HMDB0032759 RDKit 3D Moschamine 46 48 0 0 0 0 0 0 0 0999 V2000 6.2109 1.4440 -3.6968 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5839 1.5038 -2.3406 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7243 1.0693 -1.3699 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4804 0.5622 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5879 0.1155 -0.7482 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2875 -0.4173 -1.0976 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3758 -0.8558 -0.2738 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0798 -1.3813 -0.7171 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1317 -1.3967 -1.9582 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8848 -1.8474 0.2071 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1316 -2.3494 -0.2718 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9476 -1.3759 -1.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3342 -0.1616 -0.3402 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8262 1.1367 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 1.9490 0.4071 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4038 1.2039 1.0518 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3122 1.6017 2.0083 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1671 0.6506 2.5184 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1213 -0.6576 2.0907 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9774 -1.5876 2.6082 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2075 -1.0241 1.1381 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3342 -0.0827 0.6084 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9844 0.1933 0.5597 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 0.6967 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0758 1.1256 -0.0319 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3294 1.6380 0.2796 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 1.8510 -4.3334 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3366 2.0928 -3.9345 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0112 0.3905 -3.9526 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1439 0.4909 -2.7321 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0321 -0.4618 -2.1647 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5801 -0.8330 0.7848 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6913 -1.8262 1.2295 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8859 -3.1870 -0.9913 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7308 -2.8566 0.5244 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9028 -1.9143 -1.3279 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4625 -1.1736 -2.0403 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 1.3948 -1.0932 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3071 2.9741 0.5586 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3574 2.6321 2.3528 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9116 0.9204 3.2856 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 -2.5516 2.3511 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1051 -2.0235 0.7485 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3632 -0.1297 1.3798 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5295 0.7535 1.9653 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6446 1.7045 1.2353 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 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 2 0 5 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 25 3 1 0 22 13 1 0 22 16 1 0 1 27 1 0 1 28 1 0 1 29 1 0 4 30 1 0 6 31 1 0 7 32 1 0 10 33 1 0 11 34 1 0 11 35 1 0 12 36 1 0 12 37 1 0 14 38 1 0 15 39 1 0 17 40 1 0 18 41 1 0 20 42 1 0 21 43 1 0 23 44 1 0 24 45 1 0 26 46 1 0 M END