HMDB0062748 RDKit 3D 20-hydroxylipoxin A4 58 57 0 0 0 0 0 0 0 0999 V2000 10.1039 1.5042 1.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4580 0.4933 0.6744 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8911 -0.7904 0.9164 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1433 0.6585 -0.0511 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5822 -0.6913 -0.3571 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -0.6599 -1.1102 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 0.0380 -0.4199 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4556 1.3481 -0.1844 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8665 -0.7502 0.8353 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5948 -2.0616 0.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6441 -0.2474 1.5211 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4706 -0.1694 0.9341 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2714 0.3231 1.6046 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1068 0.3730 0.9376 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1055 0.8393 1.5178 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2363 0.8891 0.8742 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3189 0.4608 -0.5021 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5003 0.5227 -1.1438 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7015 1.0266 -0.4390 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5584 2.3790 -0.1026 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9618 0.7918 -1.2379 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1638 -0.6825 -1.4923 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2888 -1.4967 -0.2341 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4714 -1.0153 0.5776 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7488 -1.1472 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7989 -0.6835 0.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4582 -1.2583 0.2214 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4930 1.2383 0.6652 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2868 1.2959 -0.9363 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3425 -1.2917 -0.9426 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4994 -1.2242 0.6215 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -1.7315 -1.3625 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5130 -0.1992 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 -0.0803 -1.1039 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8317 1.7419 -1.0084 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7204 -0.7818 1.5131 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1469 -2.0957 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7274 0.0681 2.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4107 -0.4904 -0.0958 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2447 0.6576 2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1452 0.0329 -0.0821 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0453 1.1710 2.5813 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1517 1.2633 1.3798 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4967 0.0840 -1.0826 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 0.2102 -2.1711 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7969 0.4628 0.5099 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6227 2.9455 -0.9113 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8134 1.1535 -0.6289 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9839 1.3746 -2.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2585 -1.0703 -2.0213 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0140 -0.8494 -2.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 -2.5431 -0.5656 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3532 -1.4805 0.3353 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4937 -1.6990 1.4795 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3632 0.0054 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6936 -0.4897 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9139 -2.1744 -0.5562 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2241 -1.4254 1.0938 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 3 27 1 0 4 28 1 0 4 29 1 0 5 30 1 0 5 31 1 0 6 32 1 0 6 33 1 0 7 34 1 6 8 35 1 0 9 36 1 1 10 37 1 0 11 38 1 0 12 39 1 0 13 40 1 0 14 41 1 0 15 42 1 0 16 43 1 0 17 44 1 0 18 45 1 0 19 46 1 1 20 47 1 0 21 48 1 0 21 49 1 0 22 50 1 0 22 51 1 0 23 52 1 0 23 53 1 0 24 54 1 0 24 55 1 0 25 56 1 0 25 57 1 0 26 58 1 0 M END