HMDB0037591 RDKit 3D Oryzalide A 51 55 0 0 0 0 0 0 0 0999 V2000 -3.4757 1.5765 0.6732 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0661 0.3586 -0.1335 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8729 0.4308 -1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -0.8324 0.5972 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7673 -0.8567 0.9226 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7697 -1.9107 0.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4435 -1.9738 0.4591 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4971 -2.4294 -0.8554 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -0.6105 0.4596 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6747 -0.0288 1.8369 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6112 0.3217 -0.4398 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9899 1.6844 -0.4909 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4651 1.7574 -0.5397 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2738 0.5470 -0.3069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3144 0.3287 -1.4264 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2434 -0.6264 -0.7289 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6429 -1.9419 -0.4044 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2985 -1.9110 0.2193 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5232 -0.7389 -0.2528 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5049 0.1153 0.5645 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7919 0.8459 0.7301 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7048 -0.2016 1.6235 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1893 0.7858 0.8578 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4649 2.5089 0.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9432 1.6706 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5664 1.4190 0.9209 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -0.2590 -2.1723 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8476 1.4389 -1.8517 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8897 0.0369 -1.2424 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8806 -2.6522 1.1215 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4205 -2.7586 -1.0947 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5441 1.0616 1.8032 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0962 -0.5170 2.4332 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6475 -0.2139 2.3663 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5026 -0.1105 -1.4795 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4763 2.2048 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4181 2.2468 0.3939 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7898 2.6084 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7617 2.1591 -1.5593 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8828 1.2764 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8544 -0.0706 -2.3296 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1831 -0.7727 -1.2659 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6631 -2.5670 -1.3425 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3356 -2.4723 0.2939 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7513 -2.8337 -0.1498 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3012 -2.0402 1.3227 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2336 -0.9820 -1.3216 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6359 1.9079 0.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2348 0.7555 1.7374 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5554 0.4343 0.0233 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3051 1.8309 1.2356 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 4 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 9 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 1 0 17 18 1 0 18 19 1 0 16 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 11 2 1 0 19 14 1 0 23 20 1 0 19 9 1 0 23 14 1 0 1 24 1 0 1 25 1 0 1 26 1 0 3 27 1 0 3 28 1 0 3 29 1 0 7 30 1 0 8 31 1 0 10 32 1 0 10 33 1 0 10 34 1 0 11 35 1 0 12 36 1 0 12 37 1 0 13 38 1 0 13 39 1 0 15 40 1 0 15 41 1 0 16 42 1 0 17 43 1 0 17 44 1 0 18 45 1 0 18 46 1 0 19 47 1 0 21 48 1 0 21 49 1 0 21 50 1 0 23 51 1 0 M END