HMDB0030949 RDKit 3D Wyerone epoxide 34 35 0 0 0 0 0 0 0 0999 V2000 -6.0953 -1.0593 -0.8876 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5171 -0.3369 0.3306 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3575 1.1436 0.0178 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 1.3761 -1.1332 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 1.8032 0.1095 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9286 1.0516 0.6853 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9961 0.4389 1.1809 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9103 -0.2686 1.7805 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1043 -1.1105 2.6842 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4884 -0.0225 1.3446 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8487 0.8684 0.3686 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2466 0.7712 0.2921 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6848 -0.1430 1.1861 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9748 -0.6919 1.5689 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0018 -0.8078 0.8205 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1161 -0.4516 -0.5378 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2855 -0.0061 -1.2962 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3975 -0.6403 -1.1152 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6242 -0.3147 -2.4738 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5545 -0.5825 1.7922 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4697 -1.9081 -1.1631 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1346 -1.4106 -0.6786 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1386 -0.3448 -1.7459 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5548 -0.7610 0.6478 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2362 -0.3960 1.1703 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2686 1.7329 -0.1502 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0612 2.9065 0.2359 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2062 1.5013 -0.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8076 1.4148 -0.3677 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0765 -1.0468 2.6495 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9084 -1.2591 1.3625 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6865 0.0895 -2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9864 -1.1807 -3.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3714 0.5025 -2.4904 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 4 5 1 0 5 6 1 0 6 7 3 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 13 20 1 0 5 3 1 0 20 10 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 2 25 1 0 3 26 1 0 5 27 1 0 11 28 1 0 12 29 1 0 14 30 1 0 15 31 1 0 19 32 1 0 19 33 1 0 19 34 1 0 M END