HMDB0261881 RDKit 3D PE(20:5(5Z,8Z,11Z,14Z,16E)-OH(18)/20:0) 136135 0 0 0 0 0 0 0 0999 V2000 -17.7323 -1.9812 0.6794 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2231 -2.1779 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9608 -3.6101 0.6073 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1779 -4.0697 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4757 -3.2170 -1.3407 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6411 -3.8123 -2.6026 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.9828 -3.2410 -1.0678 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7390 -2.7422 0.3073 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9872 -1.6523 0.4824 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7644 -1.1917 1.8184 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0909 -0.1587 2.2218 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 0.8027 1.4104 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4093 0.7619 -0.0282 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3583 0.5996 -0.7913 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9811 0.4353 -0.1957 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4171 -0.8637 -0.6224 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3317 -1.0026 -1.2817 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3541 -0.1101 -1.7959 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2235 1.3150 -1.5992 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8002 1.6861 -0.1912 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 1.1192 0.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 0.1042 0.6661 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3958 1.7961 -0.5704 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0432 1.5800 -0.6024 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3061 1.5918 0.7179 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5523 2.8929 1.4875 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1979 3.9863 0.6839 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2924 5.4288 1.5883 P 0 0 0 0 0 5 0 0 0 0 0 0 1.1265 5.9479 1.8679 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9057 5.0215 3.1097 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 6.5829 0.9033 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5181 6.6876 1.4421 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 7.7611 0.7819 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6975 9.0518 0.9319 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0868 1.4330 0.5058 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8834 0.4093 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3561 -0.5808 1.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3259 0.4277 0.6177 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7823 -0.0219 -0.7118 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5152 -1.3902 -1.1472 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9586 -2.5651 -0.4331 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2753 -2.9832 -0.0782 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2291 -2.3521 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7965 -1.0187 0.6074 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5877 -0.8616 -0.6713 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1219 0.5499 -0.8037 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9974 0.9891 0.2952 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2558 0.2723 0.5515 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2575 0.2850 -0.5649 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4946 -0.4899 -0.0952 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5566 -0.4879 -1.1647 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7651 -1.2570 -0.6698 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8676 -1.2733 -1.6906 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0363 -2.0441 -1.1399 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7019 -3.4726 -0.8186 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9610 -4.1299 -0.2746 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0321 -1.9067 -0.3699 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9561 -1.0276 1.1903 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2018 -2.8263 1.2131 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9906 -1.9039 1.8844 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7014 -1.4996 0.1569 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4162 -4.3851 1.2578 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0279 -5.1532 -0.4593 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8392 -2.1977 -1.4225 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8215 -3.1132 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5468 -4.2340 -1.2464 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5150 -2.5492 -1.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1851 -3.2918 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5868 -1.2165 -0.3883 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2326 -1.8036 2.6461 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0545 -0.0087 3.3377 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3922 1.0052 1.8891 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8973 1.8491 1.6563 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3938 0.9320 -0.5176 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4751 0.5846 -1.8662 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9717 0.4426 0.9011 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4433 1.3071 -0.5783 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0059 -1.7930 -0.3337 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1047 -2.1296 -1.5058 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2968 -0.5545 -1.4712 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2233 -0.2805 -2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9717 2.0124 -1.9726 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2752 1.6481 -2.2147 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4633 1.3889 0.6061 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6987 2.7882 -0.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5863 2.2910 -1.3334 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 0.5740 -1.1157 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6652 0.7606 1.3191 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 2.9225 2.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6485 2.9453 1.6299 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2407 4.5485 3.6731 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0986 5.7481 1.4792 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4064 7.0201 2.5144 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6252 7.5449 -0.2611 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3076 7.8228 1.3574 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 9.8086 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7429 9.0312 0.4757 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 1.5212 0.7024 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8967 -0.0337 1.4664 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8249 0.3362 -0.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1891 0.6578 -1.4447 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3702 -1.4844 -1.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7251 -1.4330 -2.2758 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4566 -3.4408 -0.9951 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2871 -2.6077 0.5133 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8714 -3.1920 -1.0514 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2066 -4.0706 0.2912 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1348 -3.0629 0.7961 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9646 -2.4726 1.9217 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6249 -0.9184 1.4101 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1761 -0.1422 0.8714 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0416 -1.0912 -1.5844 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4541 -1.5534 -0.6056 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5673 0.6141 -1.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2283 1.2168 -0.8285 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3966 0.9818 1.2329 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2357 2.0666 0.1338 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1105 -0.7915 0.8962 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7582 0.7682 1.4211 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6238 1.3049 -0.7973 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8942 -0.1405 -1.5122 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2213 -1.5177 0.2343 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8625 0.0434 0.8061 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8068 0.5794 -1.3572 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1986 -0.9890 -2.0828 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1544 -0.7678 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4332 -2.2845 -0.4854 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2051 -0.2236 -1.8683 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4860 -1.6972 -2.6397 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8918 -2.0159 -1.8559 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3506 -1.5185 -0.2101 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9487 -3.5428 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3383 -3.9905 -1.7349 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7486 -4.7393 0.6256 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3175 -4.8324 -1.0678 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7809 -3.3976 -0.1328 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 5 7 1 0 7 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 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 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 4 63 1 0 5 64 1 0 6 65 1 0 7 66 1 0 7 67 1 0 8 68 1 0 9 69 1 0 10 70 1 0 11 71 1 0 12 72 1 0 12 73 1 0 13 74 1 0 14 75 1 0 15 76 1 0 15 77 1 0 16 78 1 0 17 79 1 0 18 80 1 0 18 81 1 0 19 82 1 0 19 83 1 0 20 84 1 0 20 85 1 0 24 86 1 0 24 87 1 0 25 88 1 1 26 89 1 0 26 90 1 0 30 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 38 98 1 0 38 99 1 0 39100 1 0 39101 1 0 40102 1 0 40103 1 0 41104 1 0 41105 1 0 42106 1 0 42107 1 0 43108 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 49120 1 0 49121 1 0 50122 1 0 50123 1 0 51124 1 0 51125 1 0 52126 1 0 52127 1 0 53128 1 0 53129 1 0 54130 1 0 54131 1 0 55132 1 0 55133 1 0 56134 1 0 56135 1 0 56136 1 0 M END