HMDB0296672 RDKit 3D DG(20:4(5Z,8Z,11Z,14Z)-OH(17)/22:0/0:0) 131130 0 0 0 0 0 0 0 0999 V2000 13.9062 -5.0626 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0988 -3.7569 1.8452 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9372 -3.5928 2.7884 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0284 -2.3168 3.5913 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0642 -1.0969 2.6932 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8199 -1.0218 1.8352 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8986 0.2075 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9774 1.4938 1.7142 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7968 1.7754 2.6151 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5200 1.8190 1.7523 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3244 2.1457 2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0830 2.2192 1.7155 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7840 0.9170 1.1128 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6638 0.7465 0.1895 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2697 0.9901 0.5091 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8232 2.3421 0.9419 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1555 3.4373 0.0272 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6309 3.4557 -1.3442 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1669 3.5840 -1.5489 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8553 3.5746 -3.0243 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1452 2.2242 -3.6263 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1918 1.2029 -3.0185 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4065 -0.0196 -3.0088 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0555 1.6853 -2.4746 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0311 1.0609 -1.8586 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2592 1.5771 -0.4306 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5159 2.9383 -0.4258 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2363 1.5119 -2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4132 1.1037 -2.2112 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0115 -0.0817 -1.9467 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4633 -1.1388 -2.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4092 0.0159 -1.3839 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2236 0.5332 -2.5728 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1811 -0.5587 -3.6378 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8238 -0.0458 -4.8369 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8754 -0.4216 -5.4589 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7867 -1.5011 -5.1567 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6218 -2.3944 -4.0457 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4446 -2.4822 -3.0094 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6436 -1.6098 -2.9273 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5896 -0.8172 -1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5245 -0.8161 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7527 -1.5741 -0.8196 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0536 -2.6127 0.1351 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3670 -3.0886 1.1095 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0210 -2.7172 1.5664 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1270 -2.2135 3.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6433 -3.1696 3.8423 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8554 -0.9113 3.1183 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9141 -0.5044 4.5691 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6262 0.8229 4.7565 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2540 -4.8961 0.2096 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9002 -5.4271 0.7059 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5120 -5.8647 1.7685 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0347 -3.7765 2.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1915 -2.9413 1.1191 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9539 -3.6647 2.3138 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0020 -4.4410 3.5242 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1159 -2.2418 4.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9090 -2.2832 4.2511 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0018 -1.0425 2.0983 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0764 -0.2028 3.3469 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9464 -0.9354 2.4943 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7312 -1.9029 1.1902 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0987 0.2440 0.1917 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8477 0.1154 0.3833 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0069 2.3147 0.9466 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9325 1.5699 2.2631 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6988 1.0098 3.3947 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8854 2.7813 3.0686 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6342 2.6050 0.9789 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5075 0.8551 1.2481 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1206 1.3405 3.3327 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4809 3.0815 3.1549 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3160 2.6664 2.3797 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3639 2.9294 0.8889 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7328 0.5693 0.5923 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7312 0.1728 1.9782 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7156 -0.3524 -0.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 1.2489 -0.8075 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9386 0.1877 1.2431 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6589 0.7231 -0.4108 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6761 2.2552 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1348 2.5463 1.9642 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8144 4.4071 0.5182 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2572 3.5627 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0758 4.3914 -1.8265 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0349 2.6484 -1.9941 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5754 2.7622 -1.0991 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7383 4.5227 -1.1195 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8232 3.9150 -3.2372 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6057 4.2839 -3.4859 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1459 1.8296 -3.4828 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8661 2.2066 -4.7153 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8839 -0.0156 -1.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3202 1.4245 0.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1082 1.0712 0.0374 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1047 3.4485 -1.1372 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1827 2.6384 -2.6577 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9992 1.1897 -3.7522 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7670 -0.9597 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4135 0.7801 -0.5908 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2272 0.8556 -2.3082 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6644 1.3980 -2.9816 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0767 -0.6655 -3.8935 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4733 -1.5192 -3.2504 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2871 0.8429 -5.2852 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1292 0.1775 -6.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7150 -2.1857 -6.1172 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8567 -1.1689 -5.2841 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7856 -3.1208 -4.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2724 -3.1808 -2.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6778 -0.8065 -3.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5673 -2.1894 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6887 -0.2251 -1.5201 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3095 -0.1369 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5871 -0.7729 -0.6772 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9799 -1.8909 -1.8819 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0712 -3.0865 -0.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8790 -3.9111 1.6977 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3997 -3.6787 1.6884 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4541 -2.0318 0.9786 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0695 -2.0304 3.3224 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3726 -3.0783 4.7839 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2933 -0.1304 2.5278 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9036 -0.9598 2.7159 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4580 -1.3218 5.1145 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8926 -0.4428 4.9633 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8387 0.9464 5.8387 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9124 1.6380 4.4674 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5735 0.8959 4.2184 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 1 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 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 25 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 2 0 36 37 1 0 37 38 1 0 38 39 2 0 39 40 1 0 40 41 1 0 41 42 2 0 42 43 1 0 43 44 1 0 44 45 2 0 45 46 1 0 46 47 1 0 47 48 1 0 47 49 1 0 49 50 1 0 50 51 1 0 1 52 1 0 1 53 1 0 1 54 1 0 2 55 1 0 2 56 1 0 3 57 1 0 3 58 1 0 4 59 1 0 4 60 1 0 5 61 1 0 5 62 1 0 6 63 1 0 6 64 1 0 7 65 1 0 7 66 1 0 8 67 1 0 8 68 1 0 9 69 1 0 9 70 1 0 10 71 1 0 10 72 1 0 11 73 1 0 11 74 1 0 12 75 1 0 12 76 1 0 13 77 1 0 13 78 1 0 14 79 1 0 14 80 1 0 15 81 1 0 15 82 1 0 16 83 1 0 16 84 1 0 17 85 1 0 17 86 1 0 18 87 1 0 18 88 1 0 19 89 1 0 19 90 1 0 20 91 1 0 20 92 1 0 21 93 1 0 21 94 1 0 25 95 1 1 26 96 1 0 26 97 1 0 27 98 1 0 28 99 1 0 28100 1 0 32101 1 0 32102 1 0 33103 1 0 33104 1 0 34105 1 0 34106 1 0 35107 1 0 36108 1 0 37109 1 0 37110 1 0 38111 1 0 39112 1 0 40113 1 0 40114 1 0 41115 1 0 42116 1 0 43117 1 0 43118 1 0 44119 1 0 45120 1 0 46121 1 0 46122 1 0 47123 1 0 48124 1 0 49125 1 0 49126 1 0 50127 1 0 50128 1 0 51129 1 0 51130 1 0 51131 1 0 M END