HMDB0284441 RDKit 3D PE(20:3(5Z,8Z,14Z)-O(11S,12R)/24:0) 150150 0 0 0 0 0 0 0 0999 V2000 -5.9220 3.3666 -5.3385 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5281 3.9473 -5.3628 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0657 4.1898 -3.9599 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0488 2.9014 -3.1954 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5565 3.0927 -1.7666 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5387 1.8170 -1.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1944 1.5372 0.0514 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0456 2.4603 0.7477 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4886 2.2121 0.9198 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2706 2.1303 -0.2884 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3433 1.1148 0.6893 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2637 -0.2330 0.0836 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3219 -1.1724 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3611 -1.7353 -0.0206 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1104 -1.4952 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2188 -2.7922 -2.1684 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2275 -3.2660 -2.8669 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9401 -2.6068 -3.0284 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6252 -2.2951 -4.4864 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5306 -3.4939 -5.3595 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4455 -4.4443 -4.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4136 -5.5286 -5.6562 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5158 -4.2441 -4.0109 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4616 -5.1928 -3.7279 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3754 -4.7076 -2.5803 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5464 -4.7096 -1.3552 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1977 -4.4126 -0.1717 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1265 -4.4552 1.1380 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.1962 -3.7735 0.8021 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1377 -6.1077 1.4682 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -3.6932 2.5043 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6834 -4.6152 3.5649 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2427 -3.9050 4.7821 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5992 -3.5045 4.5264 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0068 -3.5164 -2.9221 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3622 -3.3989 -3.1968 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9906 -4.5189 -3.0899 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0746 -2.1874 -3.5761 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8795 -1.5087 -2.4779 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 -2.5024 -1.9817 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 -2.0025 -1.0048 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4679 -1.4470 0.2871 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 -0.2025 0.3702 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2806 0.9265 -0.3696 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5762 2.2151 -0.3178 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1580 2.2418 -0.7945 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7113 3.6887 -0.7366 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3104 3.9389 -1.1268 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2707 3.3046 -0.1955 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 3.8867 1.1721 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 3.4871 2.2312 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4259 2.1319 2.7986 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1232 0.9676 1.9718 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0194 -0.3192 2.7216 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0512 -0.5158 3.7174 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2171 0.1062 5.0263 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2509 -0.1072 6.1033 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 0.3350 6.1257 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4443 1.7857 6.2178 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9793 1.8862 6.1979 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8142 2.2976 -5.0425 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3852 3.4277 -6.3614 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5435 3.8813 -4.5944 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5228 4.8853 -5.9685 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8489 3.1969 -5.8511 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6496 4.9608 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0062 4.5722 -4.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0642 2.4504 -3.1553 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4076 2.1539 -3.7003 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4808 3.4298 -1.8443 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0939 3.9153 -1.3149 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9209 1.0067 -1.4709 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0453 0.5236 0.5085 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8572 3.5228 0.4001 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6078 2.5319 1.8285 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9694 3.0396 1.6248 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3973 1.2331 1.2086 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2986 -0.7518 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2925 -0.2121 -1.0337 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4106 -1.4354 1.7547 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6950 -2.4301 0.4975 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0735 -1.0658 -1.4841 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8237 -0.7701 -1.8851 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1709 -3.3695 -2.1016 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3869 -4.2443 -3.3721 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7044 -1.7304 -2.4618 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1671 -3.3979 -2.7366 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7083 -1.6765 -4.5666 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5032 -1.6996 -4.8481 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4588 -3.1708 -6.4037 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4861 -4.0800 -5.2593 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0546 -6.1761 -3.4981 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1523 -5.2511 -4.6077 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1734 -5.5130 -2.5649 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2274 -3.8978 -1.4761 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0281 -5.7099 -1.3104 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7729 -6.5101 1.4983 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3173 -4.9993 3.7593 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3479 -5.4662 3.2777 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6041 -3.0738 5.0704 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2729 -4.5950 5.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -4.3468 4.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7312 -2.8849 3.7144 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8251 -2.3609 -4.3988 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3603 -1.4489 -3.9863 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4397 -0.6910 -3.0301 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1606 -1.1237 -1.7497 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2504 -3.3612 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4505 -2.9106 -2.8571 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6576 -2.7944 -0.8224 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4779 -1.2303 -1.6083 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8666 -2.2316 0.8627 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3867 -1.3451 0.9584 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7616 0.1104 1.4921 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6046 -0.3848 0.2506 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2985 1.0772 0.0828 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5003 0.6895 -1.4367 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6698 2.7217 0.6906 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1366 2.9269 -1.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1567 1.8871 -1.8507 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4527 1.6326 -0.2298 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9841 4.1476 0.2324 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3632 4.2268 -1.4889 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1269 5.0383 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1399 3.5914 -2.1469 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2815 3.7029 -0.5882 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2296 2.2450 -0.2972 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4442 5.0250 1.0333 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5063 3.7188 1.5337 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 3.7537 1.8648 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6024 4.2678 3.0686 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4381 1.9675 3.3252 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2715 2.2279 3.6852 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0361 0.7820 1.2926 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6907 1.1189 1.2215 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1188 -1.1628 1.9323 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9936 -0.6167 3.1685 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0697 -0.3956 3.1225 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1283 -1.6821 3.8409 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6057 1.1546 5.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1937 -0.4313 5.4463 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7623 0.3081 7.0505 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2348 -1.2396 6.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6007 -0.1183 7.0722 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7701 -0.1480 5.3266 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1899 2.1800 7.2703 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 2.4842 5.5373 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3113 1.3615 5.2685 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3318 2.9194 6.1518 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3839 1.3411 7.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 28 30 1 0 28 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 25 35 1 0 35 36 1 0 36 37 2 0 36 38 1 0 38 39 1 0 39 40 1 0 40 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 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 11 9 1 0 1 61 1 0 1 62 1 0 1 63 1 0 2 64 1 0 2 65 1 0 3 66 1 0 3 67 1 0 4 68 1 0 4 69 1 0 5 70 1 0 5 71 1 0 6 72 1 0 7 73 1 0 8 74 1 0 8 75 1 0 9 76 1 0 11 77 1 0 12 78 1 0 12 79 1 0 13 80 1 0 14 81 1 0 15 82 1 0 15 83 1 0 16 84 1 0 17 85 1 0 18 86 1 0 18 87 1 0 19 88 1 0 19 89 1 0 20 90 1 0 20 91 1 0 24 92 1 0 24 93 1 0 25 94 1 1 26 95 1 0 26 96 1 0 30 97 1 0 32 98 1 0 32 99 1 0 33100 1 0 33101 1 0 34102 1 0 34103 1 0 38104 1 0 38105 1 0 39106 1 0 39107 1 0 40108 1 0 40109 1 0 41110 1 0 41111 1 0 42112 1 0 42113 1 0 43114 1 0 43115 1 0 44116 1 0 44117 1 0 45118 1 0 45119 1 0 46120 1 0 46121 1 0 47122 1 0 47123 1 0 48124 1 0 48125 1 0 49126 1 0 49127 1 0 50128 1 0 50129 1 0 51130 1 0 51131 1 0 52132 1 0 52133 1 0 53134 1 0 53135 1 0 54136 1 0 54137 1 0 55138 1 0 55139 1 0 56140 1 0 56141 1 0 57142 1 0 57143 1 0 58144 1 0 58145 1 0 59146 1 0 59147 1 0 60148 1 0 60149 1 0 60150 1 0 M END