HMDB0262215 RDKit 3D PE(22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)/20:3(5Z,8Z,11Z)) 135134 0 0 0 0 0 0 0 0999 V2000 -15.2937 -0.0814 4.2039 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6391 -0.5201 2.9155 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7718 0.5391 2.3911 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0470 1.1656 1.2762 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2515 0.8638 0.5006 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8787 0.3781 -0.8511 C 0 0 1 0 0 0 0 0 0 0 0 0 -14.0798 1.3879 -1.4434 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2158 -0.8998 -0.9834 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8935 -1.0907 -1.0445 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2506 -2.3755 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9427 -2.5009 -1.2171 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1179 -1.3289 -1.0882 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8124 -1.2945 -1.1568 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2564 0.1450 -0.9358 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.2054 1.1014 -1.1096 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7398 0.0465 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3994 1.1723 1.2427 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2888 1.5794 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0241 0.7965 1.6155 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1142 1.8840 1.1283 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7386 1.9585 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1774 0.9906 -1.1118 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8659 0.5290 -1.7565 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0184 0.1538 -0.6144 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5154 1.0436 0.1621 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6964 -1.1346 -0.3057 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7283 -1.3947 0.7272 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5354 -0.9382 0.2627 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6912 -0.5049 -1.2801 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7978 0.2720 -1.0821 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9392 1.8141 -1.5391 P 0 0 0 0 0 5 0 0 0 0 0 0 0.5041 2.5025 -1.3326 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8897 2.5859 -0.3272 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3181 2.2704 -3.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7656 1.0725 -3.7381 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 1.0996 -4.9979 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0205 0.0380 -5.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6296 -1.4918 0.8097 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7129 -2.0206 0.1387 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5816 -2.1655 -1.1412 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -2.3614 0.8337 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -2.8775 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2163 -2.1019 -1.3197 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9593 -0.6931 -1.3714 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5492 0.4177 -1.5442 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0226 0.4663 -1.7587 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3596 1.5499 -0.7468 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5317 1.3280 0.5242 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3590 -0.0726 1.0689 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4787 -0.8812 0.4897 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6703 -0.3787 0.6456 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8309 0.9175 1.4207 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0279 0.3614 2.3901 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1033 0.2303 1.3541 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0088 -0.9120 1.6481 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0768 -1.0113 0.6059 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0636 0.0920 0.5501 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9598 0.1938 1.7337 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3552 0.4677 3.0647 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1818 0.5734 4.0172 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5379 -0.9305 4.8443 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5645 0.5585 4.7148 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2332 -1.1013 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8670 -1.3146 3.3037 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8541 0.8346 2.9352 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3963 1.9481 0.8798 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8862 1.8155 0.3177 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9943 0.2258 1.0291 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8118 0.3884 -1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4547 1.7880 -2.2396 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8171 -1.8059 -0.9859 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3017 -0.1628 -1.0236 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9106 -3.2555 -1.2633 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5524 -3.5336 -1.3278 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6131 -0.3424 -0.9066 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2022 -2.0914 -1.3345 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3969 0.2341 -1.6023 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6572 1.3478 -0.2223 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8590 -0.6955 0.3591 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5197 -0.6031 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2430 1.9559 1.4393 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1898 2.4923 2.3488 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1038 -0.0757 1.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6909 0.5287 2.6316 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7662 2.6222 1.8559 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0382 2.7437 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6260 0.0516 -0.7569 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8551 1.3779 -1.8723 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4504 1.3754 -2.3305 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0332 -0.3646 -2.3871 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8061 -2.4408 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0735 -0.7491 1.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7232 0.2390 0.5366 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 0.0931 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7249 -1.4296 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3466 3.2357 0.1452 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8113 1.2946 -4.1479 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6521 0.2529 -3.1183 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7971 2.1303 -5.3575 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7907 0.9697 -4.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2738 -0.6776 -5.8348 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9075 -0.3307 -6.1289 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -1.4568 1.3737 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8226 -3.1104 1.6624 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9890 -3.0866 0.4923 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7111 -3.9437 -0.3938 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2165 -2.4345 -1.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5234 -2.6285 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 -0.4283 -1.0299 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0279 1.4043 -1.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2292 0.8986 -2.7885 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5589 -0.4250 -1.6601 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4231 2.5814 -1.1417 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7674 2.1770 1.2012 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5081 -0.0721 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3803 -0.4653 0.8897 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2596 -1.8186 -0.0151 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5407 -0.8681 0.2616 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1677 1.7529 0.9199 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0783 1.0662 2.2015 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1823 1.1238 3.1467 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -0.5489 2.7997 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7875 0.3486 0.3078 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7230 1.2120 1.5053 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2453 -0.9472 2.6758 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3609 -1.8614 1.4557 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5640 -2.0046 0.6907 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5283 -1.0029 -0.3875 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5452 1.0811 0.3853 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6724 -0.0422 -0.3596 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8051 0.9077 1.5183 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4839 -0.8285 1.7726 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1283 -0.4726 3.6467 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4772 1.1296 3.0748 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1490 0.9678 3.7156 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 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 2 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 1 0 30 31 1 0 31 32 2 0 31 33 1 0 31 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 28 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 2 0 45 46 1 0 46 47 1 0 47 48 2 0 48 49 1 0 49 50 1 0 50 51 2 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 57 58 1 0 58 59 1 0 1 60 1 0 1 61 1 0 1 62 1 0 2 63 1 0 2 64 1 0 3 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 6 7 70 1 0 8 71 1 0 9 72 1 0 10 73 1 0 11 74 1 0 12 75 1 0 13 76 1 0 14 77 1 6 15 78 1 0 16 79 1 0 16 80 1 0 17 81 1 0 18 82 1 0 19 83 1 0 19 84 1 0 20 85 1 0 21 86 1 0 22 87 1 0 22 88 1 0 23 89 1 0 23 90 1 0 27 91 1 0 27 92 1 0 28 93 1 1 29 94 1 0 29 95 1 0 33 96 1 0 35 97 1 0 35 98 1 0 36 99 1 0 36100 1 0 37101 1 0 37102 1 0 41103 1 0 41104 1 0 42105 1 0 42106 1 0 43107 1 0 43108 1 0 44109 1 0 45110 1 0 46111 1 0 46112 1 0 47113 1 0 48114 1 0 49115 1 0 49116 1 0 50117 1 0 51118 1 0 52119 1 0 52120 1 0 53121 1 0 53122 1 0 54123 1 0 54124 1 0 55125 1 0 55126 1 0 56127 1 0 56128 1 0 57129 1 0 57130 1 0 58131 1 0 58132 1 0 59133 1 0 59134 1 0 59135 1 0 M END