HMDB0273713 RDKit 3D PGP(20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)/20:4(5Z,8Z,11Z,14Z)) 138137 0 0 0 0 0 0 0 0999 V2000 -1.9231 -9.2145 -5.8608 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8769 -8.0268 -5.7397 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2879 -7.7881 -4.3498 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5362 -7.8310 -3.9738 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7045 -8.1151 -4.8303 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7050 -6.9494 -4.8489 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1329 -6.7523 -3.5599 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1088 -5.7159 -5.4094 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1441 -5.0095 -4.9051 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6005 -3.8105 -5.5055 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6059 -3.1495 -4.9104 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -1.9473 -5.4685 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0404 -1.2640 -4.8986 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4924 -1.7265 -3.6613 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5353 -1.1004 -3.0243 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0688 0.1243 -3.4930 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8125 1.0943 -3.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2785 0.0472 -4.3468 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0354 -0.1884 -5.6847 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1522 1.2603 -4.1654 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6929 1.4278 -2.7961 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5019 2.7215 -2.5962 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9754 2.7194 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9119 1.5971 -0.5699 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4601 3.8291 -0.5116 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 3.6079 0.8199 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2378 4.8889 1.5595 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5327 4.4878 3.0263 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 3.8733 3.5205 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5912 3.3267 5.0755 P 0 0 0 0 0 5 0 0 0 0 0 0 6.0475 2.9421 5.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0945 4.4623 6.2183 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6234 1.9550 5.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0117 1.1449 6.3291 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1143 -0.0683 6.4630 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5830 -0.8377 7.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6877 0.2624 6.7397 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0606 1.0296 5.7821 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5414 1.2974 6.2611 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.8223 2.7866 6.1525 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6384 0.4518 5.3263 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7657 0.8638 7.8849 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1697 5.7755 1.5946 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0709 7.0469 1.1355 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0651 7.5618 0.5823 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8032 7.8577 1.2674 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8601 7.1178 2.1602 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5268 7.7972 2.3746 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2484 6.9463 3.2751 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3912 6.3906 3.0078 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1345 6.4866 1.7976 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 5.4188 0.8999 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0685 4.2073 0.9463 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2045 3.6077 1.9729 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0038 3.0988 1.1774 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3618 1.8613 1.1342 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4282 0.8422 1.9126 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0482 -0.1355 1.0357 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8582 -1.4227 1.0916 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0075 -2.1113 2.0486 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8633 -3.1142 2.8412 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5324 -4.1092 1.9638 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5901 -4.9589 1.1581 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -5.9347 0.3153 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2053 -10.0020 -5.1605 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0069 -9.5918 -6.8931 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8693 -8.8735 -5.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6807 -8.1882 -6.4689 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2507 -7.1248 -6.0388 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5207 -7.5617 -3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7523 -7.6389 -2.9079 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2676 -8.9363 -4.3136 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4727 -8.3780 -5.8588 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5455 -7.3026 -5.4867 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5060 -6.1744 -3.0637 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5244 -5.3462 -6.3618 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7238 -5.3536 -3.9457 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9585 -3.3998 -6.4344 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2682 -3.5821 -3.9797 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4349 -1.5831 -6.4183 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6891 -0.3695 -5.4237 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8708 -2.6492 -3.2035 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1579 -1.5382 -2.0607 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4463 0.6351 -2.5133 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3711 1.9355 -4.1604 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9544 -0.8127 -3.9958 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8206 -0.5861 -6.1331 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5989 2.1817 -4.4283 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9989 1.2336 -4.9328 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4557 0.5931 -2.6583 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0228 1.3156 -1.9486 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9159 3.5998 -2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3968 2.6421 -3.2463 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0659 3.0626 1.3741 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7299 2.9183 0.7842 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1476 5.2718 1.1276 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3593 3.7659 3.0523 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7511 5.4056 3.5955 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3991 4.1850 7.1372 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8923 1.7309 7.2804 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0694 0.8327 6.2587 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1811 -0.7027 5.5602 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 -1.2104 8.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5756 0.6598 7.7689 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1345 -0.7207 6.7512 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2747 1.0133 4.8257 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6978 0.5312 7.9763 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3876 8.0981 0.2767 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1033 8.8105 1.7452 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3682 6.9867 3.1477 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7265 6.0966 1.7587 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0645 8.1505 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7759 8.7330 2.9673 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1986 6.7779 4.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8396 5.8172 3.8599 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6487 7.3259 1.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1435 7.0543 2.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1136 5.6559 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3875 3.4640 0.1657 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7739 2.7283 2.4013 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8762 4.1707 2.8106 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 3.8515 0.6212 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 1.5614 0.5437 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0032 1.2075 2.7374 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4367 0.2670 2.4323 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7357 0.2369 0.2533 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3912 -2.0741 0.3544 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7682 -2.7436 1.5094 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4779 -1.5043 2.8049 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2229 -3.6657 3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5603 -2.5157 3.4318 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0603 -4.8336 2.6557 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3546 -3.6854 1.3475 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0644 -5.5195 1.8485 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -4.2988 0.5143 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8385 -6.2193 -0.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6501 -6.8235 0.8942 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3212 -5.3597 0.0072 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 2 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 30 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 38 39 1 0 39 40 2 0 39 41 1 0 39 42 1 0 27 43 1 0 43 44 1 0 44 45 2 0 44 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 1 0 52 53 2 0 53 54 1 0 54 55 1 0 55 56 2 0 56 57 1 0 57 58 1 0 58 59 2 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 1 65 1 0 1 66 1 0 1 67 1 0 2 68 1 0 2 69 1 0 3 70 1 0 4 71 1 0 5 72 1 0 5 73 1 0 6 74 1 6 7 75 1 0 8 76 1 0 9 77 1 0 10 78 1 0 11 79 1 0 12 80 1 0 13 81 1 0 14 82 1 0 15 83 1 0 16 84 1 1 17 85 1 0 18 86 1 1 19 87 1 0 20 88 1 0 20 89 1 0 21 90 1 0 21 91 1 0 22 92 1 0 22 93 1 0 26 94 1 0 26 95 1 0 27 96 1 6 28 97 1 0 28 98 1 0 32 99 1 0 34100 1 0 34101 1 0 35102 1 6 36103 1 0 37104 1 0 37105 1 0 41106 1 0 42107 1 0 46108 1 0 46109 1 0 47110 1 0 47111 1 0 48112 1 0 48113 1 0 49114 1 0 50115 1 0 51116 1 0 51117 1 0 52118 1 0 53119 1 0 54120 1 0 54121 1 0 55122 1 0 56123 1 0 57124 1 0 57125 1 0 58126 1 0 59127 1 0 60128 1 0 60129 1 0 61130 1 0 61131 1 0 62132 1 0 62133 1 0 63134 1 0 63135 1 0 64136 1 0 64137 1 0 64138 1 0 M END