HMDB0273682 RDKit 3D PGP(20:4(5Z,8Z,11Z,14Z)/20:4(7E,9E,11Z,13E)-3OH(5S,6R,15S)) 140139 0 0 0 0 0 0 0 0999 V2000 -2.0305 -10.6174 -0.6518 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -9.6071 0.4556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5025 -8.2801 0.1049 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6633 -7.3495 1.3006 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0546 -5.9764 0.9602 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2442 -5.0981 2.1186 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2968 -4.5062 2.7903 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1766 -4.6532 2.4488 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8348 -5.2241 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7738 -4.7059 4.2981 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4871 -3.4648 4.1688 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2326 -2.5909 3.0695 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -1.3661 3.0919 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3807 -0.7257 4.3846 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9162 -0.4749 4.3209 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3584 0.6787 4.4063 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0498 1.9606 4.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5143 2.5692 5.8897 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9868 2.6738 5.8206 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5179 3.4769 4.7183 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 4.4245 4.2369 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7409 3.2111 4.1755 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4269 3.8308 3.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6483 3.9658 1.8514 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6733 4.2511 0.7632 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3209 5.4520 0.8743 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4761 5.6583 -0.3368 P 0 0 0 0 0 5 0 0 0 0 0 0 -6.8337 5.3015 0.2864 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2538 4.5953 -1.6164 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5492 7.2545 -0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0062 7.4018 -2.1162 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0408 8.9021 -2.3963 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.4878 9.1593 -3.6984 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9492 9.5623 -1.3638 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4252 9.2490 -0.1171 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2938 9.8822 1.1598 P 0 0 0 0 0 5 0 0 0 0 0 0 -8.0759 11.0892 0.7386 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2743 10.3394 2.4352 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4163 8.7035 1.6848 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1272 2.6710 1.5491 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7485 2.5493 1.2952 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0993 3.6151 1.3584 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 1.2460 0.9748 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1183 1.2149 -0.5057 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 2.2668 -1.0481 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4388 2.1836 -0.5549 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5685 2.3130 0.8084 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3408 3.1964 -1.2711 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6632 2.9320 -0.8892 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1632 3.0938 -2.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1785 1.9372 -3.3568 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9966 1.8616 -4.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0186 0.6590 -5.4089 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8424 0.5459 -6.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -0.5974 -7.4652 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0488 -1.8464 -6.7601 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0625 -3.0080 -7.4027 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2544 -4.3124 -6.7482 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5884 -4.7459 -6.9406 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0594 -4.1684 -5.2606 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2486 -5.5227 -4.5643 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0409 -5.3278 -3.0739 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2252 -6.6494 -2.3481 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0211 -6.4673 -0.8625 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0072 -10.7010 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7342 -10.3578 -1.4687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2876 -11.6170 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6436 -10.0281 1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -9.4419 0.7256 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0278 -7.8523 -0.7659 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4247 -8.4095 -0.1324 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1309 -7.7520 2.1628 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7367 -7.2044 1.5021 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6774 -5.5369 0.1245 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0297 -6.0720 0.6429 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2941 -4.9027 2.4788 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5334 -3.8703 3.6389 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4735 -3.6565 2.1361 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2458 -5.3302 1.5759 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4595 -6.2429 3.9549 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1436 -5.3382 5.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6435 -3.7228 4.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4457 -2.9639 5.1841 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5124 -2.9198 2.0215 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5822 -0.7711 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6576 -1.3117 5.2648 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9157 0.2437 4.5013 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2311 -1.3513 4.1895 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7816 0.7069 4.3307 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1185 1.8671 4.7362 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8633 2.6700 3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0238 3.5082 6.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7605 1.8383 6.6827 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4878 1.7072 5.9115 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2675 3.2130 6.7855 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3948 3.3100 2.9084 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7393 4.8812 3.4019 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9273 4.7653 1.8672 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1968 4.1125 -0.2558 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4303 3.4402 0.8181 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5078 3.6739 -1.3745 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3207 6.8849 -2.8005 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0238 6.9697 -2.1364 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0012 9.2860 -2.3365 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1807 10.0713 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9342 9.0641 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0763 10.6338 -1.5428 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7771 9.5153 2.6928 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9772 7.7977 1.6724 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8102 0.4239 1.2825 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8235 1.0491 1.5014 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8691 1.2991 -1.0559 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4646 0.1781 -0.8152 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0757 2.2288 -2.1674 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 3.3050 -0.8511 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 1.1789 -0.8167 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7575 3.2618 1.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0556 4.2061 -0.9229 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0513 2.3677 -1.6263 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0107 3.9893 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3296 1.0374 -2.7838 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8497 2.7480 -5.4065 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1711 -0.1717 -4.7529 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6903 1.4615 -7.4393 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7199 -0.6629 -8.5551 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1858 -1.8935 -5.6993 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9185 -2.9733 -8.4821 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5545 -5.0853 -7.1604 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6681 -5.0266 -7.9082 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0809 -3.7295 -5.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9207 -3.5347 -4.8822 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5527 -6.2588 -4.9957 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2822 -5.8370 -4.7776 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7232 -4.5488 -2.7026 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -4.9914 -2.9062 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2719 -7.0181 -2.4936 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5472 -7.4080 -2.7694 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6824 -7.4301 -0.3958 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2336 -5.7026 -0.6572 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9445 -6.1489 -0.3508 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 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 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 27 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 1 0 36 37 2 0 36 38 1 0 36 39 1 0 24 40 1 0 40 41 1 0 41 42 2 0 41 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 46 48 1 0 48 49 1 0 48 50 1 0 50 51 2 0 51 52 1 0 52 53 2 0 53 54 1 0 54 55 2 0 55 56 1 0 56 57 2 0 57 58 1 0 58 59 1 0 58 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 3 71 1 0 4 72 1 0 4 73 1 0 5 74 1 0 5 75 1 0 6 76 1 0 7 77 1 0 8 78 1 0 8 79 1 0 9 80 1 0 10 81 1 0 11 82 1 0 11 83 1 0 12 84 1 0 13 85 1 0 14 86 1 0 14 87 1 0 15 88 1 0 16 89 1 0 17 90 1 0 17 91 1 0 18 92 1 0 18 93 1 0 19 94 1 0 19 95 1 0 23 96 1 0 23 97 1 0 24 98 1 1 25 99 1 0 25100 1 0 29101 1 0 31102 1 0 31103 1 0 32104 1 6 33105 1 0 34106 1 0 34107 1 0 38108 1 0 39109 1 0 43110 1 0 43111 1 0 44112 1 0 44113 1 0 45114 1 0 45115 1 0 46116 1 6 47117 1 0 48118 1 1 49119 1 0 50120 1 0 51121 1 0 52122 1 0 53123 1 0 54124 1 0 55125 1 0 56126 1 0 57127 1 0 58128 1 6 59129 1 0 60130 1 0 60131 1 0 61132 1 0 61133 1 0 62134 1 0 62135 1 0 63136 1 0 63137 1 0 64138 1 0 64139 1 0 64140 1 0 M END