HMDB0270423 RDKit 3D PG(20:3(5Z,8Z,11Z)-O(14R,15S)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 135135 0 0 0 0 0 0 0 0999 V2000 -5.5063 -1.1257 4.6969 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0246 -2.4074 3.9607 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5848 -2.3089 3.9427 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8684 -2.2763 2.8775 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4672 -2.3426 1.5195 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0811 -1.0670 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3526 -0.9728 -0.2204 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8542 -2.2385 -0.8532 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3853 -2.1480 -0.6932 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -2.2339 -1.5886 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3155 -2.4520 -3.0188 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0243 -1.3292 -3.7404 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1243 -1.6117 -4.3959 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6706 -3.0111 -4.4324 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 -3.0029 -3.5959 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0387 -3.7475 -2.5123 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9276 -4.6648 -2.0731 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5296 -6.0188 -1.7391 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1703 -6.5821 -0.5947 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2398 -6.0451 0.3514 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5554 -5.6391 1.7171 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4721 -4.5258 1.9617 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6115 -4.7657 2.4227 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1487 -3.1784 1.7187 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0558 -2.1665 2.0380 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5296 -1.2041 3.0352 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3991 -0.4471 2.5202 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8425 0.4801 3.3334 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3504 0.5899 4.5029 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6927 1.3990 2.9963 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4582 2.2400 4.1896 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5046 3.3450 4.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3086 4.4395 3.3626 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2211 5.1071 2.7535 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6501 5.0542 2.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4484 4.1021 3.4944 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4206 3.4374 2.8943 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8919 3.4934 1.5259 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8246 2.2431 0.8161 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1778 2.0770 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4447 3.1567 -0.9496 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0485 3.4491 -2.3304 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 4.5353 -2.9783 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6451 4.7091 -2.5745 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6690 4.8355 -3.6469 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8904 3.9496 -3.3571 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5195 4.3993 -2.0511 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7170 3.6083 -1.6494 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4594 2.1384 -1.4246 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7139 -1.4821 0.8835 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8981 -0.8201 -0.0009 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8834 -0.0547 -1.1769 P 0 0 0 0 0 5 0 0 0 0 0 0 4.2235 -0.0283 -2.5027 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1913 1.5278 -0.6705 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3106 -0.9471 -1.2724 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3952 -0.1471 -0.9293 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6927 -0.9347 -0.9759 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9307 -1.4484 -2.2229 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8490 -0.0555 -0.5402 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0017 -0.8042 -0.4939 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5624 -0.9763 4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2019 -1.1305 5.7429 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9371 -0.3151 4.1503 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5918 -2.4045 3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3141 -3.2277 4.6686 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0443 -2.2533 4.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7623 -2.1964 2.8743 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0486 -3.2540 1.0562 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5458 -2.4585 1.4698 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4757 -0.1709 1.3826 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1059 -0.0209 -0.6483 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3253 -3.1515 -0.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1501 -2.0904 -1.9491 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0739 -1.9761 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -2.1079 -1.2416 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4857 -3.4330 -3.4062 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8001 -2.2601 -3.2647 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6237 -0.3396 -3.7068 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6803 -0.8520 -4.9302 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0275 -3.8133 -4.3258 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1071 -3.0764 -5.5048 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7477 -2.3559 -3.9075 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9249 -3.7485 -1.8765 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2427 -4.8400 -2.8827 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4348 -4.2383 -1.1982 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2242 -6.4896 -2.4208 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6447 -7.5534 -0.3739 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5472 -5.2976 -0.1446 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4237 -6.9278 0.4619 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -6.5355 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5636 -5.3505 2.2131 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -2.6775 2.5678 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1569 -1.7695 3.9319 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2904 -0.5019 3.4148 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1946 0.8405 2.6542 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 2.0572 2.1869 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2347 1.5387 5.0838 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4766 2.7080 4.4995 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5142 2.8456 4.1724 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 3.7497 5.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7971 4.7073 3.1736 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7814 5.9083 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0654 5.1759 1.7053 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0141 6.0898 3.1931 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3063 3.9389 4.5952 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9588 2.7241 3.5634 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6303 4.3958 0.9389 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0470 3.6789 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3722 1.3876 1.2834 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1817 1.0913 -0.8094 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2223 4.0472 -0.3905 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4231 2.7283 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1194 2.6095 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7251 5.4483 -1.7573 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9816 5.9002 -3.7385 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2274 4.5557 -4.6241 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5872 4.0897 -4.2049 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5663 2.9038 -3.3469 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7991 4.4983 -1.2327 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8907 5.4479 -2.2406 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0672 4.0336 -0.6698 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5434 3.8007 -2.3651 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4084 1.8621 -1.5682 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1010 1.5617 -2.1147 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7371 1.8108 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4425 -0.7323 1.2845 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3093 -2.2862 0.3545 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0098 2.1625 -1.3866 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2717 0.2499 0.0933 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4579 0.7177 -1.6325 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6092 -1.7232 -0.1887 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2136 -1.9990 -2.5851 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9843 0.7091 -1.3481 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6760 0.4291 0.4372 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9839 -1.5787 -1.0900 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 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 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 1 0 39 40 2 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 25 50 1 0 50 51 1 0 51 52 1 0 52 53 2 0 52 54 1 0 52 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 57 59 1 0 59 60 1 0 44 42 1 0 1 61 1 0 1 62 1 0 1 63 1 0 2 64 1 0 2 65 1 0 3 66 1 0 4 67 1 0 5 68 1 0 5 69 1 0 6 70 1 0 7 71 1 0 8 72 1 0 8 73 1 0 9 74 1 0 10 75 1 0 11 76 1 0 11 77 1 0 12 78 1 0 13 79 1 0 14 80 1 0 14 81 1 0 15 82 1 0 16 83 1 0 17 84 1 0 17 85 1 0 18 86 1 0 19 87 1 0 20 88 1 0 20 89 1 0 21 90 1 0 21 91 1 0 25 92 1 1 26 93 1 0 26 94 1 0 30 95 1 0 30 96 1 0 31 97 1 0 31 98 1 0 32 99 1 0 32100 1 0 33101 1 0 34102 1 0 35103 1 0 35104 1 0 36105 1 0 37106 1 0 38107 1 0 38108 1 0 39109 1 0 40110 1 0 41111 1 0 41112 1 0 42113 1 0 44114 1 0 45115 1 0 45116 1 0 46117 1 0 46118 1 0 47119 1 0 47120 1 0 48121 1 0 48122 1 0 49123 1 0 49124 1 0 49125 1 0 50126 1 0 50127 1 0 54128 1 0 56129 1 0 56130 1 0 57131 1 1 58132 1 0 59133 1 0 59134 1 0 60135 1 0 M END