HMDB0038528 RDKit 3D Gancaonin N 47 49 0 0 0 0 0 0 0 0999 V2000 7.9543 -0.9505 0.2865 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3898 0.1663 -0.4112 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0514 0.4698 -0.2641 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5097 1.5396 -0.9339 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1586 1.8488 -0.7881 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3413 1.1065 0.0158 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.3866 0.2011 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4728 2.4771 0.9134 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1936 2.7217 1.0771 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7412 1.9351 0.5675 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0784 2.1906 0.7392 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0199 1.3452 0.1908 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3778 1.5847 0.3508 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6555 0.2268 -0.5406 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6988 -0.6658 -1.0994 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2097 -1.6016 -0.0946 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3977 -1.7099 0.4262 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4945 -0.8082 0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6828 -2.7516 1.4419 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -0.0152 -0.7027 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8415 -1.1074 -1.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 0.8315 -0.1535 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9932 0.5298 -0.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3353 -0.4890 -1.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9113 0.0228 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1211 -0.7721 1.5247 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2416 -0.3066 0.5638 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4772 -1.8903 -0.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7622 -0.8086 1.3834 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0355 -1.0171 0.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1216 2.1701 -1.5912 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 2.6896 -1.3178 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2191 3.1320 1.3379 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4026 3.0406 1.2943 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6659 2.3853 0.8726 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4772 -0.0720 -1.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2607 -1.3032 -1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4632 -2.3403 0.2862 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4752 -1.3654 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3001 -0.2376 -0.8793 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -0.0431 0.8544 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8188 -2.9112 2.1181 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5362 -2.4052 2.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9798 -3.7254 0.9617 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3492 -1.8089 -1.8782 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5309 -1.5547 2.0108 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6833 -1.1397 1.0804 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 1 0 10 11 2 0 11 12 1 0 12 13 1 0 12 14 2 0 14 15 1 0 15 16 1 0 16 17 2 3 17 18 1 0 17 19 1 0 14 20 1 0 20 21 1 0 20 22 2 0 22 23 1 0 23 24 2 0 6 25 1 0 25 26 1 0 25 27 2 0 27 3 1 0 23 7 1 0 22 10 1 0 1 28 1 0 1 29 1 0 1 30 1 0 4 31 1 0 5 32 1 0 8 33 1 0 11 34 1 0 13 35 1 0 15 36 1 0 15 37 1 0 16 38 1 0 18 39 1 0 18 40 1 0 18 41 1 0 19 42 1 0 19 43 1 0 19 44 1 0 21 45 1 0 26 46 1 0 27 47 1 0 M END