HMDB0257514 RDKit 3D 3-Methyl-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide 53 56 0 0 0 0 0 0 0 0999 V2000 4.0052 -0.8228 -1.5483 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8943 -1.3493 -0.1627 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9786 -0.5880 0.7378 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6127 -0.5489 0.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5262 -1.1427 0.9169 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8493 -1.7500 2.0032 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8569 -1.1536 0.5291 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5172 -0.0470 -0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7331 1.1750 -0.2221 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8234 -0.1086 -0.4437 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5428 1.0042 -1.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 2.1985 -0.4713 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 3.2689 -1.0945 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8534 3.0938 -2.3932 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6437 1.8864 -3.0243 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0036 0.8544 -2.3915 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5225 -1.2571 -0.2949 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9453 -2.3340 0.2415 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7358 -3.4579 0.3391 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2358 -4.6165 0.8608 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9267 -4.6011 1.2747 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1124 -3.4784 1.1854 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -2.2977 0.6555 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4911 0.7542 1.1171 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2613 1.8350 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7201 3.1202 0.5988 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4226 3.2846 1.7709 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6673 2.2223 2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 0.9469 2.3017 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1002 -0.3130 -1.9278 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1398 -1.7129 -2.2311 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8964 -0.1694 -1.7205 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9183 -1.2919 0.3003 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6095 -2.4208 -0.1051 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9347 -1.1746 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4755 -0.0613 -0.6446 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3729 2.0664 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 1.3266 0.5431 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3478 1.1995 -1.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4587 2.3579 0.5521 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5416 4.1826 -0.5475 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3565 3.9259 -2.8717 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0063 1.7918 -4.0382 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8277 -0.1078 -2.8721 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7785 -3.4631 0.0068 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8584 -5.5004 0.9376 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4967 -5.5038 1.6934 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0802 -3.5540 1.5202 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7027 1.6576 -0.6215 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5059 3.9287 -0.0928 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7898 4.2690 2.0336 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2173 2.3761 3.5231 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 0.0998 2.9445 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 2 0 5 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 10 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 3 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 23 7 1 0 29 24 1 0 16 11 1 0 23 18 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 3 35 1 0 4 36 1 0 9 37 1 0 9 38 1 0 9 39 1 0 12 40 1 0 13 41 1 0 14 42 1 0 15 43 1 0 16 44 1 0 19 45 1 0 20 46 1 0 21 47 1 0 22 48 1 0 25 49 1 0 26 50 1 0 27 51 1 0 28 52 1 0 29 53 1 0 M END