HMDB0053161 RDKit 3D TG(18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) 161160 0 0 0 0 0 0 0 0999 V2000 -8.0246 2.5068 -2.0175 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5608 1.6214 -3.1908 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2928 2.1691 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1694 1.5059 -3.6757 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0304 0.0677 -3.2157 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5297 -0.6693 -4.3797 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3828 -1.2756 -4.3786 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5188 -1.2486 -3.1684 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2882 -0.5182 -3.5752 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1055 -0.9913 -3.5383 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2705 -2.3449 -3.0957 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0407 -2.9344 -4.2549 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -3.2305 -4.1244 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0588 -3.0110 -2.8757 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7233 -4.2885 -2.3989 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4541 -4.1883 -1.1243 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6903 -4.0822 0.1366 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7121 -3.0383 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4458 -3.3727 0.2395 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8747 -1.6537 0.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7422 -0.8284 0.5271 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0738 -0.7199 1.8286 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0968 -1.8685 2.7318 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3458 -2.4173 2.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4393 -1.7566 3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3402 -0.5066 3.6732 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7801 -2.3268 3.6686 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8512 -1.2303 3.5512 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8177 -0.7532 2.1131 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8135 0.3405 1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5681 1.5649 2.5871 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3149 2.6985 1.9576 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2467 2.8831 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9227 3.3930 0.1073 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6684 4.5115 -0.4988 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7479 5.4563 -0.8855 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4592 6.7252 -0.2318 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2398 7.2776 0.6416 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 6.7357 1.1053 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7396 7.5223 0.9284 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2384 7.8520 -0.4084 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3491 8.6739 -1.2904 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1192 8.8939 -2.6046 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2162 -0.1950 1.6247 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7272 0.9942 2.0194 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0053 1.7813 2.6443 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1521 1.3499 1.7097 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6134 2.6345 2.2912 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5016 2.7235 3.7423 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4991 2.8493 4.5584 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9109 2.9098 4.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6692 1.8134 4.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2726 0.8658 4.1567 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3127 0.7074 2.6712 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7310 -0.5715 2.2905 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3185 -1.5754 1.6608 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7311 -1.4228 1.2868 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9509 -1.5267 -0.1713 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7710 -2.3730 -0.7102 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5958 -3.3464 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3899 -4.7096 -0.5403 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0061 -5.7974 0.0415 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6637 -5.9054 1.4745 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2616 -6.4807 1.6424 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2053 -5.6384 0.9708 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8492 -6.2976 1.1758 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7604 -5.4794 0.5147 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5246 2.1870 -1.0987 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1185 2.4567 -1.9133 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7644 3.5778 -2.2245 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6110 0.6133 -2.8224 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3470 1.8239 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3143 3.2252 -4.0169 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2726 2.0126 -4.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4965 0.0336 -2.2883 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0476 -0.3732 -3.0086 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1734 -0.6902 -5.2647 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0069 -1.8264 -5.2654 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9066 -0.7313 -2.3023 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3332 -2.3331 -2.9444 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4494 0.5156 -3.9344 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7215 -0.3318 -3.8703 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -2.3126 -2.1761 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5955 -3.0497 -2.9928 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5313 -3.1094 -5.1876 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8826 -3.6594 -4.9667 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9264 -2.2925 -3.1523 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4924 -2.5414 -2.0913 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4469 -4.6657 -3.1823 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9579 -5.1179 -2.3243 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2384 -5.0016 -1.0286 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1039 -3.2450 -1.1988 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4409 -3.9858 0.9899 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1567 -5.0824 0.3385 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9644 -1.0428 -0.2722 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1053 0.2161 0.2236 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6315 0.1658 2.4194 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3227 -2.6316 2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7698 -1.4413 3.7679 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0301 -3.2203 3.1077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7644 -2.6598 4.7539 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7114 -0.4471 4.2883 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8121 -1.7619 3.7581 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1641 -1.6401 1.5029 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7997 -0.4412 1.8834 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7944 -0.0793 2.2673 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0664 0.4483 0.7671 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5966 1.5581 3.6947 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1403 3.5783 2.6107 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0806 3.4774 0.1049 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3353 1.9077 -0.0714 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0465 2.7600 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6035 4.7808 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5452 5.6221 -2.0146 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 5.0226 -0.7402 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5222 7.2440 -0.5021 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 8.2661 1.1077 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6641 5.6553 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3768 6.6776 2.2561 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5431 6.9724 1.5091 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5786 8.4915 1.5026 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1588 8.5175 -0.2426 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6845 6.9820 -0.9567 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1780 9.6989 -0.8466 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3704 8.2516 -1.5079 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6016 8.3249 -3.3913 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1868 8.5449 -2.5026 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1520 9.9620 -2.8575 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7662 0.4811 1.9749 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1972 1.3974 0.5861 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6072 2.8773 1.8663 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9535 3.4633 1.8421 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4814 2.6831 4.1915 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3389 2.9180 5.6527 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1036 3.0123 3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3210 3.8640 4.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7070 1.8346 5.8752 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8007 0.1088 4.7275 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7029 1.4959 2.1496 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3369 0.8747 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6731 -0.7587 2.5524 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7741 -2.4800 1.4152 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3234 -2.1927 1.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1495 -0.4507 1.6013 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3727 -0.8346 -0.8164 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8643 -2.3607 -1.8412 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5233 -3.2973 1.0788 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6827 -3.0464 -0.2406 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6107 -4.7675 -1.6409 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9362 -6.7068 -0.5961 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7731 -4.9493 2.0163 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3691 -6.6360 1.9235 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0522 -6.5663 2.7332 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2067 -7.4968 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1773 -4.6751 1.5081 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4226 -5.4662 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6211 -6.3735 2.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8074 -7.3173 0.7488 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7751 -5.8389 0.9035 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7839 -5.6194 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8531 -4.4243 0.8137 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 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 22 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 1 0 52 53 2 0 53 54 1 0 54 55 1 0 55 56 2 0 56 57 1 0 57 58 1 0 58 59 2 0 59 60 1 0 60 61 1 0 61 62 2 0 62 63 1 0 63 64 1 0 64 65 1 0 65 66 1 0 66 67 1 0 1 68 1 0 1 69 1 0 1 70 1 0 2 71 1 0 2 72 1 0 3 73 1 0 4 74 1 0 5 75 1 0 5 76 1 0 6 77 1 0 7 78 1 0 8 79 1 0 8 80 1 0 9 81 1 0 10 82 1 0 11 83 1 0 11 84 1 0 12 85 1 0 13 86 1 0 14 87 1 0 14 88 1 0 15 89 1 0 15 90 1 0 16 91 1 0 16 92 1 0 17 93 1 0 17 94 1 0 21 95 1 0 21 96 1 0 22 97 1 1 23 98 1 0 23 99 1 0 27100 1 0 27101 1 0 28102 1 0 28103 1 0 29104 1 0 29105 1 0 30106 1 0 30107 1 0 31108 1 0 32109 1 0 33110 1 0 33111 1 0 34112 1 0 35113 1 0 36114 1 0 36115 1 0 37116 1 0 38117 1 0 39118 1 0 39119 1 0 40120 1 0 40121 1 0 41122 1 0 41123 1 0 42124 1 0 42125 1 0 43126 1 0 43127 1 0 43128 1 0 47129 1 0 47130 1 0 48131 1 0 48132 1 0 49133 1 0 50134 1 0 51135 1 0 51136 1 0 52137 1 0 53138 1 0 54139 1 0 54140 1 0 55141 1 0 56142 1 0 57143 1 0 57144 1 0 58145 1 0 59146 1 0 60147 1 0 60148 1 0 61149 1 0 62150 1 0 63151 1 0 63152 1 0 64153 1 0 64154 1 0 65155 1 0 65156 1 0 66157 1 0 66158 1 0 67159 1 0 67160 1 0 67161 1 0 M END