HMDB0285282 RDKit 3D PE(P-18:0/20:4(5Z,8Z,11Z,14Z)-OH(19S)) 131130 0 0 0 0 0 0 0 0999 V2000 -16.0607 1.9502 0.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5434 1.7183 0.2712 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9639 2.5888 1.3465 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4848 2.3659 1.4403 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7677 2.7007 0.1472 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2965 2.4446 0.3405 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4791 2.7506 -0.8723 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8533 1.9671 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7428 0.4920 -1.9349 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3179 0.0636 -1.5866 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3299 -1.4365 -1.4734 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9786 -1.9472 -1.1036 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9534 -1.5753 -2.1279 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5835 -2.1404 -1.7476 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5628 -1.7663 -2.7776 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3639 -0.2893 -2.9312 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9223 0.2575 -1.6223 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7682 0.8510 -1.4327 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4705 1.3222 -0.1547 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4378 0.4153 0.9052 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3814 -0.6248 0.7001 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3115 -1.5839 1.8928 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4979 -2.2930 2.0577 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3383 -3.3504 3.3888 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.7014 -2.6450 4.5538 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8888 -3.8603 3.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3765 -4.6738 2.9583 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -4.8607 3.8511 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5153 -6.0516 3.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7497 -7.2719 3.3932 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -0.0007 0.6582 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7419 -0.2347 -0.3733 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4477 -1.0017 -1.3192 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1035 0.4532 -0.3733 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -0.2753 0.7096 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1115 -1.6846 0.4369 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9238 -2.3645 -0.4827 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8774 -2.1017 -1.2798 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5963 -0.9322 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 0.3872 -1.0821 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3623 1.0498 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6394 0.4493 0.0159 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8542 0.3943 1.4819 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8444 0.9843 2.0717 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8748 1.7853 1.3265 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1572 1.1274 1.5923 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9435 0.6648 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7431 0.7003 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9020 1.3390 -1.4815 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2426 2.7347 -1.2051 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1967 3.7122 -1.6293 C 0 0 2 0 0 0 0 0 0 0 0 0 13.6648 5.1358 -1.2784 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9259 3.5101 -1.2155 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.2682 3.0261 0.0111 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5297 1.6973 1.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4726 1.3441 -0.6608 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3487 0.6466 0.4786 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1356 1.9418 -0.7161 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2196 3.6484 1.1558 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4320 2.3272 2.3276 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2430 1.3379 1.7349 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0389 3.0211 2.2417 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0003 3.7405 -0.1657 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1194 1.9897 -0.6394 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2077 1.3816 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9469 3.0572 1.1988 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3931 2.6816 -0.6562 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6465 3.8363 -1.1229 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9302 2.2163 -2.3056 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1934 2.2999 -2.9139 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4552 0.0684 -1.2134 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9404 0.0355 -2.9411 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0097 0.5507 -0.6421 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6209 0.3932 -2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0437 -1.7391 -0.6517 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6891 -1.8934 -2.4339 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9547 -3.0576 -0.9917 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7256 -1.5539 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2354 -2.0517 -3.0895 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8641 -0.5007 -2.3221 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2496 -1.7812 -0.7605 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6304 -3.2552 -1.6871 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8340 -2.1965 -3.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6165 -2.2756 -2.4986 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2493 0.2548 -3.2546 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5291 -0.0965 -3.6428 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 0.1533 -0.7856 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 0.9832 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 1.0024 1.8475 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4272 -0.1008 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5776 -1.2292 -0.2074 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5022 -2.3214 1.7516 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0907 -1.0414 2.8231 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1013 -4.7736 3.4618 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3223 -3.9583 3.8387 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2474 -5.0369 4.8788 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9087 -5.8472 2.3985 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3496 -6.2119 4.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9258 -7.8244 2.5228 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2655 -7.0707 3.5358 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0071 1.5138 -0.1232 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4721 0.3253 -1.3786 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 0.2989 1.0241 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2189 -0.1829 1.6504 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1967 -2.1832 1.4959 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0173 -2.0879 0.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6498 -3.5193 -0.5276 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2476 -3.0491 -1.8967 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7086 -1.2150 -1.7391 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3924 -0.7598 -2.7794 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5428 0.9636 -1.3483 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1048 2.0471 -0.0302 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4531 0.8155 -0.5891 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5801 -0.6657 -0.2576 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1235 -0.1871 2.0964 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0145 0.9496 3.1602 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6705 1.8744 0.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8079 2.8021 1.7892 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4004 1.0622 2.6889 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8870 0.1814 1.0594 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7738 1.0432 -1.1154 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7807 -0.3902 -1.0882 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8123 0.6922 -1.2391 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6853 1.1779 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5858 2.9178 -0.1516 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1701 3.0166 -1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2405 3.7154 -2.7714 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3999 5.2793 -0.2127 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1411 5.8671 -1.9187 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7471 5.1750 -1.3891 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3172 3.3544 -2.0000 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 1 0 7 8 1 0 8 9 1 0 9 10 1 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 2 0 18 19 1 0 19 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 24 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 21 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 1 0 40 41 2 0 41 42 1 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 1 0 46 47 2 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 51 53 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 0 3 60 1 0 4 61 1 0 4 62 1 0 5 63 1 0 5 64 1 0 6 65 1 0 6 66 1 0 7 67 1 0 7 68 1 0 8 69 1 0 8 70 1 0 9 71 1 0 9 72 1 0 10 73 1 0 10 74 1 0 11 75 1 0 11 76 1 0 12 77 1 0 12 78 1 0 13 79 1 0 13 80 1 0 14 81 1 0 14 82 1 0 15 83 1 0 15 84 1 0 16 85 1 0 16 86 1 0 17 87 1 0 18 88 1 0 20 89 1 0 20 90 1 0 21 91 1 6 22 92 1 0 22 93 1 0 26 94 1 0 28 95 1 0 28 96 1 0 29 97 1 0 29 98 1 0 30 99 1 0 30100 1 0 34101 1 0 34102 1 0 35103 1 0 35104 1 0 36105 1 0 36106 1 0 37107 1 0 38108 1 0 39109 1 0 39110 1 0 40111 1 0 41112 1 0 42113 1 0 42114 1 0 43115 1 0 44116 1 0 45117 1 0 45118 1 0 46119 1 0 47120 1 0 48121 1 0 48122 1 0 49123 1 0 49124 1 0 50125 1 0 50126 1 0 51127 1 6 52128 1 0 52129 1 0 52130 1 0 53131 1 0 M END