HMDB0035889 RDKit 3D Germacrone 4,5-epoxide 39 40 0 0 0 0 0 0 0 0999 V2000 3.2954 1.2743 1.1372 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7026 0.2182 0.2797 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5819 -0.9264 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4579 0.2629 -0.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9219 -0.8344 -1.0298 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4383 -2.0227 -0.2638 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0534 -1.8957 1.0699 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9313 -2.1845 0.0126 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4964 -3.5863 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8889 -1.0605 -0.2476 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8706 -0.1297 0.9408 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 1.2023 0.7153 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7924 2.1148 -0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5094 3.4462 -0.1247 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5179 1.8929 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5905 1.3785 0.1655 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8005 1.9752 1.2678 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8489 1.2768 2.1447 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0323 2.2583 0.6541 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3956 1.2238 1.1529 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0943 -1.8840 0.1992 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5451 -0.8991 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7632 -0.8681 -1.1576 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8066 -1.1202 -1.6772 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1862 -0.4502 -1.7598 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0448 -2.9652 -0.4196 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4746 -3.9324 1.2103 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9566 -4.2751 -0.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -3.5894 -0.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9234 -1.5236 -0.3049 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7751 -0.5851 -1.2184 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -0.6839 1.7226 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8645 -0.1574 1.4571 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3871 1.4396 1.1808 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 3.3839 -0.9511 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9791 3.6603 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7721 4.2284 -0.4177 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1199 2.9263 -0.9524 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5877 1.4112 -1.6601 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 2 0 16 4 1 0 8 6 1 0 1 18 1 0 1 19 1 0 1 20 1 0 3 21 1 0 3 22 1 0 3 23 1 0 5 24 1 0 5 25 1 0 6 26 1 0 9 27 1 0 9 28 1 0 9 29 1 0 10 30 1 0 10 31 1 0 11 32 1 0 11 33 1 0 12 34 1 0 14 35 1 0 14 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 M END