HMDB0259889 RDKit 3D N-Tert-Butyl-3-(4-(2-methoxyphenyl)-piperazin-1-yl)-2-phenylpropanamide 62 64 0 0 0 0 0 0 0 0999 V2000 6.6345 -1.9873 -0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3936 -1.4423 -0.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -0.1093 0.2479 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 0.6753 0.2285 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2891 2.0044 0.5644 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0649 2.5292 0.9085 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9299 1.7128 0.9226 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0731 0.3988 0.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9454 -0.4486 0.5963 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5552 -1.1088 -0.6075 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0729 -1.3205 -0.7273 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2794 -0.5970 0.1756 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4666 0.5102 -0.3222 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 0.1020 -1.2337 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5356 -0.7850 -0.5328 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6856 -1.9793 -0.9524 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2824 -0.3548 0.5728 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2265 -1.2608 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3132 -1.7309 0.3172 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8688 -0.6002 2.4159 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4333 -2.4457 1.7694 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 1.2711 -1.8052 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 1.2729 -3.1252 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3823 2.3312 -3.6829 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6459 3.4552 -2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2447 3.5018 -1.6141 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5818 2.4123 -1.0799 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6951 -0.4781 1.5126 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 -0.6902 1.7814 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3963 -1.8621 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5133 -3.0828 -0.6529 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9813 -1.5526 -1.4086 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3922 0.2668 -0.0417 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1599 2.6643 0.5614 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9266 3.5575 1.1748 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 2.1652 1.2001 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0448 -2.1040 -0.6204 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9572 -0.5455 -1.4827 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7896 -1.0579 -1.7762 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8174 -2.4147 -0.6409 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8838 1.0571 0.5635 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2717 1.1935 -0.8261 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1598 -0.4490 -2.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2081 0.6038 0.9731 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9958 -1.9513 -0.7122 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0432 -0.8804 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7809 -2.6243 0.7652 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5924 -1.2887 2.8636 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3507 0.3540 2.0581 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1171 -0.3502 3.1931 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0349 -2.8681 2.6066 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2877 -3.2090 0.9587 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4903 -2.0785 2.1802 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5211 0.3991 -3.7147 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7184 2.3315 -4.7275 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1722 4.2915 -3.3886 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4629 4.3926 -1.0434 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2845 2.5058 -0.0537 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3774 0.5310 1.8934 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1173 -1.2048 2.1382 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4773 0.0531 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3656 -1.6815 2.2429 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 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 18 21 1 0 14 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 12 28 1 0 28 29 1 0 8 3 1 0 29 9 1 0 27 22 1 0 1 30 1 0 1 31 1 0 1 32 1 0 4 33 1 0 5 34 1 0 6 35 1 0 7 36 1 0 10 37 1 0 10 38 1 0 11 39 1 0 11 40 1 0 13 41 1 0 13 42 1 0 14 43 1 0 17 44 1 0 19 45 1 0 19 46 1 0 19 47 1 0 20 48 1 0 20 49 1 0 20 50 1 0 21 51 1 0 21 52 1 0 21 53 1 0 23 54 1 0 24 55 1 0 25 56 1 0 26 57 1 0 27 58 1 0 28 59 1 0 28 60 1 0 29 61 1 0 29 62 1 0 M END