HMDB0030223 RDKit 3D (±)-Currayangine 50 55 0 0 0 0 0 0 0 0999 V2000 -1.7641 4.0067 0.2102 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8792 2.8355 0.2855 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5342 2.9432 0.1338 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3693 1.8320 0.1943 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6763 1.4722 -0.0165 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7647 2.2319 -0.2826 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9775 1.6011 -0.4611 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0465 0.2049 -0.3627 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9384 -0.5733 -0.0914 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7332 0.0532 0.0863 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5302 -0.4500 0.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7351 0.6388 0.4157 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6041 0.5932 0.5708 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4766 1.6167 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8477 1.2848 0.6439 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1433 -0.1273 0.3381 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6104 -0.2982 0.5091 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -0.7334 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7024 -2.0470 -0.6264 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5163 -1.5469 -0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0215 -0.7126 1.1543 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4306 -0.8351 1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -1.8102 0.3553 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5541 -2.6996 -0.6447 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0653 -2.3653 1.7116 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 4.8930 0.5342 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5745 3.9328 0.9513 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1094 4.2460 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9907 3.8813 -0.0333 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6397 3.3121 -0.3459 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8603 2.1886 -0.6746 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0067 -0.2686 -0.5061 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -1.6575 -0.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8444 -1.3481 0.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1524 -0.1230 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0464 0.4108 1.2392 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8719 -0.0583 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -1.0253 -1.6337 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6627 -2.4586 -1.6839 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2943 -2.7263 0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2423 -0.7291 -0.9411 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4036 -0.9480 2.0579 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6329 -0.1856 2.3979 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 -1.8332 1.6983 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9897 -2.1534 -1.4906 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2829 -3.3901 -0.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -3.3710 -1.0729 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1304 -2.8874 2.0492 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8584 -3.1769 1.7299 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -1.6388 2.4750 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 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 20 23 1 0 23 24 1 0 23 25 1 0 14 2 2 0 22 16 1 0 12 4 1 0 21 13 1 0 10 5 1 0 23 11 1 0 1 26 1 0 1 27 1 0 1 28 1 0 3 29 1 0 6 30 1 0 7 31 1 0 8 32 1 0 9 33 1 0 17 34 1 0 17 35 1 0 17 36 1 0 18 37 1 0 18 38 1 0 19 39 1 0 19 40 1 0 20 41 1 0 21 42 1 0 22 43 1 0 22 44 1 0 24 45 1 0 24 46 1 0 24 47 1 0 25 48 1 0 25 49 1 0 25 50 1 0 M END