HMDB0242368 RDKit 3D (1S-Endo)-5-(4-Chloro-3-methylphenyl)-1-((4-methylphenyl)methyl)-N-(1,3,3-tri... 68 72 0 0 0 0 0 0 0 0999 V2000 5.2994 4.3264 -0.0064 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6113 3.0698 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2936 1.8877 0.4162 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6782 0.7063 0.8176 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3818 0.6998 1.2319 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6899 -0.5288 1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7225 -1.0145 0.6796 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.5886 0.6752 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2652 -1.1282 -0.2998 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6733 -0.8846 -0.5831 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2503 -1.4492 -1.5549 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4454 -0.0046 0.2209 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8358 0.2645 -0.0256 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6242 -0.0498 1.2015 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3057 -1.3011 1.8875 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0902 0.1494 0.8776 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2927 1.6645 0.7936 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8971 2.1949 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3726 1.2111 2.0436 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0758 1.7732 -0.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7657 2.4846 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8737 2.0617 -1.4521 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5924 -1.9530 -0.9762 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8497 -1.8628 -0.3328 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0146 -2.6043 -0.8234 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 -2.6814 -0.2161 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3234 -3.3756 -0.7475 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1689 -4.0188 -1.9479 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5220 -4.8999 -2.6469 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9614 -3.9683 -2.5927 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8647 -4.7020 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9161 -3.2828 -2.0494 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6942 1.9292 1.2381 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2913 3.1010 0.8445 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0626 4.5279 -1.0531 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4038 4.2391 0.1831 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9401 5.1448 0.6536 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3341 1.8137 0.0975 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.1857 0.7812 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2924 -1.2955 2.0988 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9851 -0.1957 2.5353 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9562 0.4636 1.0323 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1726 -0.3020 -0.9247 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2126 -1.7812 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 -2.0534 1.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4878 -1.2352 2.6457 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6724 -0.2761 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3981 -0.3320 -0.0649 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9081 1.9924 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7686 1.9556 -0.1465 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8132 3.2226 1.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0422 1.2523 2.9004 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3173 1.3567 2.2612 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9594 3.5278 -0.6754 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 1.9974 -1.0917 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2347 2.5349 0.6825 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1322 2.2560 -2.2772 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4964 1.2115 -1.7585 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4695 2.9990 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3597 -2.5648 -1.8383 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3733 -2.2106 0.7196 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2473 -3.3857 -0.2037 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4263 -5.6832 -3.7756 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7985 -4.8821 -4.1622 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3561 -4.0845 -4.6559 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9974 -3.2717 -2.5981 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6816 1.9624 1.5541 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7918 4.0562 0.8378 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 20 22 1 0 9 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 28 30 1 0 30 31 1 0 30 32 2 0 5 33 1 0 33 34 2 0 34 2 1 0 24 7 1 0 32 25 1 0 20 13 1 0 19 14 1 0 1 35 1 0 1 36 1 0 1 37 1 0 3 38 1 0 4 39 1 0 6 40 1 0 6 41 1 0 12 42 1 0 13 43 1 0 15 44 1 0 15 45 1 0 15 46 1 0 16 47 1 0 16 48 1 0 17 49 1 0 17 50 1 0 18 51 1 0 19 52 1 0 19 53 1 0 21 54 1 0 21 55 1 0 21 56 1 0 22 57 1 0 22 58 1 0 22 59 1 0 23 60 1 0 26 61 1 0 27 62 1 0 31 63 1 0 31 64 1 0 31 65 1 0 32 66 1 0 33 67 1 0 34 68 1 0 M END