684 617017 130912 131699 68115 342829 95785 100805 32876 438002 89366 147685 165186 413975 346922 1994 2688 1710 1859 2769 2282 1454 1826 2783 1606 1710 2000 7673 11366 12167 10927 13061 4978 17849 18794 18978 14193 13982 20896 346914 17430351 8312919 11549284 12708547 18808850 7081828 9796815 13511037 14247327 4149310 10052764 12550117 2194253 1912652 4138770 2942342 2159432 1004527 3953304 2514129 2800626 1475450 2505885 2903492 346911 187106 583130 315419 166501 151097 379377 360434 121432 373335 211757 548812 96219 126926 156075 94853 233304 72471 119010 88035 306905 73002 401347 98939 332772 346904 34714 62805 44872 59043 33477 67493 79839 57122 66998 17388 90520 41782 3792 4694 3323 5362 3295 5307 6088 3525 3726 8149 4251 7368 346898 18703 23233 29880 4301 11387 16990 44359 2872 15161 4663 42262 3842 378 3763 5342 545 1277 2425 5009 651 1496 4467 3902 662 346897 44697 17187 23870 7560 34754 12417 62987 10410 82362 2388 67449 12964 2368 1786 1874 7818 2374 1234 1745 12896 2038 3667 4038 11670 346890 2309664 1191019 1379965 578595 2109602 659742 3287249 684883 4914506 219255 3792073 740657 123451 149768 147587 348650 113329 99884 138545 403518 93742 274925 328253 469986 346884 89395 69318 80145 109399 108149 56577 81801 79772 118610 65716 81089 76989 8220 9000 21043 16196 9489 5001 28884 19623 12922 9649 12524 21528 346881 26543136 12601248 22252355 24551578 28798179 10151530 15905552 22658512 21388291 9722154 16129451 20844515 3515099 2935896 6706248 4710009 3640001 1647468 6001386 3890547 4445421 2169732 3700886 4342713 346794 17166 52000 23051 27549 30573 57182 34680 28311 38985 31078 41655 28558 3775 9483 6422 9606 2289 2313 4919 15596 4394 12471 7005 12817 346684 4046 3728 2618 10408 3558 4875 3207 9124 2409 8167 3425 11396 8987 10854 14251 860 9193 5221 16433 1018 12850 11415 12838 1177 345420 6651 6186 5119 12001 7310 5888 9258 12342 10713 5073 9149 10772 651 1934 3099 1905 1580 855 1025 1740 1515 607 1196 5002 345404 9626 11920 9033 8629 12015 13589 11286 8687 17413 9947 9348 7632 2033 2111 3635 3564 1631 1870 6463 3860 2028 2948 2292 6775 345403 6693 2913 6332 10074 7954 2753 4077 7916 5713 7348 4668 4924 979 2066 2548 955 968 982 3143 1236 1608 2678 1025 905 345278 16834 23073 12346 4938 20473 36517 34371 15426 37517 18803 23711 10594 429 465 762 633 391 343 1148 1230 739 503 625 948 345144 3224 10801 7513 2893 13672 9001 7046 9686 15959 9850 5450 5095 2752 2411 4644 2642 2661 1485 4078 3717 3503 2865 2890 3976 345139 32400 28992 25517 23415 38037 22131 31020 20871 47824 16784 30528 18542 4287 5102 6808 7356 3916 2500 7738 8640 5154 5916 6784 10190 344959 64962 28216 69464 76420 66245 27761 44343 116864 58519 53928 40984 103914 76679 61008 107745 159930 76909 56355 106111 178205 75430 80707 87164 173034 344793 5808 5396 2812 7596 3668 2474 3354 3360 4850 2186 3955 11382 614 863 1532 1867 1524 2462 902 2449 875 659 794 3954 344756 4375 3787 5734 11040 8024 3006 5677 8010 5606 8503 5292 7044 1173 1016 2875 1950 1063 411 4127 1364 1932 722 1383 1800 342876 5189 6903 6871 15156 5693 7037 6470 17535 4134 50988 9142 15395 353 1620 2523 2560 711 792 2853 2630 1058 3135 1650 3858 342038 134491 246134 118727 1154026 131417 257116 203366 1190212 206221 275388 166214 1001128 32272 30083 34959 434004 44522 14057 36179 539453 57359 30881 32436 526054 341991 18242 13644 13824 31277 16372 12815 13640 31569 28696 10799 19045 26147 4249 3714 5754 4330 4270 3995 5489 5011 4017 8483 4664 7684 341678 1666 18573 4169 1936 2345 21494 7788 8451 2555 61348 11552 7239 489 13693 1997 11354 2729 9713 3444 11777 2375 22270 3192 12731 329435 6385 3385 3406 1507 5903 4776 3020 1680 7841 4984 3562 1993 9674 7770 16332 363 6241 6524 19421 362 7228 12962 21288 335 328853 1953 918 1237 934 1622 1072 1152 1672 1593 1200 1306 1363 1350 1111 1819 401 1394 2006 1022 283 1114 2373 1900 579 328852 1234 1480 1295 1345 1617 945 1456 905 1614 1273 1217 1561 1485 1180 2156 203 1612 952 922 223 713 1502 1914 358 328829 2700 3175 2909 2586 3717 3384 4382 1629 3133 3641 4030 1377 52342 36192 12971 609 32189 52971 10692 428 33242 54554 14002 768 328824 2696 2419 1385 2893 2116 1572 1483 3411 3375 1500 1585 3458 446 631 998 928 331 279 641 869 759 649 772 769 327614 45050 62203 47722 44844 37304 50868 36038 53585 73509 77135 33661 28904 6154 5289 4923 9981 4262 5171 2977 18591 4796 6260 8740 18524 327580 2995 3394 1361 3710 2764 4915 2037 3462 4423 6322 2691 3270 1715 3732 2213 919 1633 857 2532 1096 2614 2510 2348 1320 327312 5143 8248 3962 8769 6646 6269 6584 3580 14804 3946 6728 4934 663 2020 1889 3089 1038 383 2460 2255 1819 1488 1294 2911 324892 22122 18029 17500 15079 12984 13233 30342 8384 23500 7672 33696 12782 3102 4100 3290 5595 2715 1967 4360 4747 2213 3915 5674 5659 324843 7266 6917 5959 6355 5848 5430 5084 7790 8657 9087 7973 6705 972 2173 2762 1591 1468 1475 3058 1832 1169 2221 2410 3731 324429 3544 27002 3361 3904 5648 8628 10911 4222 6575 6768 5972 1739 15155 22480 22611 2179 38332 183640 13097 2786 11468 27771 17894 2666 324277 897 1144 691 1390 1387 844 705 952 1162 1026 517 890 454 1725 1778 219 1194 2102 2771 194 1427 2333 1903 307 321077 26688 10137 19731 754 34754 6575 13463 1424 24174 6800 30491 723 3344 1007 5235 367 3320 3306 2271 309 3465 4288 7129 142 321064 6211 3710 5275 3200 4181 4953 5384 6440 7798 4193 5648 2417 479 3062 1237 1929 654 324 1060 2313 610 776 897 1248 320849 2198 3193 2152 1923 4047 2031 2994 2034 4918 2230 2837 1931 10220 11663 16036 16648 10453 12217 12227 19216 10858 18587 18211 19117 320847 1928 6427 1820 3060 1966 5613 2527 2510 3322 7400 3083 2448 7670 7700 24171 12208 6671 3859 15002 14499 8643 10189 12002 26672 317497 1944 1002 1869 1611 1487 1171 1580 1302 1764 2040 1351 1308 2850 3644 2125 471 2134 1628 1152 884 2557 5142 1300 1201 253506 34901 189384 49266 24918 30453 103212 67534 15218 37674 84807 80296 14614 9229 7580 12838 3696 8735 3033 19894 2857 13365 7604 11646 4710 253093 1608 1514 1154 1119 1487 580 879 1212 2063 1253 683 1236 765 942 1230 562 827 492 967 602 1139 1202 979 668 251689 7000 5563 5530 7348 3518 2626 3580 2868 5577 3447 4826 4140 1002 1190 1377 1564 993 1103 2124 888 1442 1501 1474 1936 247758 523 3638 3648 5235 7405 2643 3411 968 866 3252 1947 1685 219 61 2272 839 389 527 993 938 1284 858 1504 1227 241681 3756 2302 3938 2063 4042 2074 1912 2101 3649 3747 3206 3376 842 840 1672 641 635 354 820 640 1021 935 1050 946 237287 9248 8587 6947 5899 6881 5909 10169 6055 14081 5117 9114 7294 830 1012 1785 3345 1030 528 1601 3468 1365 1656 2196 4147 229602 2090 25154 10591 36824 1697 59977 8328 42451 1736 70042 8606 34783 11694 16433 22689 12053 10239 27040 14193 13610 12611 31210 21775 19563 229311 1811 5464 2346 3371 3403 2736 2447 1668 2862 5689 2903 2270 1450 1163 1793 1244 684 1402 1712 1342 917 1378 1685 1901 229167 8492 7781 9876 6025 8817 5611 7236 5610 11718 5300 9830 4945 2157 2175 2327 1123 1793 987 2260 1921 1726 3189 2278 2094 228818 275383 154960 178940 2085 268288 121971 147897 2573 352365 28482 261744 1811 7529 24758 84889 595 23773 23293 93784 514 24096 27002 97789 848 228477 8226 6572 3295 3340 5634 3799 8468 4698 11914 2640 11958 3339 3842 7856 8964 2333 4560 11363 12786 1965 3824 6499 7273 1504 228466 3552 15113 5644 4951 3872 14041 15407 3203 12524 22708 12924 6277 827 1770 1847 1119 467 643 2635 2560 503 3772 2011 1553 228373 5542 4374 8411 9383 10289 3666 10325 11555 12131 4740 12277 10858 907 801 1565 3433 643 299 1705 3701 914 971 1027 4206 226546 3270 2810 2618 3985 4735 2331 4496 3470 4394 3731 3241 5619 1069 919 2035 909 994 825 1058 1112 1130 861 1760 1618 224253 1255 2302 912 754 908 1029 1218 1003 1162 1269 1039 551 6320 7029 2239 211 3864 20936 1175 144 7392 13662 3710 196 224096 1965 1842 1233 1778 2340 953 1834 1208 1679 1127 1647 1133 1742 2355 4050 267 2442 4583 3516 253 1329 3135 3293 409 224095 6431 4073 5002 2685 4137 2582 4457 3112 8742 3487 4949 2517 4919 6196 813 1689 5289 19487 1119 1679 2413 5979 461 1529 223405 1196 1609 757 889 1038 1462 1527 854 788 1261 1191 452 399 602 860 219 316 502 487 283 751 525 466 181 223298 6930 4378 7327 2063 1482 3550 12591 2919 7138 1054 5514 1863 522 1015 2650 656 1854 1129 2893 557 1631 966 1655 226 223250 1221 2092 1288 812 554 1683 630 862 1230 961 884 986 4902 5169 7295 167 8240 32502 4137 157 3095 6080 5801 225 223222 4437 5062 3969 5610 4825 2557 4196 5020 7716 3049 4401 4308 621 849 2341 1245 720 464 212 1675 1249 1059 1734 2157 223192 2883 2999 8670 3223 5050 2694 13807 3777 1091 18880 2993 3030 695 762 1950 1084 2058 2094 1325 1373 1217 1156 1111 1085 223154 1051 564 1506 767 838 401 353 1090 827 1095 520 555 23292 18970 4973 211 47372 214914 1067 121 8371 19776 2582 189 223120 2555 4658 2131 8160 3992 2029 2424 6267 4091 3787 3243 8002 2538 4861 10635 2519 8169 11390 4381 3116 4813 7790 4074 2617 223100 22471 7429 15745 1223 23417 5426 14821 1440 32050 1253 27169 1144 540 1815 4231 586 962 1737 3456 610 1199 2143 9438 845 223080 12758 24628 23859 4477 11851 59385 22586 3639 18607 18730 35388 4383 10134 9529 6481 964 4914 7137 10491 1064 6085 21393 14369 1593 222303 2800 2356 1693 10164 1377 2886 10267 1027 1843 5259 11004 1243 475 7401 17825 363 1485 1472 9480 547 1470 6147 16350 3771 222288 1770 9580 3496 5168 1741 22612 3780 2184 3190 72921 3858 2414 269 8838 29821 325 2907 196 33238 514 5416 12417 19690 543 220224 735 404 701 871 958 325 295 606 474 665 428 746 3024 3666 1070 158 2554 3848 857 274 2166 7886 907 196 219979 2119 1738 1219 1196 1412 3485 1271 1027 1671 4217 1569 856 245 539 1185 357 436 183 666 364 370 1302 834 338 217651 3278 57931 10591 4883 4122 12357 81107 6181 5389 9756 28962 5825 877 4387 1927 776 5121 3335 1098 873 2473 2313 782 560 215683 2123 14552 5572 9789 2230 38167 7564 4717 5574 118455 9064 4780 449 15619 60530 321 3645 315 57005 1251 9193 20889 37875 1169 212828 4046 3132 3824 4500 5264 3424 4682 3856 4687 2794 2228 3130 907 575 1446 1187 955 617 1402 1961 609 984 776 1511 212751 1807 2137 2166 1995 2275 977 2239 1668 2366 1184 1280 1407 813 549 2411 1134 811 2243 1284 535 553 705 952 1176 210993 3319 1203 5693 2058 5304 7740 8521 2172 5513 4136 5266 2144 4343 2472 5200 520 2252 4740 3714 438 1389 4998 5013 856 210986 6734 1844 6045 2013 5908 1145 3317 11878 3820 2887 2901 8163 1520 481 809 538 1657 713 860 694 3036 998 918 1438 210682 1911 2701 1506 1223 1911 1622 1305 1330 2056 1464 2613 1229 375 391 571 410 430 282 575 522 479 488 555 604 210457 25138 18424 35076 45648 22534 14766 35326 44717 37916 11727 37646 48596 2851 3415 4394 3940 3425 1444 3866 3928 2539 4765 2553 3267 210403 6506 9228 6815 14240 6038 18775 4288 13530 10998 19870 7640 11396 2487 2245 1182 1276 1260 876 700 1455 1922 2527 811 1937 210343 6560 2270 1665 1404 4311 1251 4874 2400 8325 1310 1767 1640 456 2469 3939 686 507 346 2166 838 760 2655 3471 603 210292 18770 12288 12332 6874 15833 9853 19333 9383 16405 7769 21126 9841 11387 4468 6552 13792 12870 13053 3596 14901 4240 9284 7449 14379 210280 4466 6495 1910 853 2640 2118 12181 1098 3404 1362 5485 565 1400 1885 5359 211 3241 11516 2321 158 1607 2855 2528 246 210276 53970 54216 38475 1304 48656 21441 68784 964 66994 9367 71652 1277 11168 7388 19708 1274 15372 26371 15572 1442 7118 10677 16734 1397 210272 636601 379761 393609 1535 511162 265242 535445 1704 880527 58550 710828 1445 65881 78338 53902 605 44400 75880 52787 745 42512 113806 97373 714 210262 4005 2990 3365 4662 4431 2179 4856 6791 6444 2766 4547 5818 459 346 703 735 403 176 515 1115 453 560 298 961 210229 2763 6876 3900 5407 2265 5622 2715 2030 3322 7571 4030 2383 599 579 1496 823 693 698 476 703 989 1376 1481 1048 209687 4564893 2632919 4068262 96951 5836096 668726 2577066 146895 1073619 4558328 2567899 159666 693438 614219 1854173 75822 328387 354739 1790170 91921 1162022 419940 745883 15162 209677 21985 11006 13586 1404 16392 8010 21393 1491 36512 973 28209 2801 1993 2280 1410 326 1079 2068 1445 298 1050 3462 2928 494 209671 196811 233273 250788 109399 53965 413337 156491 36809 74578 131926 47384 115066 36832 41826 96010 45621 47694 11795 24294 22071 86304 13195 72811 20377 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12117 2757 4444 4534 663 1078 863 948 432 573 534 2505 1174 1751 1171 2468 47358 4707 5378 4118 4017 3243 3846 5545 2801 8029 1569 6055 4818 1098 1404 2594 1552 1394 1261 1786 2216 1508 2337 2386 6204 46207 1770 1966 2301 2776 1537 1934 2848 2522 1867 2068 1999 1171 6524 3200 6116 2333 6578 4443 4160 3310 6221 5896 5187 2851 45378 6543 4721 6560 10552 4790 3059 6891 4347 9017 5535 2693 6924 2055 2180 3893 4785 2088 1102 3713 877 2972 2038 2078 2459 43100 19771 15700 8923 38837 15918 8459 11211 34158 14983 13300 13541 35009 6123 4681 4267 4803 6032 2661 3708 7037 3106 6030 6550 7165 42914 810 4058 2484 6251 1602 4251 1859 5296 2366 4789 1280 3359 1020 1277 2608 2129 1202 622 2632 2109 1121 2624 1320 3713 42424 4470 1842 3990 11356 3423 2428 3535 10760 8069 7936 4599 4914 447 632 809 2046 440 396 1516 1434 582 529 1107 3008 42074 1496 1171 1043 1981 1337 947 1280 948 1465 1456 1283 1219 273 615 865 571 354 214 1079 622 523 375 743 1086 41882 11225 29414 34264 28362 17305 18526 46798 27646 20407 9075 66488 20672 4395 10490 7570 8166 3513 5972 12092 8381 4305 2392 7063 10424 41836 7594 8691 5230 3096 8558 6482 8827 6362 15781 3589 9423 4249 1058 1750 1536 1731 941 1191 1219 2677 1724 2586 2119 3731 39801 4325 6120 4746 4879 4456 5308 4569 2605 4672 6188 4977 4294 1362 2000 2008 1414 1582 1443 2160 1499 2124 2091 1209 2166 34183 7582 5944 6636 7334 8997 5371 7449 5984 10713 4667 6388 5345 1806 1633 2086 1797 1806 986 3026 2137 2681 1893 1396 2269 34174 2418 2110 1396 1110 2919 148074 1937 1039 1579 1654 2280 990 2789 2294 3366 5978 3106 3479 3027 6961 3719 4141 4161 4207 34115 122368 170621 134672 80373 117545 206794 204513 132515 206445 92702 225716 90518 24392 19530 27262 47809 27647 32795 32035 44912 25639 43480 37629 68939 33386 10266 3038 7379 11915 4651 1880 12358 10394 7548 1529 9404 3048 1262 262 1301 7067 1126 164 1628 9462 831 333 1209 8972 32158 15749 5565 12823 42588 11681 17330 15324 36707 9042 28053 14408 20384 25682 872 23328 5228 29103 1413 3074 4641 24195 1112 3976 5592 31224 3830 6208 2864 5339 3288 4911 4219 6987 5210 8065 2525 4445 694 2037 3370 2683 813 391 3294 3409 1528 2327 2186 4007 27145 16451 11724 14104 12177 19151 11159 17424 11315 23379 10689 18237 12327 1011 1237 2462 3810 1071 812 2762 3843 1707 2016 2515 3825 26062 4142 3092 2612 3669 2196 3652 3068 3387 3229 3633 2939 2212 583 615 1130 811 359 864 904 967 776 1296 824 984 23001 202183 105875 150473 49412 9620 90019 458253 36447 425101 12944 263957 20370 11866 36297 13283 19451 8767 7065 9276 43976 10200 23061 65171 53220 22444 1678 2473 1202 4197 2215 2645 3516 3525 2716 9732 1639 3387 354 1021 807 1959 516 229 562 1777 615 191 766 1621 21885 12567 10331 8719 10900 13727 4957 10746 9702 15485 7676 8852 8304 2826 3112 4982 1837 2311 3154 3869 3140 2884 4367 4467 2781 21817 8429 7962 9341 13355 12195 3749 5865 11236 9598 15616 5181 15779 1761 2072 5620 2251 1800 983 5558 2899 3962 2190 2406 2889 21704 67214 36507 58427 33087 64568 24169 68951 34012 80319 12396 76107 40224 6086 1483 8304 9927 6110 4641 7973 11381 6044 7071 8280 13796 21683 23597 73046 33117 25532 30483 45285 37530 51756 54592 43267 27958 47966 6317 9808 7646 14383 7070 12048 4078 21564 9713 12324 7604 31762 18520 57684 27478 76314 91914 59818 30008 82705 47239 79036 47087 97271 36176 11371 4471 5121 25306 9211 4809 3015 29396 9297 11957 9272 32512 18488 2439 10977 4404 4540 2116 7080 6660 3474 4084 5539 5906 3695 1137 3284 1828 720 1181 2046 2215 1175 1045 4140 3172 1297 18386 13149 20891 16612 10047 12415 15030 24434 9124 18258 17441 20895 8992 4343 3181 8194 6773 4213 4513 5891 7649 3909 7254 7568 9366 18310 6169 26291 6933 36883 5344 12573 5877 3978 12142 3593 4805 23579 3532 1761 4384 837 2448 4450 4240 3333 2984 4120 5659 2041 18266 1724 1835 2052 6386 2455 2850 1676 4993 1212 2019 2114 4184 927 1158 1043 4512 1147 1041 650 5620 1402 2759 995 7617 18226 81750 4446 47909 135946 77093 4305 120792 161621 125392 6354 120871 154585 814 1313 3045 1942 1329 426 2110 2450 1887 847 1243 1665 18225 7362 10866 11472 15485 7150 11322 13140 17854 13685 8155 4729 12101 1921 1793 5684 4839 1972 912 4833 5586 2879 3238 3634 5611 18177 2642 3924 2622 3927 1208 1901 4418 4064 8012 1675 5511 5280 193 212 951 1007 310 306 312 2987 841 219 444 3020 18173 743228 51127 688064 1214956 629217 51436 1204101 1341478 1055443 47699 1301149 1323645 10284 3745 16026 103779 11189 264690 15766 134488 8937 2148 21203 109121 17664 40809 35451 50085 33484 19715 49881 26716 18424 25036 31710 15157 29958 6619 5727 16799 8101 7019 1776 5207 4808 12430 3023 8381 4471 17537 1562 979 1161 2893 1996 964 1174 1259 2078 1289 1174 1924 449 662 601 702 367 383 916 523 366 881 776 663 17463 21013 61526 16035 1932 14086 18829 44426 2030 21455 8937 21091 1962 4840 1993 5807 1097 3954 5676 3594 1223 3007 2642 3201 1047 17297 3390 2731 2629 3588 6073 2192 5126 1751 3977 3613 5696 1582 4558 1465 1674 476 9197 13123 1143 657 510 3499 3384 782 17267 1525 3173 3914 4085 1906 4139 2507 5528 3126 5701 2903 4715 7077 7249 7615 1387 5845 4682 7002 2271 6930 10546 6283 2768 17252 4923 10623 11102 7470 4082 3297 2930 3722 9469 8175 7732 4869 75329 51347 62861 46072 146562 354291 114669 151985 73989 132153 17145 105579 17233 2659 6082 4373 1404 2525 3185 5144 2951 12335 1590 6591 1109 4253 7664 6261 11114 4215 6376 8108 10516 4028 10654 12872 13663 17002 19189 13234 1172765 16586 1751223 10706 35015 30542 21647 52148 54671 32218 5119 4616 7520 4717 6586 7859 3444 6622 3344 4796 11931 8662 16980 1612 2031 1050 1462 2365 778 1728 1330 1967 1557 1304 1455 609 415 468 337 730 2671 685 280 421 349 496 462 16792 2094 6321 2435 1593 1582 3803 2711 1546 2074 2993 3421 1579 2097 3462 4854 160 4264 34936 2656 237 1386 3145 3235 293 16747 12671 8729 7068 4121 9850 5559 10091 3954 5520 2587 9870 3934 867 1265 1145 1154 1139 823 922 1405 804 1544 920 1411 16594 4985 16106 4494 3114 8044 8524 14363 3210 4565 5101 6924 1918 3162 2945 8621 550 2903 3126 8329 463 2574 4712 7570 637 14765 3594 3888 6850 2212 4351 3597 7545 2148 3867 6237 6185 2914 407 643 506 460 526 286 537 432 906 581 474 502 13146 1919 2670 12256 15354 1477 2945 13314 14852 1814 2810 14431 15844 1384 917 2099 1696 507 728 1705 1523 825 1563 1336 1877 13107 1965 1751 1396 1476 3393 1527 2573 2168 3835 2368 2192 1832 1213 1861 1838 2953 1214 1135 2818 4400 1610 2685 1977 2629 11457 13136 10126 8743 11717 9057 11012 9464 10147 15396 12599 8656 11991 1579 2184 4239 3291 1937 4492 4842 4597 3328 3692 5146 6583 11149 1537 849 1268 1056 848 1194 1184 850 1276 685 1181 483 692 678 890 172 1430 6815 320 220 480 1027 8009 243 7490 1716 1541 1727 4775 2131 3067 1225 2994 1696 2283 1590 3595 1791 893 1672 975 1380 1403 1853 1319 1066 1201 1330 1231 6646 25138 18424 35076 45648 22534 14766 35326 44717 37916 11727 37646 48596 2851 2441 2545 3940 3425 1726 3866 3928 4124 4765 3954 3267 6408 2293 6725 5579 4130 2919 5175 5549 5390 5307 12518 6513 3260 402 870 878 642 676 324 531 587 1063 631 701 954 6353 5546 2988 5803 10548 5858 3263 4295 7550 5161 3589 5781 4136 959 873 1941 8122 708 3987 2435 6893 1182 781 4238 1342 6292 6194 8479 7140 4838 11576 9801 7259 12464 19837 5292 6503 4424 1178 1624 1374 2244 989 674 2621 2071 1535 2497 1951 2852 5990 2663 6021 3268 1386 2111 4902 4116 3568 4658 2972 4564 3376 1143 3070 2873 1028 1678 1977 2647 1914 1216 4329 5085 1887 5269 25138 14964 35076 45648 22534 12111 35326 44717 37916 11727 37646 48596 1839 3415 4394 3940 3425 1726 2627 3928 4124 3610 3954 3267 5085 13510 14917 5779 3213 9386 14281 7291 3458 7958 11070 6142 3359 24813 4568 9971 1231 16483 4936 50656 1319 17958 6758 51617 2642 4983 4142 6231 3586 5317 6931 3219 5984 3144 8151 5791 3234 4999 344 454 1357 1147 336 105 609 1812 511 263 1395 1923 4928 23801 14757 26429 54349 29345 12147 18745 32796 23262 33884 19896 33451 4360 3568 15550 5847 4733 1735 14266 6576 6069 4067 5169 6112 4922 8998 3272 13797 22734 11212 4776 9272 13652 9751 12936 12161 10920 2941 1646 8922 1658 3313 1283 5224 1319 3582 1528 1684 2233 4877 2372 3365 5755 3493 3318 7278 3308 5697 4711 4838 5225 3161 537 1008 1757 1176 563 977 1457 1225 1212 1078 1251 903 4773 5770 43072 7565 4432 5938 8803 56516 6452 5296 5641 18667 5205 5282 4873 9436 708 4450 6472 8966 834 3003 5666 8009 727 4746 6618 13703 24264 56520 7400 18334 32203 59396 12010 19038 25707 60368 2444 2732 3196 911 1898 1539 3003 1371 2425 4541 2191 1659 4712 7931 7398 7341 3584 6018 6236 9855 6602 11248 6083 3869 7769 3410 2394 7275 1715 3338 5076 5641 1525 4321 3520 5968 1969 4550 14615 25682 14971 16496 18607 19140 21558 19782 35896 16277 17725 14566 2409 3791 3594 5566 2442 1648 2967 6415 3118 5129 4022 8810 4546 6660 14385 5389 3507 10848 7453 6701 3431 2416 5864 3853 5523 7758 8121 16159 1977 3888 8531 16585 2535 6689 11162 20070 1906 4541 194227 247423 245896 128734 313785 195991 140674 117093 350876 47038 100661 105318 15604 10119 32890 20937 10635 6681 37994 15216 20964 9883 17111 18983 4526 6074 5590 4532 2843 12390 4592 4476 3324 10139 5223 4380 3688 438 1309 776 843 445 887 694 1819 419 533 3156 4190 4219 6942 4960 3955 4473 3648 4415 4178 2573 5282 5604 3003 2544 8377 9657 17210 1378 9794 21103 8449 908 4988 8552 9273 1389 3618 1325 1350 1865 1553 1277 1063 2280 1570 2701 1683 1621 1151 1548 2671 1839 3057 1245 1222 2636 5213 935 7143 5098 6480 3219 52391 393473 13206 30488 43666 373577 84154 29338 103004 492186 82056 35457 19922 28491 64171 77072 28115 31259 80912 84588 39989 29562 39017 121313 3204 5820 6511 3689 8074 4241 13024 6176 3324 9904 9582 9492 4352 67958 108313 14175 918 70363 88818 18536 944 85518 133320 24935 1440 3175 7486 7145 5192 2451 7864 1987 4927 5831 10246 8037 4084 6054 1513 677 582 760 1572 6790 1325 1578 2811 1685 2186 1961 3166 5451 11683 5268 1363 6507 6729 10707 1499 6750 3240 6447 1202 1213 1355 2376 518 1550 3734 4174 723 1103 1931 2697 792 3143 2044 2115 2985 3710 2500 2171 1884 3773 3061 3933 1347 3095 18685 19184 18993 3392 20683 17251 27186 4783 20368 25746 12095 6559 2900 25857 39874 13068 23027 37853 51202 17506 19113 42368 46454 11939 17624 104479 134333 140708 30401 131272 130738 120434 36850 91063 167324 137623 53689 2788 10245 20302 12722 40417 9166 21327 15931 32851 13062 24488 16827 30688 1995 2852 3519 15470 2181 1973 4277 16723 3089 5378 2686 25944 2705 24781 55058 57674 117414 18966 52765 110034 108941 33518 56401 78980 132625 1795 6183 8389 27324 1878 3804 7656 37872 2275 10897 6423 51335 2674 1973 1871 1841 2252 1941 1569 971 2412 2402 1821 746 2120 1107 1423 1049 1495 1400 253 1081 2155 1611 1759 1522 2507 2575 3199 4137 4118 4017 6631 3846 4029 4607 5510 4315 7926 3452 793 1053 1942 1146 900 1261 1786 1523 535 2337 1636 4500 2439 15305 17896 9386 11766 30463 10567 21586 11913 31986 10608 15341 10071 6333 9620 10924 9496 9417 7560 12925 20645 9249 15877 10737 14725 2438 10411 58028 35038 41978 28093 51577 19086 66442 42866 35161 43618 35577 4107 4825 5331 9593 2837 2183 5486 15250 4684 7477 4975 17862 2403 5039 8661 5776 21222 5040 5784 12637 19467 15022 5032 19704 16830 1127 1725 1107 6678 1020 682 838 11516 1827 2053 1389 17630 2242 21707 50122 11672 43793 18986 52562 28323 65152 42143 59467 28249 43487 2645 10477 5412 31322 4317 2310 5024 32726 8861 13425 6084 41416 2233 27419 38893 31300 16586 25698 32193 40328 23334 17438 39378 54671 24729 3868 14513 9907 14997 14699 12359 7303 15016 11652 18745 27849 31750 2189 1641 2363 3503 6522 1941 2232 2665 4552 2035 1719 2164 3982 1478 1211 1443 1519 764 1717 1587 2714 1020 3072 2235 2296 2044 248724 188998 173724 2063 199408 113238 311663 1597 293504 15515 325395 1599 12383 27951 83236 1546 43391 65895 80133 1522 30912 41453 98827 1576 2032 10876 8810 6750 8219 9605 6044 6463 6983 13229 7563 6959 5479 8786 8977 19412 20467 8879 7318 23328 17700 7590 10943 17792 33296 2004 2455 2884 3347 7185 2465 4198 3136 9257 1547 2818 1465 7338 480 244 386 4803 482 123 619 4341 488 276 303 6295 1996 9833 12412 7468 9419 11676 8124 12119 6484 21615 6808 18412 6157 1970 1927 2745 16888 1339 2052 3873 19990 1941 2370 2124 21399 1838 9156 23642 26689 20806 10718 14640 36548 20655 14751 6464 53098 15909 2774 8389 5941 5805 3513 4974 7889 6945 2756 11096 5483 8662 1815 87492 81290 100377 53749 91458 62848 122603 75409 130724 50631 318152 88556 21633 20648 27573 32841 78980 12451 27702 53227 20790 26973 27262 55225 1771 2505 5840 4142 8733 2874 8552 3809 11551 3842 17964 4675 8704 58087 57707 147017 103560 51752 32465 96712 81028 62381 73521 71438 152590 1753 13834 21462 10498 25726 12155 10554 14537 28004 18044 9554 16709 27558 1449 1766 3109 3884 1652 1994 4407 5068 2053 5178 2297 7109 1719 11487 27291 16795 16546 8453 29953 17140 24456 14747 40939 20106 21439 1450 1056 2105 11996 1653 965 2388 14810 1579 1137 1770 27502 1715 43920 33003 27825 3268 44350 23091 27966 4446 52956 17137 24986 4017 4804 5389 10472 1057 4769 3963 11385 2456 6234 6516 6025 2490 1711 2721 3669 1603 3737 2814 2915 3475 2986 9295 3106 3274 2376 6771 5243 19847 13251 5171 3324 11963 11561 8005 6798 7485 19494 1704 12318 4967 7828 7781 18343 8801 16506 8164 9737 18726 10321 9235 2822 6520 3579 3754 1928 5604 3541 8962 6965 4687 4416 3484 1666 85975 605350 440088 1838093 89971 489313 415832 1811560 196132 440939 337929 1730191 42301 150792 165393 221719 40439 43753 159959 282107 79388 226864 107014 423083 1661 181710 47780 123871 47706 168017 52868 81798 152246 164017 11970 80194 190323 44410 75997 24806 52744 260650 41004 49397 51987 263614 43114 45860 113677 1380 7993 8050 9082 11920 6681 6139 20562 9623 16736 6350 21008 6681 70521 106651 47072 34701 75441 69376 13515 55650 47878 138421 110999 50520 782 1766 39536 6536 1115 2999 71130 9104 1904 2570 125657 6915 1291 438 19241 54511 303 4083 1713 36370 498 6393 22676 51170 462 592 3943 2853 2546 2406 2884 3034 3294 2703 5203 3114 2443 3024 6692 7476 9628 2452 5299 6265 4075 3911 3879 13840 9772 5942 479 5721 9368 9392 11180 5229 8408 15183 10937 8778 9140 15662 14375 10829 14115 4043 11200 11299 9064 15043 18616 14131 27567 24748 24348 448 12800 9255 8156 5867 11307 3177 16819 3431 17167 2620 20661 3582 790 1700 3045 5930 913 1430 4609 7022 1837 866 2641 10496 307 68872 87070 33262 12060 73256 120687 46862 36916 120898 82747 16262 23825 238893 257614 373918 81979 235952 155414 307620 83846 276357 279274 330813 205983 168 21566 20320 47815 30217 42863 21411 6476 3745 53091 25835 11382 37156 2856 4653 7515 2646 3105 1853 5492 13044 4600 3369 3256 11006 136 1147 1654 1741 1340 1507 3015 2182 1841 1832 1257 2062 1171 5523 5714 6116 1917 5964 4930 4160 3310 5590 5896 5187 2851 91 96553 71710 74711 90903 103723 56575 66568 81007 112537 96915 60995 66131 29610 23151 91130 30211 23007 19753 54793 43979 63421 20121 23579 73543 39 195436 220069 161748 176304 218988 183991 237451 165221 377120 165149 214899 163364 71775 75535 65898 50262 50084 15310 70089 61034 62373 81437 83838 94514 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name xylose xanthine valine uridine urea uracil tyrosine tryptophan trehalose thymine threonine tartaric acid tagatose succinic acid sophorose serine salicylaldehyde ribulose-5-phosphate ribose-5-phosphate ribose ribitol pyrrole-2-carboxylic acid pyrophosphate pyrogallol putrescine proline phosphoenolpyruvate phosphate phenylpyruvate phenylalanine pelargonic acid pantothenic acid palmitoleic acid oxoproline oxalic acid orotic acid ornithine oleic acid O-acetylserine norvaline nicotinic acid nicotinamide N-carbamoylaspartate N-acetylputrescine N-acetylornithine n-acetyl-d-hexosamine N-acetylaspartic acid myristic acid montanic acid monomyristin methionine maltotriitol maltose malic acid lyxose lyxitol lysine levoglucosan leucine lactic acid isothreonic acid isomaltose isoleucine inosine indole-3-lactate homoserine hexose-6-phosphate hexose heptadecanoic acid guanine glycolic acid glycine glycerol-alpha-phosphate glyceric acid glutathione glutaric acid glutamine glutamate glucose-6-phosphate glucose-1-phosphate glucose gluconic acid gamma-aminobutyric acid galactose-6-phosphate fumaric acid fucose fructose-6-phosphate fructose ethanol phosphate NIST erythrose erythritol dodecanol cytosin cytidine-5-monophosphate cysteine-glycine cysteine cyanoalanine citrulline citric acid citramalic acid catechol caprylic acid capric acid butyrolactam NIST beta-glycerolphosphate beta-alanine benzoic acid aspartic acid asparagine aminomalonate alpha-aminoadipic acid alloxanoic acid NIST alanine-alanine alanine adipic acid adenosine adenine 6-deoxyglucose 5'-deoxy-5'-methylthioadenosine 5-aminovaleric acid 4-hydroxyphenylacetic acid 4-hydroxybutyric acid 4-hydroxybenzoate 3-phenyllactic acid 3-hydroxybutyric acid 3,6-anhydro-D-galactose 3,4-dihydroxycinnamic acid 2-picolinic acid 2-methylglyceric acid NIST 2-ketoisovaleric acid 2-ketoisocaproic acid 2-isopropylmalic acid 2-hydroxyglutaric acid 2-hydroxybutanoic acid 2-aminobutyric acid 2,5-dihydroxypyrazine NIST 1-monostearin 1-monopalmitin 1-monoolein 1-methylgalactose NIST 1,2,4-benzenetriol 346945 346935 346922 346914 346911 346904 346898 346897 346890 346884 346881 346794 346684 345420 345404 345403 345278 345144 345139 344959 344793 344756 342876 342038 341991 341678 329435 328853 328852 328829 328824 327614 327580 327312 324892 324843 324429 324277 321077 321064 320849 320847 317497 253506 253093 251689 247758 241681 237287 229602 229311 229167 228818 228477 228466 228373 226546 224253 224096 224095 223405 223298 223250 223222 223192 223154 223120 223100 223080 222303 222288 220224 219979 217651 215683 212828 212751 210993 210986 210682 210457 210403 210343 210292 210280 210276 210272 210262 210229 209687 209677 209671 209171 209167 199109 189361 187055 172625 172041 171070 170468 170242 170237 170069 169627 169611 169610 168764 168759 163872 161388 161376 160221 146585 145865 135619 135260 133943 133907 133706 133616 133612 133605 133504 133407 131618 131106 130741 129225 128091 128089 126709 126391 126354 126345 125897 125800 125468 125452 124590 124293 122191 121028 120980 120744 120562 120466 119167 119129 119036 119023 118125 118071 117785 117482 117201 115895 113534 111255 110985 110669 110647 110641 110639 110501 110389 110359 110345 110328 110315 110289 110183 110182 110170 109995 109386 108950 108312 108309 108306 107960 106935 106927 106629 105538 105415 105071 104928 104918 104917 104915 104914 104312 104022 103870 102728 102716 102715 102232 102223 101742 100841 100326 100114 100099 99877 98053 98027 97753 97708 96537 95440 95438 95422 94724 94586 94582 92740 92689 88907 88058 88055 87312 87282 85003 84223 84216 84213 84161 84088 66437 64527 62409 62327 62264 62250 47561 47358 46207 45378 43100 42914 42424 42074 41882 41836 39801 34183 34174 34115 33386 32158 31224 27145 26062 23001 22444 21885 21817 21704 21683 18520 18488 18386 18310 18266 18226 18225 18177 18173 17664 17537 17463 17297 17267 17252 17233 17002 16980 16792 16747 16594 14765 13146 13107 11457 11149 7490 6646 6408 6353 6292 5990 5269 5085 4983 4928 4922 4877 4773 4746 4712 4550 4546 4541 4526 4219 3618 3219 3204 3175 3166 3143 2900 2788 2705 2674 2575 2439 2438 2403 2242 2233 2189 2044 2032 2004 1996 1838 1815 1771 1753 1719 1715 1711 1704 1666 1661 1380 782 592 479 448 307 168 136 91 39 METABOLITES_END #END