HMDB0286462 RDKit 3D PC(20:4(6E,8Z,11Z,14Z)+=O(5)/18:1(9Z)) 137136 0 0 0 0 0 0 0 0999 V2000 -5.7022 -7.1502 1.5148 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4947 -6.5201 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1027 -5.1807 -0.0581 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1633 -4.0436 0.8808 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2636 -4.1126 2.0647 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 -2.9491 2.9612 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 -2.1349 3.2116 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0973 -2.1005 2.7479 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4927 -3.0175 1.8313 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4536 -3.8295 2.0819 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7827 -3.9011 3.3373 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5912 -3.5313 3.5112 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4231 -3.0635 2.6463 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1672 -2.7950 1.2723 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1201 -2.3086 0.4706 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8669 -2.0378 -0.9338 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7588 -2.2679 -1.4796 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9731 -1.4750 -1.7089 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7681 -1.4410 -3.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0434 -0.7601 -3.7454 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0906 0.6425 -3.2561 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9689 1.1418 -2.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2121 1.4178 -3.1113 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3087 2.7186 -2.6473 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8488 2.9139 -1.1998 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8324 2.1436 -0.3272 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7008 0.8211 -0.6638 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7208 -0.2340 0.1474 P 0 0 0 0 0 5 0 0 0 0 0 0 8.0534 0.4821 0.3495 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1244 -0.7127 1.6318 O 0 0 0 0 0 1 0 0 0 0 0 0 7.0289 -1.5262 -0.8999 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6428 -2.7489 -0.4123 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9704 -3.7699 -1.4858 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6283 -5.1106 -1.1492 N 0 0 0 0 0 4 0 0 0 0 0 0 7.7323 -5.9886 -0.8928 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6986 -5.2073 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9016 -5.6770 -2.3016 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5341 2.5666 -1.0339 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5155 3.4026 -0.6888 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7783 4.6090 -0.4829 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1409 2.8287 -0.5844 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0669 3.7965 -0.2998 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0816 4.9006 -1.3085 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2564 5.8044 -0.9838 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3906 6.9166 -1.9499 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5713 6.6392 -3.3704 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7787 5.9193 -3.8673 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9575 4.5682 -3.3292 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0247 4.1325 -2.6757 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1853 4.9720 -2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5045 5.1344 -0.9193 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 3.7722 -0.3523 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1443 3.8026 1.0957 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0459 4.3794 1.9667 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7943 3.5141 1.8032 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6617 4.0394 2.6483 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0059 4.0503 4.1113 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 -7.2065 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5299 -8.2678 1.2868 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6766 -6.7691 1.6074 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3916 -7.2140 -0.4802 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5987 -6.5951 0.6447 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7376 -4.8866 -0.9689 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0904 -5.3014 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0843 -3.0744 0.3287 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2403 -4.0115 1.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7509 -4.9574 2.7027 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2706 -4.5171 1.9226 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 -2.7866 3.4427 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7292 -1.2938 3.9335 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8979 -0.9998 2.3447 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4115 -2.0156 3.6616 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8881 -3.0673 0.8017 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1817 -4.4965 1.2365 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3654 -3.4632 4.2091 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8473 -5.0365 3.6387 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0154 -3.6682 4.5577 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4604 -2.8529 3.0404 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -2.9331 0.7944 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0765 -2.1230 0.8841 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9392 -2.0133 -1.5173 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1216 -0.4272 -1.3651 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6692 -2.4155 -3.6723 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8916 -0.7777 -3.4186 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0994 -0.8616 -4.8284 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -1.2963 -3.2803 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7131 3.4134 -3.2604 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3726 3.0268 -2.6791 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9964 3.9918 -0.9997 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8582 2.4901 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7125 2.3881 0.7285 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3278 -2.9724 0.4492 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6282 -2.8193 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0873 -3.7370 -1.6184 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4701 -3.4558 -2.4088 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3935 -7.0419 -1.1326 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9489 -6.0024 0.2029 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6273 -5.8008 -1.4947 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7523 -4.6579 -0.2374 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1196 -4.8832 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4141 -6.2726 0.0545 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7793 -6.7690 -2.2182 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -5.2203 -2.3952 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4256 -5.4759 -3.2548 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8782 2.3013 -1.5457 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1602 1.9919 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9081 3.2237 -0.3388 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 4.1824 0.7449 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8209 5.5665 -1.2021 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1901 4.5296 -2.3344 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1977 5.2602 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0645 6.2740 0.0222 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4373 7.5470 -1.8555 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2297 7.5777 -1.5919 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4437 7.5934 -3.9756 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6331 6.0627 -3.7129 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6563 5.7559 -5.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6927 6.5629 -3.8276 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1063 3.8753 -3.5119 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0122 3.0825 -2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2559 5.9232 -2.9217 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0848 4.3804 -2.7967 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4339 5.7262 -0.8289 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6958 5.6687 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9607 3.0520 -0.5362 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6873 3.3861 -0.8984 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3157 2.7361 1.4133 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1116 4.3209 1.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3304 4.3474 3.0273 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8139 5.4260 1.7061 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4795 3.5793 0.7374 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9933 2.4741 2.0732 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4358 5.1057 2.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7669 3.4427 2.4576 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0862 4.1164 4.7083 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4829 3.0720 4.3678 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6608 4.8885 4.4027 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 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 16 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 34 35 1 0 34 36 1 0 34 37 1 0 25 38 1 0 38 39 1 0 39 40 2 0 39 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 2 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 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 3 64 1 0 4 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 0 7 70 1 0 8 71 1 0 8 72 1 0 9 73 1 0 10 74 1 0 11 75 1 0 11 76 1 0 12 77 1 0 13 78 1 0 14 79 1 0 15 80 1 0 18 81 1 0 18 82 1 0 19 83 1 0 19 84 1 0 20 85 1 0 20 86 1 0 24 87 1 0 24 88 1 0 25 89 1 1 26 90 1 0 26 91 1 0 32 92 1 0 32 93 1 0 33 94 1 0 33 95 1 0 35 96 1 0 35 97 1 0 35 98 1 0 36 99 1 0 36100 1 0 36101 1 0 37102 1 0 37103 1 0 37104 1 0 41105 1 0 41106 1 0 42107 1 0 42108 1 0 43109 1 0 43110 1 0 44111 1 0 44112 1 0 45113 1 0 45114 1 0 46115 1 0 46116 1 0 47117 1 0 47118 1 0 48119 1 0 49120 1 0 50121 1 0 50122 1 0 51123 1 0 51124 1 0 52125 1 0 52126 1 0 53127 1 0 53128 1 0 54129 1 0 54130 1 0 55131 1 0 55132 1 0 56133 1 0 56134 1 0 57135 1 0 57136 1 0 57137 1 0 M CHG 2 30 -1 34 1 M END