HMDB0261574 RDKit 3D PE(18:3(6Z,9Z,12Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) 129128 0 0 0 0 0 0 0 0999 V2000 15.9837 1.8790 1.5331 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9000 0.8573 1.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2933 1.1073 -0.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3320 0.2228 -1.0712 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9636 -1.0950 -0.9842 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9610 -2.2170 -1.2189 C 0 0 2 0 0 0 0 0 0 0 0 0 14.6564 -3.4366 -1.0969 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4691 -2.1813 -2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1396 -2.2415 -2.8119 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6880 -2.2061 -4.1698 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4391 -2.2675 -4.5215 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2276 -2.3837 -3.7453 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2315 -2.5148 -2.3165 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7084 -1.6481 -1.5019 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0629 -0.4532 -1.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5266 0.4223 -1.0308 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8900 1.6179 -1.5786 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9490 2.5690 -1.7021 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8438 2.2449 -0.7962 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5838 1.8761 -0.8847 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1803 0.8052 -1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5169 -0.3077 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2823 0.2535 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5408 -0.7915 0.4672 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9938 -1.9276 0.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3461 -0.4795 1.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4853 -1.2602 1.8174 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9236 -1.3391 1.3147 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4682 -0.0515 1.2329 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7618 0.2881 0.8839 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5423 -0.6583 0.6243 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2345 1.6698 0.8085 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7064 1.7507 0.5615 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5361 1.1561 1.6488 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0223 1.3456 1.3077 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4035 0.6495 0.0927 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3262 -0.2843 0.0222 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0870 -0.7268 1.2112 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8804 -2.1834 1.4129 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8651 -3.0450 1.4032 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2773 -2.6738 1.1927 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8208 -3.3516 -0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2830 -2.7256 -1.0504 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3423 -1.2621 -1.2044 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8184 -0.9104 -1.3937 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0315 0.5751 -1.5699 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2791 1.0707 -2.7761 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7161 0.3865 -4.0421 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6104 -0.6552 3.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1444 0.6458 3.0069 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3964 1.4256 4.4584 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.7395 0.6836 5.6038 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0702 1.5309 4.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7218 2.9643 4.4022 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5304 3.8779 3.7029 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8813 5.2468 3.7217 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7426 5.6672 5.1132 N 0 0 0 0 0 0 0 0 0 0 0 0 16.5342 1.5809 2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5418 2.8606 1.7112 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7530 1.9372 0.7362 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3176 -0.1234 1.3914 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1191 1.0217 2.0232 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7777 2.0577 -0.3261 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8552 0.4616 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6797 -1.1594 -1.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5837 -1.2911 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1515 -2.1212 -0.5069 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4862 -4.0393 -1.8495 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1749 -2.1125 -3.4395 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5336 -2.2892 -1.9519 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4648 -2.1191 -4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2767 -2.2208 -5.6286 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6519 -3.3072 -4.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5304 -1.5568 -4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6689 -3.4352 -1.8592 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -1.8391 -0.4143 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9811 -0.1950 -2.9632 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6076 0.1804 -0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6089 1.4537 -2.6631 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 3.1831 -0.9128 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0423 3.0692 -0.0834 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7963 2.3791 -0.2833 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9118 0.4375 -2.4909 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3337 1.2101 -2.4291 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1842 -1.1294 -1.6629 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1519 -0.7298 -0.2126 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5692 0.6652 -1.0593 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5327 1.0331 0.4337 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1272 -2.2962 1.9697 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4818 -1.8966 2.0978 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0083 -1.9180 0.3841 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 2.1881 1.7958 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6924 2.2600 0.0124 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9735 1.2250 -0.4007 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0108 2.8101 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3544 1.6810 2.6228 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4151 0.0685 1.7882 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0864 2.4859 1.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5876 1.1815 2.2109 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8727 0.9437 -0.8432 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5433 -0.7624 -0.9612 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1412 -0.4183 1.1367 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6930 -0.2389 2.1479 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8375 -2.5171 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6252 -4.1288 1.5676 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5240 -1.6369 1.2318 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8700 -3.1783 2.0581 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8328 -4.4728 -0.0202 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6601 -3.3485 -1.8839 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8053 -0.9979 -2.1493 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9826 -0.6913 -0.3618 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3778 -1.2855 -0.5125 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1731 -1.4259 -2.3223 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1298 0.7527 -1.6748 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6830 1.0908 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2072 0.9319 -2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4537 2.1612 -2.9448 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2343 0.9267 -4.8928 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3044 -0.6447 -4.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8085 0.4141 -4.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3206 -0.6295 3.7725 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -1.2613 3.7321 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4086 0.6422 4.9099 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5213 3.8980 4.2001 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 3.5712 2.6515 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5086 5.9918 3.1985 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1254 5.1635 3.2606 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1527 6.6207 5.2654 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2161 5.5625 5.4686 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 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 2 0 20 21 1 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 2 0 30 32 1 0 32 33 1 0 33 34 1 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 45 46 1 0 46 47 1 0 47 48 1 0 27 49 1 0 49 50 1 0 50 51 1 0 51 52 2 0 51 53 1 0 51 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 4 64 1 0 5 65 1 0 5 66 1 0 6 67 1 1 7 68 1 0 8 69 1 0 9 70 1 0 10 71 1 0 11 72 1 0 12 73 1 0 12 74 1 0 13 75 1 0 14 76 1 0 15 77 1 0 16 78 1 0 17 79 1 6 18 80 1 0 19 81 1 0 20 82 1 0 21 83 1 0 21 84 1 0 22 85 1 0 22 86 1 0 23 87 1 0 23 88 1 0 27 89 1 1 28 90 1 0 28 91 1 0 32 92 1 0 32 93 1 0 33 94 1 0 33 95 1 0 34 96 1 0 34 97 1 0 35 98 1 0 35 99 1 0 36100 1 0 37101 1 0 38102 1 0 38103 1 0 39104 1 0 40105 1 0 41106 1 0 41107 1 0 42108 1 0 43109 1 0 44110 1 0 44111 1 0 45112 1 0 45113 1 0 46114 1 0 46115 1 0 47116 1 0 47117 1 0 48118 1 0 48119 1 0 48120 1 0 49121 1 0 49122 1 0 53123 1 0 55124 1 0 55125 1 0 56126 1 0 56127 1 0 57128 1 0 57129 1 0 M END