#METABOLOMICS WORKBENCH JtenHoeve_20220129_140548 DATATRACK_ID:3056 STUDY_ID:ST002069 ANALYSIS_ID:AN003378 PROJECT_ID:PR001311 VERSION 1 CREATED_ON February 1, 2022, 10:15 am #PROJECT PR:PROJECT_TITLE Molecular alterations caused by mitochondrial alternative oxidase (AOX) PR:PROJECT_TITLE expression in Drosophila melanogaster development PR:PROJECT_SUMMARY Whole-body metabolome of AOX-expressing and control larvae of Drosophila PR:PROJECT_SUMMARY melanogaster cultured on standard (SD) and low-nutrient (LN) diets PR:INSTITUTE Tampere University PR:DEPARTMENT Faculty of Medicine and Health Technology PR:LAST_NAME Dufour PR:FIRST_NAME Eric PR:ADDRESS Arvo Ylpön katu 34, 33520 Tampere, Finlândia PR:EMAIL eric.dufour@tuni.fi PR:PHONE +358 (0)50 413 0493 PR:FUNDING_SOURCE European Union (Marie Curie International Incoming Fellowship GA328988 #STUDY ST:STUDY_TITLE Systemic impact of the expression of the mitochondrial alternative oxidase on ST:STUDY_TITLE Drosophila development ST:STUDY_SUMMARY Despite the beneficial effects shown when the mitochondrial alternative oxidase ST:STUDY_SUMMARY AOX from Ciona intestinalis (Tunicata: Ascidiacea) is xenotopically expressed in ST:STUDY_SUMMARY mammalian and insect models, important detrimental outcomes have also been ST:STUDY_SUMMARY reported, raising concerns regarding its envisioned deployment as a therapy ST:STUDY_SUMMARY enzyme for human mitochondrial and related diseases. We have shown previously ST:STUDY_SUMMARY that AOX-expressing flies present a dramatic drop in pupal viability when the ST:STUDY_SUMMARY larvae are cultured on a low nutrient (LN) diet, indicating that AOX interferes ST:STUDY_SUMMARY with normal developmental metabolism. Here, we applied the metabolomics approach ST:STUDY_SUMMARY to gain insights into the molecular basis of the fatal developmental interaction ST:STUDY_SUMMARY between AOX expression and LN diet. We investigated the whole-body metabolome of ST:STUDY_SUMMARY AOX-expressing and control larvae cultured on SD and LN diets. ST:INSTITUTE Tampere University ST:DEPARTMENT Faculty of Medicine and Health Technology ST:LAST_NAME Dufour ST:FIRST_NAME Eric ST:ADDRESS Arvo Ylpön katu 34, 33520 Tampere, Finlândia ST:EMAIL eric.dufour@tuni.fi ST:PHONE +358 (0)50 413 0493 #SUBJECT SU:SUBJECT_TYPE Insect SU:SUBJECT_SPECIES Drosophila melanogaster SU:TAXONOMY_ID 7227 SU:AGE_OR_AGE_RANGE 3rd instar larvae #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 - SS-001 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Standard (SD) | Condition:C RAW_FILE_NAME=SS-001.mzXML SUBJECT_SAMPLE_FACTORS - SS-002 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Standard (SD) | Condition:C RAW_FILE_NAME=SS-002.mzXML SUBJECT_SAMPLE_FACTORS - SS-003 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Standard (SD) | Condition:C RAW_FILE_NAME=SS-003.mzXML SUBJECT_SAMPLE_FACTORS - SS-004 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Standard (SD) | Condition:C RAW_FILE_NAME=SS-004.mzXML SUBJECT_SAMPLE_FACTORS - SS-005 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Standard (SD) | Condition:C RAW_FILE_NAME=SS-005.mzXML SUBJECT_SAMPLE_FACTORS - SS-007 Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Standard (SD) | Condition:AOX RAW_FILE_NAME=SS-007.mzXML SUBJECT_SAMPLE_FACTORS - SS-008 Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Standard (SD) | Condition:AOX RAW_FILE_NAME=SS-008.mzXML SUBJECT_SAMPLE_FACTORS - SS-009 Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Standard (SD) | Condition:AOX RAW_FILE_NAME=SS-009.mzXML SUBJECT_SAMPLE_FACTORS - SS-010 Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Standard (SD) | Condition:AOX RAW_FILE_NAME=SS-010.mzXML SUBJECT_SAMPLE_FACTORS - SS-011 Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Standard (SD) | Condition:AOX RAW_FILE_NAME=SS-011.mzXML SUBJECT_SAMPLE_FACTORS - SS-014 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN RAW_FILE_NAME=SS-014.mzXML SUBJECT_SAMPLE_FACTORS - SS-015 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN RAW_FILE_NAME=SS-015.mzXML SUBJECT_SAMPLE_FACTORS - SS-016 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN RAW_FILE_NAME=SS-016.mzXML SUBJECT_SAMPLE_FACTORS - SS-017 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN RAW_FILE_NAME=SS-017.mzXML SUBJECT_SAMPLE_FACTORS - SS-018 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN RAW_FILE_NAME=SS-018.mzXML SUBJECT_SAMPLE_FACTORS - SS-019 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN RAW_FILE_NAME=SS-019.mzXML SUBJECT_SAMPLE_FACTORS - SS-020 Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN RAW_FILE_NAME=SS-020.mzXML SUBJECT_SAMPLE_FACTORS - SS-021 Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Low Nutrient (LN) | Condition:LN-AOX RAW_FILE_NAME=SS-021.mzXML SUBJECT_SAMPLE_FACTORS - SS-023 Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Low Nutrient (LN) | Condition:LN-AOX RAW_FILE_NAME=SS-023.mzXML SUBJECT_SAMPLE_FACTORS - SS-024 Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Low Nutrient (LN) | Condition:LN-AOX RAW_FILE_NAME=SS-024.mzXML SUBJECT_SAMPLE_FACTORS - SS-025 Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Low Nutrient (LN) | Condition:LN-AOX RAW_FILE_NAME=SS-025.mzXML SUBJECT_SAMPLE_FACTORS - blank1 Genotype of fly lines:- | Genotype Shorthand:- | Diet:- | Condition:- RAW_FILE_NAME=blank1.mzXML SUBJECT_SAMPLE_FACTORS - blank2 Genotype of fly lines:- | Genotype Shorthand:- | Diet:- | Condition:- RAW_FILE_NAME=blank2.mzXML SUBJECT_SAMPLE_FACTORS - blank3 Genotype of fly lines:- | Genotype Shorthand:- | Diet:- | Condition:- RAW_FILE_NAME=blank3.mzXML #COLLECTION CO:COLLECTION_SUMMARY Ten randomly selected, wandering L3 larvae (100-115 hrs post-egg laying in SD CO:COLLECTION_SUMMARY diet; 125-140 hrs in LN diet) per biological replica (5 in total) were CO:COLLECTION_SUMMARY collected, briefly rinsed in ultrapure water, and flash-frozen in liquid N2. CO:SAMPLE_TYPE Larvae #TREATMENT TR:TREATMENT_SUMMARY The fly lines were maintained on a standard (SD) or a low-nutrient (LN) diet, TR:TREATMENT_SUMMARY with a 12/12h of light/dark photoperiod cycle at 25 °C. The eggs were allowed TR:TREATMENT_SUMMARY to develop until reaching the wandering L3 larval stage for collection. The LN TR:TREATMENT_SUMMARY diet consisted of 3.5% yeast extract, 1% agar, and antimicrobials (0.1% nipagin TR:TREATMENT_SUMMARY and 0.5% propionic acid). #SAMPLEPREP SP:SAMPLEPREP_SUMMARY : Frozen larvae were homogenized in 1 ml cold (-80 °C) 80% methanol on dry ice SP:SAMPLEPREP_SUMMARY using a probe homogenizer. Samples were clarified by centrifugation for 5 min at SP:SAMPLEPREP_SUMMARY 16,000 x gmax at 4 °C and the supernatants were transferred to new Eppendorf SP:SAMPLEPREP_SUMMARY tubes. The remaining pellets were resuspended in RIPA lysis buffer and total SP:SAMPLEPREP_SUMMARY protein content was determined by the BCA method. A volume of the supernatant SP:SAMPLEPREP_SUMMARY equivalent to 5 µg of protein was transferred to a glass vial, dried using an SP:SAMPLEPREP_SUMMARY EZ-2 Elite evaporator (SP Scientific), and stored at -80 °C until analysis by SP:SAMPLEPREP_SUMMARY LC-MS. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY Separation was achieved using a linear gradient from 15% to 90% A over 18 min. CH:CHROMATOGRAPHY_SUMMARY This was followed by an isocratic step at 90% A for 9 min and re-equilibration CH:CHROMATOGRAPHY_SUMMARY to the initial 15% A for 7 min. CH:CHROMATOGRAPHY_TYPE HILIC CH:INSTRUMENT_NAME UltiMate 3000RSLC HPLC (Thermo Scientific) CH:COLUMN_NAME Phenomenex Luna NH2 3 μm 100A (150 mm x 2 mm) CH:FLOW_RATE 200 ul/min CH:COLUMN_TEMPERATURE 27 C CH:SOLVENT_A 5 mM ammonium acetate, pH 9.9 CH:SOLVENT_B 100% acetonitrile #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Orbitrap MS:INSTRUMENT_TYPE Ion trap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS MS1 scan range 65-975 m/z. MS/MS with inclusion list; target others when idle. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS intensity (area under the curve) MS_METABOLITE_DATA_START Samples SS-001 SS-002 SS-003 SS-004 SS-005 SS-007 SS-008 SS-009 SS-010 SS-011 SS-014 SS-015 SS-016 SS-017 SS-018 SS-019 SS-020 SS-021 SS-023 SS-024 SS-025 blank1 blank2 blank3 Factors Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Standard (SD) | Condition:C Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Standard (SD) | Condition:C Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Standard (SD) | Condition:C Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Standard (SD) | Condition:C Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Standard (SD) | Condition:C Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Standard (SD) | Condition:AOX Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Standard (SD) | Condition:AOX Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Standard (SD) | Condition:AOX Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Standard (SD) | Condition:AOX Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Standard (SD) | Condition:AOX Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN Genotype of fly lines:2/2;daGAL4/daGAL4 | Genotype Shorthand:C | Diet:Low Nutrient (LN) | Condition:LN Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Low Nutrient (LN) | Condition:LN-AOX Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Low Nutrient (LN) | Condition:LN-AOX Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Low Nutrient (LN) | Condition:LN-AOX Genotype of fly lines:UAS-AOXwtF6/2; daGAL4/3 | Genotype Shorthand:AOX | Diet:Low Nutrient (LN) | Condition:LN-AOX Genotype of fly lines:- | Genotype Shorthand:- | Diet:- | Condition:- Genotype of fly lines:- | Genotype Shorthand:- | Diet:- | Condition:- Genotype of fly lines:- | Genotype Shorthand:- | Diet:- | Condition:- 2-Aminobutyric acid 426890 484469 638762 926955 436251 1070183 394434 366512 483931 426216 97685 339914 92000 101738 104150 97849 274388 131548 147437 102535 188928 0 0 0 5'-Methylthioadenosine 21472 30659 62745 58106 41214 142881 84658 67628 97712 123495 22900 80133 62710 38512 9564 58819 78158 57593 46242 14421 72060 0 0 0 CAR 2:0 1554073 2466362 2364188 3933847 2197177 4474820 2242407 1964228 1407036 2024142 1819660 3126174 2386792 2943625 1822963 2548774 2519210 2765188 1686152 1754701 3341832 0 0 0 Acetylcholine 0 0 12644 6942 6556 46380 7707 16884 26608 21841 0 22384 0 0 0 0 18247 0 0 0 0 0 0 0 Adenine 29197 10105 15710 78468 25904 127187 42993 26835 32765 58242 0 0 0 11026 0 28645 8845 0 22314 9893 7240 0 0 0 Adenosine 570271 729668 614074 1903753 1179901 1366039 311575 537004 563332 709527 187423 264217 246829 234968 117500 320076 382408 130706 403847 217978 204130 0 0 0 Alanine 3273717 5744916 5741274 13168780 5782754 13719141 5548380 5396724 5015296 7395170 1758029 4838128 2548902 2950673 1657349 4449068 6528998 3066241 5141743 3018136 5367654 0 0 0 AMP 350523 345176 492636 601105 545856 812943 359823 370517 392704 558092 486844 674007 534093 593395 376659 1277435 1095942 490209 801908 533133 451004 0 0 0 Arginine 12286499 14144991 15227092 16928530 15639625 26717002 16545156 16007795 15338651 21104218 18070274 19093956 17000034 20214102 11472676 21459696 23559488 18058590 18651894 16144623 19332416 0 0 0 Carnitine 2768390 2596204 2845009 3417246 3282007 4110599 3103815 2913562 2575049 3953821 5789168 5454522 4202586 5286258 2935282 7728260 6962694 4546098 5633906 4339963 4052866 0 0 0 Citrulline 10925 485564 47859 43129 101136 140928 81203 73791 159031 233722 130902 183142 124732 95138 36500 13193 128028 62298 49536 19242 89806 0 0 0 Cystathionine 24261 72217 23758 145618 48460 61617 23136 64265 27963 21661 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Cytidine 97835 83426 135115 238410 138361 387775 84329 170098 173087 262551 134852 255036 103674 185471 97684 325359 300227 78723 379056 166814 114684 0 0 0 Cytosine 13488 22110 18290 68044 29368 0 0 6919 0 6841 24726 7530 27165 0 11575 0 116259 14353 0 6840 15916 0 0 0 gamma-Aminobutyric acid 355505 714019 617769 3088260 777949 359718 165120 103848 69653 113158 8978 129131 26056 0 10130 39085 245293 19792 53964 46645 27207 0 0 0 Glycine 59564 128156 115576 463174 136151 478811 305739 158779 161567 247574 81654 252622 124331 111737 53465 149749 368739 165764 188754 183357 186920 0 0 0 Guanosine 239815 345873 314570 279065 319898 509479 258669 319390 382694 480882 89092 52555 156194 113781 77200 91984 118502 50446 211086 39143 46446 0 0 0 Histidine 14388989 17952726 18971338 23004786 20734144 32989950 15640659 18914556 21686276 23666416 6313988 6110110 5652148 7648192 2953259 9351768 4634574 9004852 7953090 6377652 9087601 0 0 0 Hypoxanthine 89831 191099 112842 90062 142755 369288 137197 135506 178066 370112 49631 105276 58757 164472 62642 164488 101176 79247 307823 243565 177341 0 0 0 Inosine 717642 928701 1161407 1248576 1298142 1979681 956829 992246 1228688 1784916 302055 323349 336185 1040009 256491 464068 484440 263705 1140118 544769 354229 0 0 0 Leucine 4375218 5276642 5748396 11281688 7072102 13993392 6532556 6821548 8602841 9753209 2801753 4405226 3979812 2983385 1854371 3292883 5210232 4142227 4695826 3959337 4562794 0 0 0 Lysine 2593533 4558132 3599962 6395432 5712278 6384946 3202830 4108755 4512198 4679288 1376923 2910670 2272419 1541942 1197002 1599319 2017735 1932048 2419988 1681134 2653285 0 0 0 Methionine 1682628 1919990 2310258 2872041 2143480 4995718 4452092 4110677 3795895 4894498 1270200 1925842 1712275 1267807 917339 2174726 1729783 1915509 2048082 1435823 2327902 0 0 0 N-Acetyl-D-glucosamine 8581 17310 42159 303284 135280 925911 514565 308604 608664 780750 12177 0 0 0 0 0 13463 0 0 0 0 0 0 0 NAD+ 23339 46084 22207 27576 22431 55783 40755 41009 30364 32906 123632 24121 47374 103925 21859 83342 125988 118453 23140 77489 86348 0 0 0 Ornithine 70278 150394 150131 397108 324707 394485 190670 166445 167513 135957 12782 0 13295 18202 0 0 0 11199 8445 0 25467 0 0 0 Phenylalanine 3412277 4574116 3867383 4567356 4524330 9611286 5850304 6437058 7258314 8748817 4693024 5064542 5219390 4444800 3104743 4842452 5862690 4895308 5672086 4388762 5191154 0 0 0 Choline phosphate 599451 998002 713954 807691 967340 1708762 982125 876508 1664307 1444116 1567746 960350 1171704 931739 655400 1024060 967589 3817666 1479175 2086821 3359140 0 0 0 Proline 21962138 26976670 30811822 47367212 32759326 53383420 29588306 28608598 30137962 36212996 31626970 45782800 29553712 34809708 20970810 54388492 47577740 36543952 32506766 27033482 37493316 0 0 0 S-Adenosylmethionine 77988 91532 168901 132252 77883 243772 242573 204052 265650 289529 171998 209364 154131 116706 45460 209182 90725 168264 161549 66930 131277 0 0 0 Sarcosine 1392824 1888638 2166538 7780640 1979318 5834774 2398264 1907926 1534782 2384450 811900 2711853 1091559 710083 570030 1429698 2241470 1048457 1953121 741404 1595195 0 0 0 Threonine 867229 1136836 1398030 2689850 1724209 3116624 1410581 1570953 1284141 1560079 440677 1216402 734905 510927 316572 448814 1127754 817307 842165 597636 943162 0 0 0 Tryptophan 1373328 2089736 1826850 2667319 2266525 3844470 2602282 2778155 2444135 2869563 1767083 1902449 2036196 1803096 1154629 1276620 2230542 2249321 2136430 1728605 1858309 0 0 0 Tyrosine 13572820 9172679 10404097 10963459 10276900 21027172 19407986 18084318 13790991 28184710 62405148 50426484 45588032 50147392 34075200 50433108 58697588 40293048 58921484 60181456 40077072 0 0 0 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name Alt.name Formula KEGG.ID Sub class Retention time MS mode 2-Aminobutyric acid 2-Aminobutyrate C4H9NO2 C02356 Amino FA 7.3 pos 5'-Methylthioadenosine 5'-Methylthioadenosine C11H15N5O3S C00170 Purine ribonucleosides 2.8 pos Acetylcholine Acetylcholine C7H16NO2 C01996 Acyl cholines 4 pos Adenine Adenine C5H5N5 C00147 6-aminopurines 5.3 pos Adenosine Adenosine C10H13N5O4 C00212 Purine ribonucleosides 4.1 pos Alanine Alanine C3H7NO2 C00041 Amino acids 7.4 pos AMP AMP C10H14N5O7P C00020 Purine rNMP 16.5 pos Arginine Arginine C6H14N4O2 C00062 Amino acids 9.5 pos CAR 2:0 Acetylcarnitine C9H17NO4 C02571 Acyl carnitines 5.2 pos Carnitine Carnitine C7H15NO3 C00318 Carnitines 6.8 pos Choline phosphate Phosphocholine C5H14NO4P C00588 Cholines 13.3 pos Citrulline Citrulline C6H13N3O3 C00327 Amino acids 8.2 pos Cystathionine Cystathionine C7H14N2O4S C02291 Amino acids 12.8 pos Cytidine Cytidine C9H13N3O5 D07769 Pyrimidine ribonucleosides 5.2 pos Cytosine Cytosine C4H5N3O C00380 Pyrimidones 4.3 pos gamma-Aminobutyric acid GABA C4H9NO2 C00334 Amino FA 8.1 pos Glycine Glycine C2H5NO2 C00037 Amino acids 8 pos Guanosine Guanosine C10H13N5O5 C00387 Purine ribonucleosides 7.3 pos Histidine Histidine C6H9N3O2 C00135 Amino acids 8.8 pos Hypoxanthine Hypoxanthine C5H4N4O C00262 Hypoxanthines 7.5 pos Inosine Inosine C10H12N4O5 C00294 Purine ribonucleosides 8.1 pos Leucine Leucine-Isoleucine C6H13NO2 C00123 Amino acids 5.7 pos Lysine Lysine C6H14N2O2 C00047 Amino acids 10.6 pos Methionine Methionine C5H11NO2S C00073 Amino acids 6.9 pos N-Acetyl-D-glucosamine N-Acetylglucosamine C8H15NO6 C00140 Acylaminosugars 5.1 pos NAD+ NAD+ C21H28N7O14P2 C00003 Nicotinamide dinucleotides 12.4 pos Ornithine Ornithine C5H12N2O2 C00077 Amino acids 10.3 pos Phenylalanine Phenylalanine C9H11NO2 C00079 Amino acids 6.6 pos Proline Proline C5H9NO2 C00148 Amino acids 6.9 pos S-Adenosylmethionine S-Adenosyl-L-methionine C15H23N6O5S C00019 Glycosylamines 8 pos Sarcosine Sarcosine C3H7NO2 C00213 Amino acids 7.9 pos Threonine Threonine C4H9NO3 C00188 Amino acids 8.2 pos Tryptophan Tryptophan C11H12N2O2 C00078 Amino acids 6.8 pos Tyrosine Tyrosine C9H11NO3 C00082 Amino acids 8 pos METABOLITES_END #END