HMDB0248180 RDKit 3D Aloperine 41 44 0 0 0 0 0 0 0 0999 V2000 0.6200 0.1650 -1.5122 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 0.0831 -0.7364 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8902 0.9387 -0.9058 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2913 1.4970 0.4156 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1567 0.5433 1.5616 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8628 -0.1061 1.6069 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7344 -0.8914 0.4011 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5536 -1.8201 0.4219 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2245 -2.1620 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -0.9190 -1.6314 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6323 -0.5973 -0.8699 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3732 0.5012 -1.5781 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6791 1.6433 -0.6369 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3752 1.1138 0.5883 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4847 0.1186 1.2507 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2887 -0.1882 0.4749 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6268 -1.2842 1.1667 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4692 1.0575 -2.0978 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7267 1.7677 -1.6125 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6756 0.2439 -1.3228 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7541 2.4454 0.5838 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 1.7620 0.3448 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9102 -0.2646 1.4318 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3175 1.1171 2.4963 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0791 0.5917 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6657 -1.4895 0.3083 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8637 -2.7614 0.9057 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4197 -3.0404 -1.1081 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2128 -2.3005 -1.5401 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6113 -1.1686 -2.6902 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2967 -1.4643 -0.8003 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8112 0.9156 -2.4396 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3442 0.1290 -2.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2941 2.3791 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 2.0820 -0.2881 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5368 1.9753 1.2724 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3825 0.7235 0.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1124 0.5137 2.2345 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0476 -0.8092 1.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3467 -2.1283 1.2973 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -0.9124 2.1401 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 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 1 0 16 17 1 0 10 1 1 0 16 11 1 0 7 2 1 0 17 8 1 0 1 18 1 0 3 19 1 0 3 20 1 0 4 21 1 0 4 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 7 26 1 0 8 27 1 0 9 28 1 0 9 29 1 0 10 30 1 0 11 31 1 0 12 32 1 0 12 33 1 0 13 34 1 0 13 35 1 0 14 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 17 40 1 0 17 41 1 0 M END