HMDB0038875 RDKit 3D Gancaonin Q 56 58 0 0 0 0 0 0 0 0999 V2000 6.8277 -1.4832 -1.9876 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9242 -0.7675 -0.9608 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2359 -1.6416 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8446 0.5165 -1.0156 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1016 1.4709 -0.2142 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2848 1.0073 0.8842 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8893 0.9531 0.8179 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1398 0.5461 1.8883 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6792 0.4978 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1596 0.1175 2.7794 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5546 0.0761 2.6528 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2706 -0.2822 3.6144 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 0.4453 1.4298 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4496 0.4424 1.1901 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3461 0.0758 2.1459 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9407 0.8280 -0.0764 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4195 0.8150 -0.2839 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8933 -0.5720 -0.4176 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5260 -0.9709 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0162 -2.3785 -1.6566 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7740 -0.0180 -2.6017 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0871 1.2017 -1.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5547 1.5927 -2.3357 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7415 1.1922 -0.7848 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1903 0.8282 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0895 0.8354 0.6366 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7667 0.1834 3.0517 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1663 0.2273 3.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9098 0.6361 2.0713 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2902 0.6861 2.1464 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5556 -0.7400 -2.3664 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -2.3153 -1.4466 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1732 -1.8494 -2.7866 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2015 -1.3698 0.1665 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1738 -2.6794 -0.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8486 -1.7364 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4827 0.9629 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4955 2.1765 -0.8696 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9043 2.1497 0.2619 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3957 1.2332 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2292 -0.1742 3.7399 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2888 -0.2111 3.0519 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7005 1.4651 -1.1165 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8482 1.2757 0.6379 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7289 -1.2897 0.3754 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0500 -2.3746 -2.0473 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9705 -2.8898 -0.6957 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3952 -2.9094 -2.3933 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4631 -0.4961 -3.3401 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8131 0.2461 -3.0477 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2859 0.8958 -2.2204 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8698 1.8611 -3.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0674 1.4911 -1.5755 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1888 -0.1393 3.9035 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6487 -0.0678 4.0936 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7456 0.4239 2.9872 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 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 2 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 3 19 20 1 0 19 21 1 0 16 22 2 0 22 23 1 0 22 24 1 0 24 25 2 0 25 26 1 0 8 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 29 6 1 0 26 9 1 0 25 13 1 0 1 31 1 0 1 32 1 0 1 33 1 0 3 34 1 0 3 35 1 0 3 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 7 40 1 0 10 41 1 0 15 42 1 0 17 43 1 0 17 44 1 0 18 45 1 0 20 46 1 0 20 47 1 0 20 48 1 0 21 49 1 0 21 50 1 0 21 51 1 0 23 52 1 0 24 53 1 0 27 54 1 0 28 55 1 0 30 56 1 0 M END