HMDB0252138 RDKit 3D Evodiamine 40 44 0 0 0 0 0 0 0 0999 V2000 0.8546 -1.5514 1.2266 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3763 -0.3827 0.5518 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7649 -0.3003 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6709 -1.0136 1.0501 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0152 -0.9274 0.7516 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4584 -0.1533 -0.3117 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5495 0.5465 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2063 0.4696 -0.8046 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1817 1.1760 -1.5781 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5365 1.9019 -2.5666 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8153 1.0383 -1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1874 1.2160 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4217 0.3911 -1.9857 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8029 0.3047 -0.5713 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 0.4635 0.4183 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5472 0.3283 1.5767 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8543 0.0882 1.3513 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9643 -0.1267 2.1632 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2216 -0.3545 1.6668 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3987 -0.3722 0.2973 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2983 -0.1588 -0.5406 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 0.0674 -0.0111 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5274 0.7298 0.1599 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2471 -1.5909 1.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -2.4535 0.7726 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9768 -1.4989 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -1.6131 1.8755 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7651 -1.4548 1.3297 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5038 -0.0620 -0.5753 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8476 1.1619 -1.9287 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1857 0.9419 -3.2482 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4319 2.2980 -2.2748 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3326 -0.6399 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2532 0.8767 -2.5581 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1709 0.3872 2.5611 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8211 -0.1120 3.2339 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0911 -0.5228 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3707 -0.5476 -0.1515 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3922 -0.1642 -1.6172 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9077 1.6137 0.7564 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 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 15 23 1 0 23 2 1 0 8 3 1 0 23 11 1 0 22 14 1 0 22 17 1 0 1 24 1 0 1 25 1 0 1 26 1 0 4 27 1 0 5 28 1 0 6 29 1 0 7 30 1 0 12 31 1 0 12 32 1 0 13 33 1 0 13 34 1 0 16 35 1 0 18 36 1 0 19 37 1 0 20 38 1 0 21 39 1 0 23 40 1 0 M END