HMDB0055407 RDKit 3D TG(18:4(6Z,9Z,12Z,15Z)/16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) 153152 0 0 0 0 0 0 0 0999 V2000 -2.2403 5.4850 1.4117 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9499 4.2536 0.8129 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2623 4.0372 1.4135 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3674 4.0435 0.7389 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5369 4.2635 -0.7297 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1742 3.0854 -1.3147 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6041 2.3715 -2.2627 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2807 2.6714 -2.8323 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 2.9562 -4.2854 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5949 2.2580 -5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7443 1.1154 -4.7782 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3377 1.5146 -5.0898 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6259 0.8885 -5.9586 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0319 -0.2631 -6.7675 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1534 -1.4016 -6.4414 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5964 -2.5740 -6.0579 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9773 -2.9326 -5.9055 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5547 -3.3755 -4.6342 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9935 -4.5773 -3.9397 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5983 -4.3188 -3.4364 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3884 -4.9575 -3.8389 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3809 -3.3559 -2.5079 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6121 -2.8157 -1.8247 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -3.6208 -0.8841 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7067 -4.1058 -1.5564 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1735 -3.0135 -2.3844 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6065 -1.8077 -1.9156 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6221 -1.6434 -0.6439 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0656 -0.6385 -2.6769 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0576 0.1504 -3.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9073 0.7597 -2.7508 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0459 1.7635 -1.6733 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6927 1.4001 -0.4338 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0872 1.4153 0.7139 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6544 1.7952 0.9675 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0382 0.5887 1.5775 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9764 -0.0810 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6717 0.3112 -0.1423 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 0.5621 0.1116 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0664 -0.1275 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7788 -1.2062 -1.4764 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3545 -2.4470 -0.9001 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2628 -3.1691 -1.5024 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7931 -2.8089 -2.8167 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3056 -2.5558 -2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7739 -4.3966 0.0032 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5701 -4.0665 1.3184 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0755 -2.9811 1.7181 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1836 -4.8506 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3555 -4.1768 3.6242 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8808 -3.8502 4.3851 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4234 -3.1497 5.6677 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5752 -2.7695 6.5359 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -1.8474 5.9169 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9904 -0.5029 5.4914 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0787 0.2998 4.8895 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5311 1.4594 5.3049 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9688 2.1155 6.4804 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3783 3.4708 6.1998 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3484 4.4757 5.6444 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5056 4.7278 6.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4841 5.7453 6.0555 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 7.0790 5.8128 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3705 5.5511 2.4892 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1588 5.3870 1.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6815 6.3608 0.8932 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9218 4.2817 -0.2653 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2861 3.3944 1.1673 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3055 3.8645 2.4941 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3168 3.8698 1.2883 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6296 4.6446 -1.1402 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2589 5.1629 -0.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1806 2.7493 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1207 1.4834 -2.6803 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7906 3.5195 -2.3005 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 1.8026 -2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9227 3.8121 -4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6961 2.5845 -6.2013 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0081 0.2012 -5.3872 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7407 0.8317 -3.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9277 2.3990 -4.5234 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4181 1.2832 -6.0959 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0798 -0.4606 -6.8911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7059 -0.0017 -7.8603 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9557 -1.2462 -6.5314 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1821 -3.3604 -5.8555 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1381 -3.8367 -6.6274 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6947 -2.1990 -6.3876 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -2.4960 -3.9199 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6671 -3.4953 -4.7988 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6517 -4.9770 -3.1625 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8812 -5.3749 -4.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2556 -1.8935 -1.2907 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3823 -2.3536 -2.5623 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8873 -2.7562 -0.1938 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5359 -4.3407 -0.8401 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5038 -4.9681 -2.1853 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7396 -1.0911 -3.5049 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8294 -0.0549 -2.1017 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6494 0.9705 -3.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7407 -0.4947 -4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.0560 -2.4812 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3182 1.2995 -3.5789 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7189 2.5827 -2.1336 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0902 2.3291 -1.5512 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7564 1.1019 -0.4611 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6892 1.1151 1.5973 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 2.5176 1.8585 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1433 2.2528 0.1515 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4777 0.2104 2.5224 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3556 -0.9549 1.6268 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5482 -0.5299 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2186 1.1825 -0.6479 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4191 1.3271 0.8109 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1169 0.1074 -0.2586 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 -0.9304 -2.4546 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7614 -1.4121 -1.7273 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9669 -2.7479 0.0935 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6511 -4.0912 -1.0087 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7465 -3.8012 -3.4131 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2496 -2.1254 -3.4404 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5574 -1.5677 -2.3866 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8034 -3.3253 -2.1413 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6438 -2.6412 -3.8239 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4172 -5.7884 2.4951 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1802 -5.1783 1.9586 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9993 -3.2562 3.4964 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9791 -4.8324 4.2985 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -4.7881 4.6604 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6034 -3.1962 3.9081 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1457 -2.2362 5.4268 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2085 -3.8648 6.2051 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1428 -3.6857 6.8499 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1901 -2.3518 7.5134 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0661 -2.3577 5.0839 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3226 -1.6038 6.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4475 -0.0300 6.3155 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2042 -0.7626 4.7387 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -0.1085 3.9827 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3635 1.9281 4.7251 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2644 1.5251 7.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8479 2.2873 7.1868 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5384 3.3956 5.4898 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9728 3.8933 7.1425 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7825 5.4487 5.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6851 4.2636 4.6248 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1018 3.8091 6.7676 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1171 5.0223 7.5944 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3412 5.7886 6.7366 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7921 5.3421 5.0458 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6533 7.8541 5.8983 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3531 7.1547 4.8244 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1329 7.3061 6.6492 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 1 0 39 40 2 0 40 41 1 0 41 42 1 0 42 43 2 0 43 44 1 0 44 45 1 0 24 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 2 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 1 64 1 0 1 65 1 0 1 66 1 0 2 67 1 0 2 68 1 0 3 69 1 0 4 70 1 0 5 71 1 0 5 72 1 0 6 73 1 0 7 74 1 0 8 75 1 0 8 76 1 0 9 77 1 0 10 78 1 0 11 79 1 0 11 80 1 0 12 81 1 0 13 82 1 0 14 83 1 0 14 84 1 0 15 85 1 0 16 86 1 0 17 87 1 0 17 88 1 0 18 89 1 0 18 90 1 0 19 91 1 0 19 92 1 0 23 93 1 0 23 94 1 0 24 95 1 1 25 96 1 0 25 97 1 0 29 98 1 0 29 99 1 0 30100 1 0 30101 1 0 31102 1 0 31103 1 0 32104 1 0 32105 1 0 33106 1 0 34107 1 0 35108 1 0 35109 1 0 36110 1 0 37111 1 0 38112 1 0 38113 1 0 39114 1 0 40115 1 0 41116 1 0 41117 1 0 42118 1 0 43119 1 0 44120 1 0 44121 1 0 45122 1 0 45123 1 0 45124 1 0 49125 1 0 49126 1 0 50127 1 0 50128 1 0 51129 1 0 51130 1 0 52131 1 0 52132 1 0 53133 1 0 53134 1 0 54135 1 0 54136 1 0 55137 1 0 55138 1 0 56139 1 0 57140 1 0 58141 1 0 58142 1 0 59143 1 0 59144 1 0 60145 1 0 60146 1 0 61147 1 0 61148 1 0 62149 1 0 62150 1 0 63151 1 0 63152 1 0 63153 1 0 M END