HMDB0033697 RDKit 3D Melilotocarpan C 42 45 0 0 0 0 0 0 0 0999 V2000 -6.8139 -0.3034 -1.1008 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9018 -0.4364 -0.0546 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5635 -0.0955 -0.1089 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9886 0.4273 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6509 0.7363 -1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8736 0.5466 -0.0904 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4494 0.0262 1.0411 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7937 -0.2916 1.0226 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3396 -0.8188 2.1956 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6966 -0.1863 2.2089 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2909 -0.0464 2.1462 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1437 1.0873 1.2497 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5876 0.9040 0.9659 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7658 1.3114 1.5518 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0101 0.9763 1.0523 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 0.1982 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2961 -0.1562 -0.6123 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4941 0.2495 -0.0291 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8892 -0.2264 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -1.0101 -1.8414 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9772 -2.4138 -1.6514 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6617 0.1272 -0.1698 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3582 -0.1792 -0.6081 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 0.8969 -0.1184 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3191 0.6997 -1.0249 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3907 -0.3777 -2.1063 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6301 -1.0684 -1.0469 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5948 0.5865 -2.1528 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2263 1.1507 -2.1332 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3162 -1.0789 2.2688 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1413 0.0465 3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1084 -0.9846 1.7048 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0808 2.0803 1.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7009 1.9139 2.4326 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 1.3081 1.5299 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3505 -0.1142 -0.6339 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6442 -0.1790 0.9987 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6142 1.3363 0.0781 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5462 -2.9704 -2.4928 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3699 -2.7122 -0.7475 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0094 -2.7700 -1.4355 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2291 1.8102 -0.7031 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 7 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 2 0 16 17 1 0 17 18 1 0 16 19 1 0 19 20 1 0 20 21 1 0 19 22 2 0 22 23 1 0 23 24 1 0 8 3 1 0 24 12 1 0 24 6 1 0 22 13 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 5 29 1 0 9 30 1 0 11 31 1 0 11 32 1 0 12 33 1 0 14 34 1 0 15 35 1 0 18 36 1 0 18 37 1 0 18 38 1 0 21 39 1 0 21 40 1 0 21 41 1 0 24 42 1 0 M END