HMDB0032689 RDKit 3D Annuionone C 36 37 0 0 0 0 0 0 0 0999 V2000 3.6777 1.2581 1.2533 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3238 -0.1014 0.7426 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 -0.5827 -0.1389 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0179 -0.1275 0.0274 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8698 -0.3700 0.6522 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3724 -0.3675 -0.1844 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1746 -1.0858 -1.3984 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0653 -1.5845 -0.3541 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6136 -2.8470 0.3062 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4841 -1.5573 -0.8075 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8557 -0.2926 -1.4789 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9551 -0.2093 -1.9989 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9568 0.8792 -1.5505 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1671 0.9018 -0.2374 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1685 1.0159 0.8921 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2861 2.1415 -0.1771 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7722 1.4678 1.0895 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5349 1.3228 2.3702 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1233 2.0823 0.7768 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2476 -0.7884 1.6326 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0721 -0.2333 -1.0585 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 0.0604 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8655 -0.5560 1.7115 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1444 -2.6537 1.1119 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2022 -3.6020 -0.3747 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4933 -3.2968 0.8113 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5946 -2.3667 -1.5881 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 -1.8316 -0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5469 1.8258 -1.5593 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2904 0.8799 -2.4146 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0848 1.5307 0.4894 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4322 0.0246 1.3263 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 1.7123 1.6769 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8463 2.9672 0.3424 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0638 2.4077 -1.2317 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6362 1.9761 0.3814 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 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 2 0 11 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 8 6 1 0 14 6 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 0 3 21 1 0 4 22 1 0 5 23 1 0 9 24 1 0 9 25 1 0 9 26 1 0 10 27 1 0 10 28 1 0 13 29 1 0 13 30 1 0 15 31 1 0 15 32 1 0 15 33 1 0 16 34 1 0 16 35 1 0 16 36 1 0 M END