HMDB0250434 RDKit 3D Conduritol b epoxide 21 22 0 0 0 0 0 0 0 0999 V2000 -2.3828 0.2563 0.3381 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1274 0.1040 -0.2098 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2461 1.2794 -0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5928 2.2494 -0.9725 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2063 1.0112 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7492 1.2513 1.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6286 -0.3294 -0.4559 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -0.7280 -1.6384 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7533 -1.4075 -0.4431 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5025 -1.1487 0.3612 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3824 -2.2165 0.2617 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3447 0.1705 1.3124 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2648 -0.0465 -1.3057 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5416 1.7547 0.9758 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5926 2.2184 -1.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7132 1.7765 -0.6222 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5026 0.5855 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7371 -0.4698 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -2.4432 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2138 -0.9957 1.4131 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1138 -2.8720 -0.4163 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 5 1 0 5 6 1 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 2 1 0 9 7 1 0 1 12 1 0 2 13 1 0 3 14 1 0 4 15 1 0 5 16 1 0 6 17 1 0 7 18 1 0 9 19 1 0 10 20 1 0 11 21 1 0 M END