HMDB0012590 RDKit 3D 15-Oxo-lipoxin A4 55 54 0 0 0 0 0 0 0 0999 V2000 4.4760 -0.8759 -3.1293 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2124 -1.4813 -1.9797 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1451 -0.5161 -1.3062 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 0.6922 -0.7438 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4354 0.3930 0.2877 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -0.3159 1.4685 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 -0.6433 1.6173 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9761 -0.6466 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6955 -0.3314 2.4373 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -0.6743 3.4961 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5135 -0.3779 3.4365 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0895 0.3233 2.3075 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3931 0.6094 2.2839 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0268 1.3086 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3097 1.5887 1.1484 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0031 2.2965 0.0452 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6204 3.6604 0.0566 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7583 1.7241 -1.3106 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.5132 2.5528 -2.2076 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3364 0.3495 -1.5066 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8215 -0.7001 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4606 -2.0512 -0.9373 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9222 -1.8997 -0.7732 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6684 -1.4848 -1.6776 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4438 -2.2561 0.4863 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8607 -1.2598 -4.0941 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3915 -1.1474 -3.0067 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6012 0.2413 -3.1934 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8581 -2.3117 -2.3788 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5338 -1.9851 -1.2559 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7869 -1.0445 -0.5883 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8435 -0.1428 -2.1116 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 1.3015 -0.2508 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0487 1.3218 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0275 1.3701 0.6448 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5717 -0.1360 -0.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2768 -1.1700 3.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 0.1844 1.5709 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1285 -1.2098 4.4017 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1237 -0.6772 4.2911 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4436 0.6558 1.4344 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9967 0.3149 3.1118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4206 1.6103 0.3323 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8847 1.2780 2.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0869 2.2827 0.2535 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5766 3.8964 1.0227 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7238 1.8158 -1.6635 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4461 2.4331 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4496 0.4356 -1.2901 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3157 0.0482 -2.5797 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1384 -0.5384 0.4783 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7283 -0.8159 -0.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0465 -2.8059 -0.2353 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1758 -2.3736 -1.9538 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2810 -2.8159 0.4654 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 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 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 0 2 30 1 0 3 31 1 0 3 32 1 0 4 33 1 0 4 34 1 0 5 35 1 0 5 36 1 0 8 37 1 0 9 38 1 0 10 39 1 0 11 40 1 0 12 41 1 0 13 42 1 0 14 43 1 0 15 44 1 0 16 45 1 1 17 46 1 0 18 47 1 6 19 48 1 0 20 49 1 0 20 50 1 0 21 51 1 0 21 52 1 0 22 53 1 0 22 54 1 0 25 55 1 0 M END