HMDB0261407 RDKit 3D PE(20:4(5Z,8Z,11Z,14Z)-OH(20)/18:2(9Z,12Z)) 128127 0 0 0 0 0 0 0 0999 V2000 10.6891 5.0927 1.9052 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0822 3.6392 2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2568 2.7480 1.1814 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7932 2.8528 1.4621 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9452 1.9630 0.5573 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3211 0.5787 0.7254 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7861 -0.2484 -0.1479 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0618 -0.0157 -1.5401 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8637 1.2639 -2.1741 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0724 1.5768 -3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2173 0.5996 -3.8331 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7216 1.0229 -3.7609 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2775 1.0985 -2.3329 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2937 -0.1997 -1.6624 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2873 -1.2407 -1.8004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7444 -1.6732 -3.0767 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7327 -0.8050 -3.7657 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4963 -0.7782 -2.8749 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5357 -0.0473 -3.1673 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4343 -1.5488 -1.7657 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4038 -1.6680 -0.8377 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8617 -1.1257 0.5259 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -1.3096 1.4676 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4024 -0.8818 1.5504 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 -0.1843 0.6135 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2905 -1.2020 2.6941 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6645 -0.6889 2.4457 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5846 -0.9931 3.6374 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1006 -0.3471 4.8479 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7794 0.4863 5.5634 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1627 1.0007 5.3892 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1628 2.4810 5.2599 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7557 3.1239 4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5391 2.6027 3.1599 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0525 2.9655 1.8268 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7394 2.1386 0.8616 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8054 0.7068 0.9016 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6914 -0.0359 0.0094 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5438 0.4072 -0.8523 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9031 1.7786 -1.2133 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6182 2.0713 -2.6734 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3574 1.1802 -3.6233 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8487 1.2527 -3.5338 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3208 2.6599 -3.8191 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9001 3.0224 -5.1132 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -3.1236 -0.6406 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -3.2600 0.2799 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2919 -4.9373 0.4569 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.3109 -5.0822 1.5547 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8769 -5.5883 -0.9668 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1606 -5.7074 0.8859 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3395 -6.8941 0.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6703 -7.4633 0.6696 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7226 -6.5047 0.3349 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4119 5.3297 0.8664 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8271 5.2805 2.5842 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5288 5.7751 2.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0408 3.3161 3.1273 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1431 3.5374 1.7463 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5306 3.0269 0.1436 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6522 1.7065 1.3333 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5010 3.9276 1.3209 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6362 2.6375 2.5423 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7663 2.3883 -0.4067 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9013 2.0445 1.0698 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1908 0.1705 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0246 -1.3226 0.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6560 -0.8847 -2.1374 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2013 -0.2260 -1.6575 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4906 2.1017 -1.7978 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 2.6269 -3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4443 0.6788 -4.9471 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2996 -0.4362 -3.5332 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6113 2.0118 -4.2696 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1429 0.3016 -4.3322 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0138 1.8033 -1.8347 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2788 1.6153 -2.2993 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3108 -0.7358 -1.8351 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4369 0.0132 -0.5175 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7589 -2.1929 -1.3154 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 -1.0117 -1.0349 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2070 -2.6684 -2.9229 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5325 -1.9406 -3.8248 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4365 -1.2653 -4.7279 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9797 0.2319 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5002 -1.0523 -1.0703 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1108 -0.0323 0.3719 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8412 -1.5772 0.7941 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -0.9370 3.6605 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3657 -2.3303 2.7043 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -1.2247 1.5894 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6413 0.3960 2.2439 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5944 -0.6940 3.3864 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5794 -2.0984 3.8315 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0542 -0.5698 5.2253 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2555 0.9172 6.4902 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7519 0.7026 6.2987 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5818 0.5558 4.4781 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6113 3.0797 6.0483 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6443 4.2542 4.3538 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7908 1.5517 3.2985 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5634 3.1374 3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9511 4.0737 1.6528 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3568 2.6138 -0.0675 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0735 0.3808 1.9543 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7674 0.2418 0.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6231 -1.1544 0.0809 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1032 -0.3764 -1.4198 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5646 2.5796 -0.5806 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0617 1.8036 -1.1739 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5219 1.8841 -2.8711 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8223 3.1216 -2.9232 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0960 1.5609 -4.6563 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9798 0.1296 -3.6057 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2656 0.9614 -2.5583 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2431 0.5478 -4.3229 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8844 3.3256 -3.0559 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4364 2.7072 -3.7305 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5991 3.6096 -5.4989 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9949 -3.6194 -0.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2817 -3.5846 -1.5947 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7537 -6.5691 -0.9486 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4771 -7.5810 0.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2589 -6.8393 -0.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9156 -8.4196 0.2026 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6437 -7.5328 1.7636 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6362 -5.6205 0.8411 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6816 -6.9232 0.4270 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 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 1 0 32 33 2 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 1 0 42 43 1 0 43 44 1 0 44 45 1 0 21 46 1 0 46 47 1 0 47 48 1 0 48 49 2 0 48 50 1 0 48 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 1 55 1 0 1 56 1 0 1 57 1 0 2 58 1 0 2 59 1 0 3 60 1 0 3 61 1 0 4 62 1 0 4 63 1 0 5 64 1 0 5 65 1 0 6 66 1 0 7 67 1 0 8 68 1 0 8 69 1 0 9 70 1 0 10 71 1 0 11 72 1 0 11 73 1 0 12 74 1 0 12 75 1 0 13 76 1 0 13 77 1 0 14 78 1 0 14 79 1 0 15 80 1 0 15 81 1 0 16 82 1 0 16 83 1 0 17 84 1 0 17 85 1 0 21 86 1 6 22 87 1 0 22 88 1 0 26 89 1 0 26 90 1 0 27 91 1 0 27 92 1 0 28 93 1 0 28 94 1 0 29 95 1 0 30 96 1 0 31 97 1 0 31 98 1 0 32 99 1 0 33100 1 0 34101 1 0 34102 1 0 35103 1 0 36104 1 0 37105 1 0 37106 1 0 38107 1 0 39108 1 0 40109 1 0 40110 1 0 41111 1 0 41112 1 0 42113 1 0 42114 1 0 43115 1 0 43116 1 0 44117 1 0 44118 1 0 45119 1 0 46120 1 0 46121 1 0 50122 1 0 52123 1 0 52124 1 0 53125 1 0 53126 1 0 54127 1 0 54128 1 0 M END