HMDB0284516 RDKit 3D PE(24:0/20:4(8Z,11Z,14Z,17Z)-2OH(5S,6R)) 151150 0 0 0 0 0 0 0 0999 V2000 15.9373 5.7259 1.5831 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8524 4.6795 1.8308 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1680 4.3745 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1435 3.1803 0.0506 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8006 1.9985 0.6448 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7921 1.4912 -0.3534 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6912 0.2870 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6609 -0.7275 -0.4883 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9542 -1.0634 -1.7252 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6667 -0.8693 -1.8775 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7772 -0.3007 -0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7185 -1.3156 -0.5819 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4407 -1.1134 -0.7538 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9408 0.1761 -1.2397 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9986 0.8678 -0.2395 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6630 1.0797 0.9675 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6030 2.1856 -0.8746 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8839 2.8474 -1.0789 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8103 3.0846 -0.0317 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5137 2.7384 0.5363 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3335 2.4345 -0.2838 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3997 1.2325 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9913 1.0708 -2.1963 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7127 0.0495 -0.6857 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7043 -1.1381 -1.3940 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3707 -1.3286 -2.1389 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2645 -1.3060 -1.2432 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0276 -1.4062 -1.7383 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1518 -1.5234 -3.0076 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2653 -1.3869 -0.9539 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9903 -1.6632 0.4811 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2498 -1.6386 1.3314 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8516 -0.2820 1.2795 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1197 -0.2319 2.0835 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 -1.1877 1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4743 -0.8370 0.1274 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5270 -1.6939 -0.4817 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8778 -1.5777 0.1945 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8331 -2.4990 -0.5255 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9724 -2.1920 -1.9768 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4623 -0.8279 -2.3171 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8233 -0.5688 -1.7607 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3136 0.8293 -2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7323 0.9579 -1.5045 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2824 2.2954 -1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6236 2.6991 -1.4704 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0413 2.8099 -0.0668 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0637 1.6154 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6716 1.8049 2.1601 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1111 1.9127 2.3281 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0114 2.8407 1.6291 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.2407 2.5687 0.1764 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1514 -2.3682 -0.6914 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -3.4916 -1.5176 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6014 -4.8928 -0.7495 P 0 0 0 0 0 5 0 0 0 0 0 0 6.0019 -5.2570 -1.2412 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5053 -6.1196 -1.2155 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 -4.7759 0.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5034 -6.0784 1.4289 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5606 -6.0742 2.9249 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3836 -7.3849 3.4936 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0553 5.8711 0.4739 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7215 6.6971 2.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8786 5.3291 2.0299 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2055 3.8449 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1050 5.2095 2.5165 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6540 5.2286 0.0854 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5982 3.0647 -0.8921 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0144 1.2578 0.8938 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3354 2.1868 1.5757 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5877 2.1538 -0.6686 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4558 -0.0248 -1.5598 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1107 -0.5945 0.4146 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3094 -1.6702 -0.2632 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5143 -1.5039 -2.5825 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2094 -1.1551 -2.8542 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2983 -0.1978 0.1479 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4243 0.7013 -1.0718 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0679 -2.2911 -0.2169 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7643 -1.9565 -0.5173 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2084 -0.1059 -2.0829 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6332 0.8454 -1.7211 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1069 0.2761 -0.0593 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0760 1.9632 1.0485 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2716 2.0249 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7120 3.8111 -1.0951 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6758 4.0528 -0.6529 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4762 3.4936 0.8111 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2048 3.6542 1.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6244 1.9664 1.3906 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3819 2.4068 0.3319 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2282 3.2949 -1.0256 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4201 -0.9723 -2.2719 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3082 -0.5679 -2.9151 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -2.3220 -2.6376 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9736 -2.1680 -1.3462 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7376 -0.3921 -1.1349 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3253 -0.8726 0.8815 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4642 -2.6308 0.5599 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8976 -2.4385 0.9586 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9172 -1.8117 2.3867 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1448 0.4443 1.7825 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 0.1465 0.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8662 -0.5973 3.1185 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5443 0.7768 2.0788 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0778 -1.0538 2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8731 -2.2319 1.5914 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5474 -0.9803 -0.4549 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 0.2260 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2461 -2.7840 -0.4238 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5963 -1.4396 -1.5557 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8380 -1.8940 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2523 -0.5319 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4525 -3.5371 -0.4119 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8395 -2.4943 -0.0515 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7424 -2.9152 -2.3844 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0503 -2.4336 -2.5629 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5099 -0.7812 -3.4434 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7281 -0.0334 -2.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5373 -1.2852 -2.2207 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8551 -0.6878 -0.6727 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6770 1.5555 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3409 1.0060 -3.2082 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5012 0.8405 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3731 0.1460 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1012 2.5473 -2.9365 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5653 3.0452 -1.3369 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7956 3.7304 -1.9669 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4262 2.0616 -1.9891 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8502 3.5240 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1534 3.4543 0.4566 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5517 0.7514 0.2988 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0166 1.2210 1.0129 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1337 2.6910 2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3076 0.9473 2.8389 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.2956 2.0581 3.4704 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.5099 0.8249 2.1928 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.6877 3.9229 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.0236 2.8568 2.1613 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.6613 1.7066 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.0977 3.4406 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.3251 2.2560 0.0051 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5507 -2.6156 0.2059 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2036 -2.2753 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3791 -5.9903 -2.1953 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3181 -6.6914 1.0229 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5019 -6.4008 1.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5264 -5.6902 3.2999 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7798 -5.4219 3.3768 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0633 -8.0940 3.1551 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3888 -7.6958 3.4255 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 28 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 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 25 53 1 0 53 54 1 0 54 55 1 0 55 56 2 0 55 57 1 0 55 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 1 62 1 0 1 63 1 0 1 64 1 0 2 65 1 0 2 66 1 0 3 67 1 0 4 68 1 0 5 69 1 0 5 70 1 0 6 71 1 0 7 72 1 0 8 73 1 0 8 74 1 0 9 75 1 0 10 76 1 0 11 77 1 0 11 78 1 0 12 79 1 0 13 80 1 0 14 81 1 0 14 82 1 0 15 83 1 1 16 84 1 0 17 85 1 6 18 86 1 0 19 87 1 0 19 88 1 0 20 89 1 0 20 90 1 0 21 91 1 0 21 92 1 0 25 93 1 6 26 94 1 0 26 95 1 0 30 96 1 0 30 97 1 0 31 98 1 0 31 99 1 0 32100 1 0 32101 1 0 33102 1 0 33103 1 0 34104 1 0 34105 1 0 35106 1 0 35107 1 0 36108 1 0 36109 1 0 37110 1 0 37111 1 0 38112 1 0 38113 1 0 39114 1 0 39115 1 0 40116 1 0 40117 1 0 41118 1 0 41119 1 0 42120 1 0 42121 1 0 43122 1 0 43123 1 0 44124 1 0 44125 1 0 45126 1 0 45127 1 0 46128 1 0 46129 1 0 47130 1 0 47131 1 0 48132 1 0 48133 1 0 49134 1 0 49135 1 0 50136 1 0 50137 1 0 51138 1 0 51139 1 0 52140 1 0 52141 1 0 52142 1 0 53143 1 0 53144 1 0 57145 1 0 59146 1 0 59147 1 0 60148 1 0 60149 1 0 61150 1 0 61151 1 0 M END