HMDB0036568 RDKit 3D Persenone A 65 64 0 0 0 0 0 0 0 0999 V2000 -8.7820 1.1095 0.0668 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5394 1.7425 -0.5532 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6298 2.2018 0.5164 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1757 1.1311 1.4253 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3316 0.0232 0.9229 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8849 -0.8063 -0.1129 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3119 -0.9774 -1.2747 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0332 -0.3737 -1.7316 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0659 -1.4311 -2.0511 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9199 -1.5776 -1.4689 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4568 -0.6840 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2005 -1.4663 0.8896 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -2.5243 0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1658 -1.9745 0.2317 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7452 -1.0040 1.2434 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0415 -0.5045 0.7502 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2075 0.7770 0.5466 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4758 1.3092 0.0591 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5703 2.5524 -0.1182 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6446 0.4725 -0.2346 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5281 0.4387 1.0172 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9266 1.7101 1.3119 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6708 -0.4944 0.8483 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5582 -0.1653 -0.1608 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3836 0.9223 -0.2665 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2819 1.1416 -1.4336 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3938 1.7754 0.6487 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8283 1.4362 1.1102 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7964 0.0117 -0.0222 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6564 1.4628 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8614 2.5984 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0807 1.0326 -1.2219 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7104 2.6210 0.0124 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0861 3.0149 1.1477 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1125 0.7011 1.9247 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6851 1.6566 2.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1512 -0.6589 1.8228 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3293 0.4682 0.6751 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8290 -1.3237 0.0779 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8121 -1.6330 -2.0021 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3125 0.0669 -2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6829 0.4834 -1.1835 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3294 -2.1555 -2.8448 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2116 -2.3896 -1.7355 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4556 -0.2873 -0.7455 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0899 0.1441 -0.1239 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9279 -0.7560 1.6788 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1239 -1.9784 1.2237 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0383 -3.0913 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4893 -3.2879 -0.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1762 -1.4912 -0.7443 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8538 -2.8655 0.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0561 -0.1497 1.3838 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8276 -1.4877 2.2529 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 -1.2181 0.5661 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3905 1.4304 0.7455 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 -0.5645 -0.4939 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2937 0.9846 -1.0049 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8444 0.0688 1.8552 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7442 2.3018 0.5466 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2278 -0.5443 1.8358 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2923 -1.5380 0.7199 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6744 1.0336 -2.3561 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6591 2.1827 -1.4397 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1034 0.3972 -1.4551 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 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 27 2 0 1 28 1 0 1 29 1 0 1 30 1 0 2 31 1 0 2 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 4 36 1 0 5 37 1 0 5 38 1 0 6 39 1 0 7 40 1 0 8 41 1 0 8 42 1 0 9 43 1 0 10 44 1 0 11 45 1 0 11 46 1 0 12 47 1 0 12 48 1 0 13 49 1 0 13 50 1 0 14 51 1 0 14 52 1 0 15 53 1 0 15 54 1 0 16 55 1 0 17 56 1 0 20 57 1 0 20 58 1 0 21 59 1 0 22 60 1 0 23 61 1 0 23 62 1 0 26 63 1 0 26 64 1 0 26 65 1 0 M END