HMDB0289499 RDKit 3D PC(P-16:0/20:4(8Z,11Z,14Z,17Z)-2OH(5S,6R)) 135134 0 0 0 0 0 0 0 0999 V2000 4.4742 -4.9125 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4009 -4.7469 -3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1064 -5.2800 -3.5032 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2487 -4.5191 -4.1073 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3951 -3.0812 -4.4559 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2699 -3.0028 -5.9283 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3366 -2.3073 -6.5008 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3217 -1.5413 -5.7558 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9965 -2.0919 -6.2131 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9369 -1.4211 -6.8217 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7603 0.0035 -7.1084 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8781 0.8352 -6.6375 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8235 1.7335 -5.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6369 2.0960 -4.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9956 2.0886 -3.4543 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9911 3.1461 -3.3351 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7474 0.9032 -3.0071 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2435 1.2806 -1.6925 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0662 -0.3850 -2.7839 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9811 -0.3627 -1.7249 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4345 -1.7784 -1.5162 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6283 -1.7181 -0.5156 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1614 -2.8369 -0.1568 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1487 -0.6162 0.1058 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -0.6875 1.0470 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8765 -0.1218 2.3904 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8626 -0.6636 3.1257 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -0.7938 2.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2633 -1.5591 3.6608 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6952 -1.7551 3.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3242 -1.0108 2.3435 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7997 -1.3417 2.2993 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5631 -0.6821 1.2214 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6052 0.8033 1.2223 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2029 1.4012 2.4569 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2110 2.9156 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8033 3.6032 3.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0380 3.3625 4.7486 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6182 3.8880 4.6503 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6236 5.3882 4.3786 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3104 6.1694 5.4537 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2627 7.6401 5.0738 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9740 7.8605 3.7372 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 -0.0735 0.5711 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3886 -0.2502 1.6437 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9076 0.3586 1.2427 P 0 0 0 0 0 5 0 0 0 0 0 0 6.1197 1.7268 1.8256 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0634 0.4208 -0.4395 O 0 0 0 0 0 1 0 0 0 0 0 0 7.0851 -0.7358 1.8212 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6170 -1.4622 0.7847 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6501 -2.4578 1.2004 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1886 -3.4534 2.1147 N 0 0 0 0 0 4 0 0 0 0 0 0 6.7821 -3.7180 2.0264 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4829 -3.0375 3.4683 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8578 -4.7184 1.7989 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5099 -4.6810 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7408 -5.9597 -1.2796 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3150 -4.2775 -1.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6689 -3.7440 -3.3437 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2257 -5.4538 -3.4331 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8414 -6.3451 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2911 -4.9670 -4.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6588 -2.5483 -3.8709 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4282 -2.6822 -4.2164 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0229 -3.5785 -6.5259 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2671 -2.2655 -7.6038 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4899 -0.4839 -6.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3262 -1.6070 -4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1376 -3.1535 -5.9958 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8555 -1.9051 -7.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7788 0.0979 -8.2769 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8411 0.4762 -6.7632 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8531 0.6360 -7.1431 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7508 2.2910 -5.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3688 3.1460 -5.1981 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7876 1.3992 -5.0297 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 2.3863 -2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5587 3.9986 -3.6016 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6323 0.7622 -3.6523 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7883 0.4682 -1.4541 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8228 -1.1125 -2.4108 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6972 -0.7909 -3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1614 0.2817 -2.0863 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3878 0.0502 -0.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1561 -2.2112 -2.4644 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3221 -2.3679 -1.1146 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4213 -1.7652 1.1893 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 0.9714 2.2253 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8255 -0.0952 2.9692 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.2838 2.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7328 -2.0535 4.4733 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8594 -2.8640 3.3399 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2876 -1.5291 4.4227 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8395 -1.3644 1.3975 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1632 0.0683 2.3785 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8977 -2.4565 2.1318 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2018 -1.1767 3.3188 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5968 -1.0729 1.1161 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0679 -0.9748 0.2462 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6351 1.2806 1.0497 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 1.1204 0.3682 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6718 1.1272 3.3819 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2582 1.0755 2.5439 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2242 3.2805 1.9964 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9002 3.1274 1.4239 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8330 3.2392 3.6367 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8494 4.6703 3.2618 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5368 3.9012 5.5679 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9977 2.3062 5.0211 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 3.7531 5.6176 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0299 3.4086 3.8688 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5638 5.7091 4.3639 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0255 5.6101 3.3662 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3869 5.9214 5.5763 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7409 6.0533 6.3832 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7373 8.2689 5.8691 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2286 8.0119 4.9473 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3093 7.6357 2.8912 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3160 8.9209 3.6523 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8721 7.2143 3.7061 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3894 1.0198 0.4198 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8894 -0.6190 -0.2956 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8643 -1.9735 0.1511 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1033 -0.7052 0.1023 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5983 -1.9573 1.5571 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9778 -2.9817 0.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1372 -2.8640 1.8437 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 -4.3337 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6423 -4.4037 1.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8303 -2.1958 3.7487 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1862 -3.8740 4.1669 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5506 -2.8565 3.5751 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8088 -4.8362 0.6761 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2294 -5.5452 2.1835 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8912 -4.7164 2.1681 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 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 1 0 15 16 1 0 15 17 1 0 17 18 1 0 17 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 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 25 44 1 0 44 45 1 0 45 46 1 0 46 47 2 0 46 48 1 0 46 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 52 54 1 0 52 55 1 0 1 56 1 0 1 57 1 0 1 58 1 0 2 59 1 0 2 60 1 0 3 61 1 0 4 62 1 0 5 63 1 0 5 64 1 0 6 65 1 0 7 66 1 0 8 67 1 0 8 68 1 0 9 69 1 0 10 70 1 0 11 71 1 0 11 72 1 0 12 73 1 0 13 74 1 0 14 75 1 0 14 76 1 0 15 77 1 1 16 78 1 0 17 79 1 6 18 80 1 0 19 81 1 0 19 82 1 0 20 83 1 0 20 84 1 0 21 85 1 0 21 86 1 0 25 87 1 1 26 88 1 0 26 89 1 0 28 90 1 0 29 91 1 0 30 92 1 0 30 93 1 0 31 94 1 0 31 95 1 0 32 96 1 0 32 97 1 0 33 98 1 0 33 99 1 0 34100 1 0 34101 1 0 35102 1 0 35103 1 0 36104 1 0 36105 1 0 37106 1 0 37107 1 0 38108 1 0 38109 1 0 39110 1 0 39111 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 43120 1 0 44121 1 0 44122 1 0 50123 1 0 50124 1 0 51125 1 0 51126 1 0 53127 1 0 53128 1 0 53129 1 0 54130 1 0 54131 1 0 54132 1 0 55133 1 0 55134 1 0 55135 1 0 M CHG 2 48 -1 52 1 M END