HMDB0008340 RDKit 3D PC(20:2(11Z,14Z)/20:0) 150149 0 0 0 0 0 0 0 0999 V2000 0.5899 -0.3942 -7.1833 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3975 -0.8085 -6.0831 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3308 -0.9694 -4.7853 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5189 -1.3763 -3.6355 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -0.3681 -3.3269 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0545 0.9363 -3.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2649 1.4870 -1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0116 1.0533 -0.7111 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4755 0.7356 0.5841 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2602 0.6479 1.0457 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9235 0.8732 0.2331 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8624 1.9678 0.6096 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9712 2.0393 -0.3691 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0771 1.1389 -0.5141 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9665 -0.3358 -0.5424 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8549 -0.9322 0.8271 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6334 -2.3921 0.8989 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3107 -2.8912 0.3394 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2712 -4.3943 0.4831 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0349 -5.0422 0.0972 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -6.3057 -0.1581 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2383 -4.4847 -0.0255 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -5.3735 -0.3835 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6474 -4.8089 -0.4326 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0915 -4.1415 -1.6811 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -4.8483 -2.8244 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3119 -4.1654 -4.2214 P 0 0 0 0 0 5 0 0 0 0 0 0 -4.4041 -5.1060 -4.7437 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1629 -4.0509 -5.4526 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.0903 -2.6803 -3.9845 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3654 -2.0584 -5.2006 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0704 -0.7584 -4.9185 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4013 -0.0298 -6.1061 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.5172 1.1074 -6.3493 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7334 0.5157 -5.9697 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3886 -0.8466 -7.3071 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0479 -4.1646 0.7742 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9923 -4.6622 1.6424 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5092 -5.7868 1.2819 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4837 -4.1127 2.8872 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4387 -3.5495 3.8319 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1630 -3.1007 5.0662 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3513 -2.5236 6.1504 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6074 -1.2530 5.8327 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8213 -0.7885 7.0395 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1048 0.4927 6.8126 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1395 0.3867 5.6821 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6233 1.6887 5.4718 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2484 2.8574 5.1741 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5859 4.0919 5.0169 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6047 3.9870 3.8764 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3466 5.2735 3.8516 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3801 5.4971 2.8555 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5934 4.7194 2.6586 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5302 4.6386 3.7921 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1015 3.8110 4.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9949 2.3323 4.5779 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3527 1.7933 4.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1032 -0.6356 -8.1538 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -0.9509 -7.1282 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8274 0.6810 -7.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1151 0.0394 -6.0382 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8352 -1.7583 -6.3868 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1121 -1.7514 -4.9544 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8981 -0.0306 -4.6152 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1086 -1.3519 -2.6911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8503 -2.3940 -3.7353 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1431 -0.2418 -4.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3867 -0.7608 -2.6731 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4235 1.4511 -3.7756 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7522 2.4917 -1.7351 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6633 0.1603 -0.9989 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8771 1.8024 -0.5039 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2616 0.5124 1.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1437 0.3866 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4876 -0.0810 0.2988 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7384 0.8795 -0.8863 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 1.8032 1.6273 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3425 2.9541 0.7335 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3302 3.1435 -0.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4876 2.1094 -1.4463 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6167 1.4392 -1.5022 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9471 1.4096 0.2321 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1496 -0.6338 -1.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8837 -0.8094 -1.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3012 -0.3090 1.5185 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 -0.8149 1.2325 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6276 -2.6737 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4873 -2.9531 0.4676 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4519 -2.4752 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3154 -2.6598 -0.7471 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1686 -4.8182 -0.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4128 -4.6075 1.5897 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0433 -5.8535 -1.3778 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1888 -6.2378 0.3379 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3211 -5.7779 -0.4208 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7605 -3.0713 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2184 -4.0768 -1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -2.6980 -5.8342 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4004 -1.8710 -5.7177 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0222 -1.0018 -4.3798 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5133 -0.1028 -4.2511 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0728 1.7398 -7.1028 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5837 0.7985 -6.8521 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3785 1.7442 -5.4655 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7777 1.3650 -5.2708 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4771 -0.2356 -5.6393 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1230 0.9090 -6.9531 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3456 -0.1624 -8.2055 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2895 -1.4564 -7.4201 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 -1.4868 -7.3936 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0382 -4.8757 3.5091 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2387 -3.2965 2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -2.7893 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -4.4196 4.1181 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9577 -2.3432 4.8023 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7695 -3.9581 5.4798 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6417 -3.3225 6.5236 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9765 -2.3093 7.0668 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9624 -1.4505 4.9599 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3573 -0.4900 5.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5308 -0.7453 7.9056 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1362 -1.6325 7.2992 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5284 0.7164 7.7607 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7956 1.3644 6.7153 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6119 0.0483 4.7575 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6229 -0.3733 5.9556 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 1.9151 6.2879 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2538 1.4880 4.5548 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9243 3.0622 6.0541 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9367 2.6947 4.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1321 4.2402 5.9729 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0455 5.0130 4.8844 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0796 3.8704 2.9053 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2772 3.1621 4.1206 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5073 6.0466 3.5729 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6352 5.6722 4.8523 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7505 6.5871 3.0526 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9282 5.6715 1.8077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3971 3.7035 2.1959 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1709 5.2266 1.8025 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5892 4.3716 3.4476 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7189 5.6809 4.2252 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1262 4.0990 5.3154 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8112 3.9385 5.7979 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7087 1.7993 5.4947 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 2.1197 3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1871 2.3509 4.5934 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4615 1.7890 3.0462 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4168 0.7388 4.4816 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 2 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 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 27 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 33 36 1 0 24 37 1 0 37 38 1 0 38 39 2 0 38 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 1 59 1 0 1 60 1 0 1 61 1 0 2 62 1 0 2 63 1 0 3 64 1 0 3 65 1 0 4 66 1 0 4 67 1 0 5 68 1 0 5 69 1 0 6 70 1 0 7 71 1 0 8 72 1 0 8 73 1 0 9 74 1 0 10 75 1 0 11 76 1 0 11 77 1 0 12 78 1 0 12 79 1 0 13 80 1 0 13 81 1 0 14 82 1 0 14 83 1 0 15 84 1 0 15 85 1 0 16 86 1 0 16 87 1 0 17 88 1 0 17 89 1 0 18 90 1 0 18 91 1 0 19 92 1 0 19 93 1 0 23 94 1 0 23 95 1 0 24 96 1 1 25 97 1 0 25 98 1 0 31 99 1 0 31100 1 0 32101 1 0 32102 1 0 34103 1 0 34104 1 0 34105 1 0 35106 1 0 35107 1 0 35108 1 0 36109 1 0 36110 1 0 36111 1 0 40112 1 0 40113 1 0 41114 1 0 41115 1 0 42116 1 0 42117 1 0 43118 1 0 43119 1 0 44120 1 0 44121 1 0 45122 1 0 45123 1 0 46124 1 0 46125 1 0 47126 1 0 47127 1 0 48128 1 0 48129 1 0 49130 1 0 49131 1 0 50132 1 0 50133 1 0 51134 1 0 51135 1 0 52136 1 0 52137 1 0 53138 1 0 53139 1 0 54140 1 0 54141 1 0 55142 1 0 55143 1 0 56144 1 0 56145 1 0 57146 1 0 57147 1 0 58148 1 0 58149 1 0 58150 1 0 M CHG 2 29 -1 33 1 M END