HMDB0041227 RDKit 3D (8betaOH,10beta)-8-Hydroxy-3-oxo-7(11)-eremophilen-12,8-olide 39 41 0 0 0 0 0 0 0 0999 V2000 3.3060 1.4940 -1.2993 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8394 0.1813 -0.7805 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7868 -0.0556 -0.0703 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7201 0.8426 0.4517 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6222 0.1942 0.4664 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2589 0.5416 1.8242 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7446 -1.2414 0.2394 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8706 -1.6255 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -0.9493 -0.3847 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8955 0.5034 -0.2903 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7279 1.3206 -0.0218 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4961 0.9332 -0.5519 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3228 2.4221 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4468 -2.0000 -0.2764 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7529 -1.4936 0.2381 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9423 -1.7506 1.5945 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7996 -2.0598 -0.4753 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5291 -1.0646 -1.0685 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5826 -1.2597 -1.7216 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0233 1.3922 -2.1153 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4038 2.0402 -1.6416 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7673 2.1232 -0.5115 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0496 1.1480 1.4678 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7379 1.7682 -0.1585 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9818 -0.2524 2.5689 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3577 0.6427 1.7412 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 1.4826 2.2306 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0434 -1.7725 1.1945 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5504 -1.4483 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0068 -2.7196 -0.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -1.0859 -1.2691 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6736 -1.3746 0.4705 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1314 0.5995 -1.5487 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8982 2.7080 0.6026 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6767 2.8120 -1.1844 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2995 2.9634 -0.4444 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3512 -3.0704 -0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4644 -1.9609 -1.3843 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9229 -0.9281 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 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 2 0 10 12 1 0 12 13 1 0 7 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 2 0 18 2 1 0 15 3 1 0 12 5 1 0 1 20 1 0 1 21 1 0 1 22 1 0 4 23 1 0 4 24 1 0 6 25 1 0 6 26 1 0 6 27 1 0 7 28 1 0 8 29 1 0 8 30 1 0 9 31 1 0 9 32 1 0 12 33 1 0 13 34 1 0 13 35 1 0 13 36 1 0 14 37 1 0 14 38 1 0 16 39 1 0 M END