Metabolite_name RefMet_name S1_0080 S1_0081 S1_0082 S1_0083 S1_0084 S1_0085 S1_0086 S1_0087 S1_0088 S1_0089 S1_0090 S1_0091 S1_0092 S1_0093 S1_0094 S1_0076 S1_0079 S1_0002 S1_0003 S1_0004 S1_0005 S1_0006 S1_0007 S1_0008 S1_0028 S1_0029 S1_0039 S1_0040 S1_0041 S1_0054 S1_0055 S1_0056 S1_0069 S1_0070 S1_0071 S1_0075 S1_0078 S1_0033 S1_0034 S1_0035 S1_0048 S1_0049 S1_0050 S1_0063 S1_0064 S1_0065 S1_0036 S1_0037 S1_0038 S1_0051 S1_0052 S1_0053 S1_0066 S1_0067 S1_0068 S1_0001 S1_0030 S1_0031 S1_0032 S1_0045 S1_0046 S1_0047 S1_0060 S1_0061 S1_0062 S1_0077 S1_0042 S1_0043 S1_0044 S1_0057 S1_0058 S1_0059 S1_0072 S1_0073 S1_0074 S1_0010 S1_0011 S1_0012 S1_0013 S1_0014 S1_0015 S1_0016 S1_0017 S1_0009 S1_0019 S1_0020 S1_0021 S1_0022 S1_0023 S1_0024 S1_0025 S1_0026 S1_0027 S1_0018 S1_0110 S1_0111 S1_0112 S1_0113 S1_0114 S1_0115 S1_0116 S1_0117 S1_0118 S1_0119 S1_0120 S1_0121 S1_0122 S1_0123 S1_0124 S1_0095 S1_0096 S1_0097 S1_0098 S1_0099 S1_0100 S1_0101 S1_0102 S1_0103 S1_0104 S1_0105 S1_0106 S1_0107 S1_0108 S1_0109 Factors - Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC15;0/18;1-d7 | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:18O2 air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:18O2 air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, AAPH | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/18;2, Autoxidation | Treatment times:24h | Air conditions:normal air Treatments:PC16;0/18;2, Autoxidation | Treatment times:24h | Air conditions:normal air Treatments:PC16;0/18;2, Autoxidation | Treatment times:24h | Air conditions:normal air Treatments:PC16;0/18;2, Autoxidation | Treatment times:24h | Air conditions:normal air Treatments:PC16;0/18;2, Autoxidation | Treatment times:24h | Air conditions:normal air Treatments:PC16;0/18;2, Autoxidation | Treatment times:24h | Air conditions:normal air Treatments:PC16;0/18;2, Autoxidation | Treatment times:24h | Air conditions:normal air Treatments:PC16;0/18;2, Autoxidation | Treatment times:24h | Air conditions:normal air Treatments:PC16;0/18;2, Autoxidation | Treatment times:24h | Air conditions:normal air Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/18;2, CuSO4+AsA | Treatment times:72h | Air conditions:normal air Treatments:PC16;0/18;2, CuSO4+AsA | Treatment times:72h | Air conditions:normal air Treatments:PC16;0/18;2, CuSO4+AsA | Treatment times:72h | Air conditions:normal air Treatments:PC16;0/18;2, CuSO4+AsA | Treatment times:72h | Air conditions:normal air Treatments:PC16;0/18;2, CuSO4+AsA | Treatment times:72h | Air conditions:normal air Treatments:PC16;0/18;2, CuSO4+AsA | Treatment times:72h | Air conditions:normal air Treatments:PC16;0/18;2, CuSO4+AsA | Treatment times:72h | Air conditions:normal air Treatments:PC16;0/18;2, CuSO4+AsA | Treatment times:72h | Air conditions:normal air Treatments:PC16;0/18;2, CuSO4+AsA | Treatment times:72h | Air conditions:normal air Treatments:PC16;0/20;4, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/20;4, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/20;4, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/20;4, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/20;4, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/20;4, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/20;4, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/20;4, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/20;4, control | Treatment times:no treatment | Air conditions:- Treatments:PC16;0/22;6, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/22;6, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/22;6, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/22;6, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/22;6, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/22;6, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/22;6, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/22;6, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/22;6, AAPH+hemin | Treatment times:4h | Air conditions:normal air Treatments:PC16;0/22;6, control | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard oxPCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- Treatments:Standard PCs | Treatment times:no treatment | Air conditions:- PC15:0/18:1(d7) PC(1)* 4073867 3415956 2950358 19794246 20369506 20133248 44990505 43528364 43707353 266105352 253394116 256068737 527790672 543116642 530371198 PC16:0/14:0 PC16:0/14:0* 4132857 4273958 4295079 29679941 30300211 31599179 68797224 72859466 73998532 399001565 397573553 405325752 824578926 845945743 866175836 PC16:0/18:0 PC 16:0/18:0 5196149 5456521 5731326 35800556 38406522 36489087 85371500 86464638 85045899 463746812 466838143 460221127 990961987 1006388324 1032609716 PC16:0/18:1 PC 16:0/18:1 5632300 5381288 5262468 33104068 33540155 33893831 79561559 78561412 80793043 432036129 424046596 433719421 898180237 902169407 899669947 PC16:0/2:0 PC 16:0/2:0 6084185 6327893 6284650 39294705 39511738 40728462 90808229 89121352 90594651 493926929 487201735 524590464 1050543101 1062619850 1067049080 PC16:0/5:0;5oxo 4434941 4587121 4424582 26435620 30255752 26820397 54998120 56422050 56292506 330218947 315911465 309177923 585985127 583986520 590678172 PC16:0/9:0;9oxo 5796844 6110182 5597067 32370828 36913641 33593362 66899080 67316116 66660957 396121454 372319717 363395410 714494395 711647105 701507879 PC24:0 PC 24:0 0.1799 0.1736 0.1695 0.1953 0.2021 0.1964 0.1478 0.1479 0.1564 0.1347 0.1390 0.1455 1.4179 1.3481 1.3438 PC24:0;COOH 1.5538 1.5751 1.5351 0.0867 0.0883 0.0871 0.2403 0.2520 0.2449 0.0194 0.0219 0.0212 1.1618 1.1640 1.1523 PC24:0;O PC(O)* 4.7504 4.6733 4.4881 0.4714 0.4769 0.4549 0.5140 0.4973 0.5019 0.0042 0.0043 0.0042 8.2481 8.1203 8.1785 PC24:0;O2 PC(2)* 0.0696 0.0606 0.0590 5.4405 5.6379 5.3124 1.7183 1.6663 1.6639 0.0018 0.0017 0.0014 10.9056 10.9790 10.7155 PC24:1;O PC 24:1;O 13.4430 13.7791 12.7678 1.7875 1.8695 1.8030 1.0973 1.0255 1.0340 0.0112 0.0089 0.0102 11.7962 10.9026 10.7838 PC25:0;COOH 11.0131 11.0582 10.2521 1.6396 1.7456 1.7481 2.2711 2.2609 2.2670 0.0322 0.0301 0.0313 9.1777 8.3474 8.5294 PC25:1;O PC 25:1;O 40.7761 39.8999 38.3740 72.2168 77.7543 75.3718 7.2646 7.3506 7.2146 0.3428 0.3229 0.3487 66.6306 64.7443 65.3589 PC26:0;O3 PC(3)* 0.0014 0.0154 0.0149 0.5567 0.4707 0.4660 0.0295 0.0238 0.0255 0.0493 0.0465 0.0562 0.0149 0.0191 0.0265 PC26:1;COOH 1.4376 1.3920 1.2935 0.5606 0.5911 0.5542 0.1542 0.1528 0.1509 0.0007 0.0006 0.0008 0.5461 0.5421 0.5249 PC26:1;O3 PC(3)* 0.2339 0.2293 0.2176 1.6641 1.7789 1.6896 0.4153 0.3930 0.4019 0.0079 0.0085 0.0087 0.5380 0.5552 0.5565 PC26:1;O;COOH 0.3099 0.3158 0.3021 0.0420 0.0416 0.0473 0.0481 0.0473 0.0494 0.0022 0.0025 0.0030 0.1077 0.1101 0.1092 PC26:2;O PC 26:2;O 3.0825 3.0504 2.9281 0.3698 0.3984 0.3888 0.1722 0.1671 0.1788 0.0020 0.0015 0.0014 1.3778 1.3631 1.3632 PC27:1;O2 PC 27:1;O2 0.4130 0.0422 0.3999 1.0352 1.1306 1.1254 0.1329 0.1340 0.1372 0.0032 0.0023 0.0029 0.4434 0.4153 0.4497 PC27:1;O;COOH 1.2350 1.2307 1.1750 0.2809 0.2869 0.2955 0.2627 0.2594 0.2573 0.0002 0.0002 0.0001 0.7246 0.7538 0.7691 PC27:2;O PC 27:2;O 3.1945 3.1451 3.0458 6.6544 6.8897 6.4347 1.6940 1.6884 1.7723 0.0284 0.0262 0.0264 4.2648 4.1846 4.1357 PC27:2;O2 PC 27:2;O2 1.8871 1.8693 1.8045 1.2333 1.3602 1.3251 0.5242 0.5130 0.5196 0.0010 0.0007 0.0007 3.7474 3.6902 3.6720 PC27:2;O;COOH 0.0578 0.0543 0.0517 0.0428 0.0412 0.0408 0.0242 0.0239 0.0236 0.1124 0.1111 0.1142 PC28:1;O2;COOH 0.2794 0.2770 0.2581 0.8857 0.9350 0.8952 0.2920 0.3004 0.3077 0.0009 0.0015 0.0015 0.4607 0.4489 0.4630 PC28:2;O PC 28:2;O 0.4282 0.4230 0.0402 6.9529 7.0961 7.3250 0.1249 0.1344 0.1248 0.1662 0.1689 0.1724 0.3827 0.3874 0.3732 PC28:2;O2 PC 28:2;O2 3.5406 3.4191 3.3467 2.3034 2.2504 2.4202 0.4263 0.4247 0.4246 0.0107 0.0113 0.0107 3.8944 3.9967 4.0143 PC28:2;O3 PC 28:2;O3 1.4896 1.4689 1.4597 4.6753 4.8327 4.6660 1.3023 1.3517 1.3260 0.0096 0.0086 0.0080 2.8594 2.8678 2.8290 PC28:2;O;COOH 1.0611 1.0723 0.9957 0.4768 0.4724 0.4842 0.5340 0.5436 0.5458 3.5611 3.5244 3.4493 PC28:3;O2 PC 28:3;O2 0.1310 1.3106 1.2534 0.6446 0.6812 0.6201 0.6132 0.6295 0.6300 0.0152 0.0148 0.0156 3.5095 3.4854 3.4384 PC29:2;O;COOH 0.4410 0.4462 0.4339 0.0260 0.0279 0.0250 0.0442 0.0429 0.0432 0.0002 0.0002 0.0003 0.6332 0.6381 0.6353 PC29:3;O2 PC 29:3;O2 0.8719 0.8288 0.7929 0.0360 0.0420 0.0357 0.0822 0.0751 0.0735 0.0007 0.0003 0.0014 2.0452 2.0434 2.0173 PC34:2 PC 34:2 196.2536 188.2635 205.3934 403.0322 423.2983 405.2283 355.7505 350.7098 344.2807 457.0423 450.2607 453.6100 87.9536 87.2729 93.7630 PC34:2;O PC 34:2;O 31.0030 30.3900 29.2713 8.7697 8.7972 8.7503 4.1736 3.6305 3.4999 0.3178 0.3071 0.3126 18.5747 18.8044 18.3883 PC34:2;O2 PC 34:2;O2 100.0298 102.0712 100.7167 121.3317 123.6277 121.4682 27.3602 26.3628 26.3459 0.2840 0.2670 0.2632 75.4591 70.8608 73.3646 PC34:2;O3 PC 34:2;O3 21.7939 21.5784 21.0328 12.1166 12.7955 12.1894 6.7437 6.9338 6.8763 44.8418 44.4095 44.4237 PC34:2;O4 PC(4)* 2.7327 2.5990 2.5720 15.1554 15.1533 14.3212 5.1231 5.2006 5.2283 0.0167 0.0170 0.0160 13.8117 13.1000 13.3239 PC34:3;O PC 34:3;O 46.8965 47.1409 45.5045 10.8727 11.3544 10.9996 2.5861 2.4003 2.4305 0.3092 0.2852 0.2949 11.1089 11.4761 11.1341 PC34:3;O2 PC 34:3;O2 132.9874 136.4414 130.0073 2.0098 2.1778 2.0728 2.1803 1.9868 1.9153 0.0406 0.0193 0.0189 43.5100 45.0843 43.6103 PC34:3;O3 PC 34:3;O3 14.8411 14.8123 14.1172 1.6781 1.7157 1.6514 1.6228 1.6454 1.5577 0.0044 0.0055 0.0053 11.7503 11.3677 11.4209