HMDB0272776 RDKit 3D PGP(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/18:1(9Z)) 141140 0 0 0 0 0 0 0 0999 V2000 -5.6456 -4.4563 3.7386 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0174 -4.2343 4.3665 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8207 -3.5060 5.6354 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3467 -2.3382 5.8796 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1917 -1.6028 4.9417 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5842 -0.2552 4.5971 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4848 0.4340 5.8081 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2261 -0.3443 4.0319 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9641 -0.8750 2.8128 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6177 -0.9313 2.3162 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3072 -1.4300 1.1522 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2809 -1.9805 0.2388 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1929 -3.3625 -0.1192 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3983 -4.2935 0.2803 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3465 -4.1709 1.2451 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5643 -5.1949 1.5807 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -4.9848 2.6039 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1662 -5.0266 3.8425 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5525 -6.1065 2.6001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7235 -6.0713 2.9381 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3332 -4.8138 3.3663 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4995 -4.3466 2.5717 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3152 -4.1323 1.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2941 -3.1686 0.7055 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -3.6373 0.1844 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3876 -1.7937 0.8351 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -1.0224 0.3687 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4606 0.4570 0.5944 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3801 0.6437 2.1191 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3043 1.9663 2.4681 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 2.0528 4.1777 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.6603 3.1039 4.6673 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1253 0.5180 4.7518 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8876 2.4559 4.6047 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4663 1.5057 5.4105 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9043 1.9997 5.6615 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5428 1.0854 6.4656 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5654 2.1086 4.2806 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4744 0.8329 3.7268 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1293 0.7226 2.1900 P 0 0 0 0 0 5 0 0 0 0 0 0 6.4650 1.3686 2.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0233 1.3099 1.0474 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3272 -0.9407 1.8454 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7172 1.0378 0.0082 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5747 2.1128 -0.8789 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 2.5105 -1.0874 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7872 2.6716 -1.4802 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 3.9210 -2.2471 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6242 3.9115 -3.3645 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8612 2.9668 -4.4883 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2493 3.1405 -5.5175 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0055 2.1626 -6.6308 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8898 2.0909 -7.7431 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1998 1.7475 -7.9825 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1254 1.2758 -7.2267 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8624 1.0070 -5.8499 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7511 1.8253 -4.9014 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2215 1.5363 -5.1106 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0356 2.3713 -4.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5109 2.1395 -4.2934 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0394 2.4684 -5.6737 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5452 2.1738 -5.6083 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1232 3.0782 -4.5252 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0173 -3.5499 3.8068 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0943 -5.2635 4.2868 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8239 -4.8302 2.7313 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6276 -3.7671 3.6131 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4757 -5.2149 4.6416 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1797 -4.0133 6.4051 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1149 -1.9118 6.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1766 -1.4303 5.4969 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5011 -2.1144 4.0266 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2596 0.3392 3.9471 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7674 1.1183 5.7747 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3694 0.0139 4.5723 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8551 -1.2190 2.3219 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7629 -0.5474 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2299 -1.3722 0.8297 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 -1.7865 0.5779 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2289 -1.3108 -0.7112 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9464 -3.7087 -0.8865 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 -5.3236 -0.1638 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1357 -3.2806 1.7761 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6886 -6.1478 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0679 -3.9811 2.5414 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7917 -5.8007 3.7593 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9454 -7.0783 2.2894 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3192 -6.9615 2.8998 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7469 -5.0280 4.4127 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6584 -3.9611 3.5037 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9342 -3.4614 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2992 -5.1405 2.6848 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3033 -3.7345 0.7288 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2059 -5.1166 0.6116 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6394 -1.3225 0.8677 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -1.1571 -0.7425 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3549 0.9263 0.1952 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3088 0.1360 2.5112 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4575 0.0164 2.4854 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 0.4754 5.2286 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5214 0.5136 4.9299 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9892 1.3706 6.3997 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7997 3.0143 6.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1417 0.5331 5.8965 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0172 2.8648 3.6893 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6185 2.3692 4.3724 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 0.8745 0.1686 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8838 -1.0471 1.0219 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 1.8585 -2.0537 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4944 2.9027 -0.6443 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2698 4.7174 -1.5344 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5797 4.2496 -2.6367 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6725 4.9491 -3.8272 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4524 3.8832 -3.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9074 1.9135 -4.2402 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8112 3.2637 -4.9802 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0809 4.2127 -5.8718 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2318 3.1815 -5.0911 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0089 2.5312 -7.0474 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3855 1.1684 -6.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7452 3.1324 -8.2573 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2771 1.4894 -8.5369 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5481 1.9033 -9.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1602 1.0549 -7.5831 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8677 0.8813 -5.4608 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3015 -0.0524 -5.6731 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5991 2.8805 -5.1354 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4823 1.6564 -3.8552 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3946 0.4777 -4.8695 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5498 1.8082 -6.1365 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8402 3.4636 -4.2847 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7641 2.1053 -3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7686 1.0846 -4.0595 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0981 2.7774 -3.5853 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5554 1.8868 -6.4754 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8985 3.5433 -5.9074 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6917 1.1006 -5.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0146 2.3595 -6.5902 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1588 3.3339 -4.8732 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5301 3.9947 -4.3741 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1210 2.5062 -3.5776 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 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 2 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 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 36 38 1 0 38 39 1 0 39 40 1 0 40 41 2 0 40 42 1 0 40 43 1 0 28 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 2 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 1 64 1 0 1 65 1 0 1 66 1 0 2 67 1 0 2 68 1 0 3 69 1 0 4 70 1 0 5 71 1 0 5 72 1 0 6 73 1 6 7 74 1 0 8 75 1 0 9 76 1 0 10 77 1 0 11 78 1 0 12 79 1 0 12 80 1 0 13 81 1 0 14 82 1 0 15 83 1 0 16 84 1 0 17 85 1 6 18 86 1 0 19 87 1 0 20 88 1 0 21 89 1 0 21 90 1 0 22 91 1 0 22 92 1 0 23 93 1 0 23 94 1 0 27 95 1 0 27 96 1 0 28 97 1 6 29 98 1 0 29 99 1 0 33100 1 0 35101 1 0 35102 1 0 36103 1 1 37104 1 0 38105 1 0 38106 1 0 42107 1 0 43108 1 0 47109 1 0 47110 1 0 48111 1 0 48112 1 0 49113 1 0 49114 1 0 50115 1 0 50116 1 0 51117 1 0 51118 1 0 52119 1 0 52120 1 0 53121 1 0 53122 1 0 54123 1 0 55124 1 0 56125 1 0 56126 1 0 57127 1 0 57128 1 0 58129 1 0 58130 1 0 59131 1 0 59132 1 0 60133 1 0 60134 1 0 61135 1 0 61136 1 0 62137 1 0 62138 1 0 63139 1 0 63140 1 0 63141 1 0 M END