HMDB0284007 RDKit 3D PE(22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/22:2(13Z,16Z)) 143142 0 0 0 0 0 0 0 0999 V2000 -2.2099 7.9607 -1.3777 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0466 7.8312 -0.3828 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1469 8.3386 -1.0838 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2324 7.6281 -1.3189 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3977 6.2253 -0.9098 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6194 5.3215 -2.1145 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7697 4.0028 -1.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4771 5.3882 -3.0603 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7102 4.8659 -2.7435 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8147 4.9320 -3.6629 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 4.4422 -3.4222 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2944 3.7806 -2.1706 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5022 3.2701 -1.9041 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7325 2.5963 -0.5878 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.0223 2.1342 -0.4969 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7404 1.4228 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8279 0.6364 0.6816 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1010 -0.6332 0.8124 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3706 -1.4605 -0.3674 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -2.5647 -0.5221 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6095 -3.8411 -0.5454 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9746 -4.3760 -0.4062 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9051 -5.2673 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5211 -4.4863 2.0442 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4318 -3.9011 2.7247 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2115 -4.3272 2.5121 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0325 -3.5724 3.6689 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7032 -3.4166 4.2436 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8684 -2.7492 5.6371 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1964 -1.3958 5.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4002 -0.6273 6.9245 P 0 0 0 0 0 5 0 0 0 0 0 0 -3.8535 -0.1754 7.0884 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0609 -1.6149 8.2425 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4474 0.7758 6.9926 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2738 0.6159 6.2573 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5897 1.8397 6.2973 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.6513 5.5276 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6802 -2.7507 3.5924 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5663 -3.3007 3.3411 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6726 -4.5272 3.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7193 -2.6354 2.7188 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6911 -1.1585 2.6826 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6916 -0.4774 1.8266 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9636 -0.7396 0.3382 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0676 -0.0190 -0.4634 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1016 -0.1090 -1.9442 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1412 -1.5168 -2.4701 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2894 -1.4393 -4.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3802 -2.8384 -4.5131 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4436 -3.0599 -5.9556 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5315 -2.4778 -6.7835 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5198 -1.0272 -6.7944 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4503 -0.1819 -6.4631 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7872 -0.6354 -5.9811 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9594 -0.0779 -4.6299 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1496 -0.7140 -3.4869 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2143 -2.1615 -3.4313 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4469 -2.8249 -2.9781 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9920 -2.6526 -1.6346 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3905 -1.2812 -1.1828 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4248 -0.6800 -2.1042 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8396 7.6125 -2.3644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5613 9.0127 -1.4384 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0593 7.3095 -1.0607 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0134 6.7851 -0.0801 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3467 8.5106 0.4661 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1573 9.3740 -1.4429 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0547 8.1434 -1.8585 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3929 6.1868 -0.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6773 5.8310 -0.1945 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 5.5891 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6401 3.9265 -0.6852 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 5.8538 -4.0249 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7649 4.4118 -1.7827 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6263 5.4277 -4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7812 4.5355 -4.1703 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5421 3.6820 -1.4084 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2697 3.3648 -2.6558 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5034 3.2653 0.2439 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3202 1.6913 -1.3538 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8138 0.9424 -1.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6893 1.8815 -0.5353 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6347 1.1903 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1404 -1.1188 1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 -1.8062 -0.2629 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2502 -0.8528 -1.2894 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3438 -2.2495 -0.6207 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8189 -4.6062 -0.6681 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7865 -3.6689 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1667 -5.1363 -1.2297 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2862 -6.1498 0.6713 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9512 -5.6454 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6906 -4.0713 4.4518 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5105 -2.5527 3.5839 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2952 -4.4427 4.5327 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9099 -2.8168 6.1481 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 -3.2921 6.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0878 -1.7520 8.3041 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5833 0.4860 5.1865 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3322 -0.2468 6.6001 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8852 2.1142 7.3352 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0765 2.7384 5.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3848 0.8638 5.8756 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6399 1.6583 4.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9657 -3.0967 1.7212 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6272 -2.9162 3.3421 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5354 -0.7905 3.7469 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7193 -0.7477 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3372 -0.8251 2.0176 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8119 0.6152 1.9661 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9931 -0.4268 0.0661 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8886 -1.8267 0.2071 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 1.0667 -0.1714 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0648 -0.3694 -0.1902 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 0.3825 -2.3902 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9459 0.5044 -2.3263 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9537 -2.1163 -2.0351 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7968 -2.0822 -2.3297 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5299 -0.8399 -4.4103 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2561 -0.9155 -4.1274 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2318 -3.3259 -3.9463 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5314 -3.3834 -4.1108 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5848 -2.7358 -6.3701 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -4.1984 -6.1078 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4851 -2.9241 -6.4059 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -2.9050 -7.8273 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5627 -0.5622 -7.1424 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2374 0.8950 -6.5448 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9746 -1.6841 -6.0135 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5287 -0.0695 -6.6535 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 1.0421 -4.5899 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2308 -0.0570 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 -2.5979 -4.4106 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3404 -2.5582 -2.7691 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2793 -3.9448 -3.1646 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3021 -2.6312 -3.7149 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9717 -3.2487 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4036 -3.1735 -0.8281 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9685 -1.4639 -0.1984 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6063 -0.5797 -0.9499 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3281 0.4396 -2.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4447 -0.9430 -1.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1905 -0.8758 -3.1834 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 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 31 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 28 38 1 0 38 39 1 0 39 40 2 0 39 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 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 1 0 59 60 1 0 60 61 1 0 1 62 1 0 1 63 1 0 1 64 1 0 2 65 1 0 2 66 1 0 3 67 1 0 4 68 1 0 5 69 1 0 5 70 1 0 6 71 1 6 7 72 1 0 8 73 1 0 9 74 1 0 10 75 1 0 11 76 1 0 12 77 1 0 13 78 1 0 14 79 1 1 15 80 1 0 16 81 1 0 16 82 1 0 17 83 1 0 18 84 1 0 19 85 1 0 19 86 1 0 20 87 1 0 21 88 1 0 22 89 1 0 22 90 1 0 23 91 1 0 23 92 1 0 27 93 1 0 27 94 1 0 28 95 1 1 29 96 1 0 29 97 1 0 33 98 1 0 35 99 1 0 35100 1 0 36101 1 0 36102 1 0 37103 1 0 37104 1 0 41105 1 0 41106 1 0 42107 1 0 42108 1 0 43109 1 0 43110 1 0 44111 1 0 44112 1 0 45113 1 0 45114 1 0 46115 1 0 46116 1 0 47117 1 0 47118 1 0 48119 1 0 48120 1 0 49121 1 0 49122 1 0 50123 1 0 50124 1 0 51125 1 0 51126 1 0 52127 1 0 53128 1 0 54129 1 0 54130 1 0 55131 1 0 56132 1 0 57133 1 0 57134 1 0 58135 1 0 58136 1 0 59137 1 0 59138 1 0 60139 1 0 60140 1 0 61141 1 0 61142 1 0 61143 1 0 M END