HMDB0036262 RDKit 3D Annoglabasin E 55 58 0 0 0 0 0 0 0 0999 V2000 -3.3971 0.5222 1.4922 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8414 0.4376 0.0736 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3979 1.6875 -0.6355 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9916 2.8486 -0.0193 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5076 -0.7153 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8827 -2.0447 -0.3782 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4339 -1.9489 -0.7128 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6865 -0.8897 0.0914 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7502 -1.4319 1.5288 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3665 0.4546 0.0209 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7822 1.1835 -1.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6172 1.6495 -0.7456 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4159 0.4602 -0.3554 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5607 0.3471 -1.3845 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5326 -0.4416 -0.5767 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0351 -1.7869 -0.1512 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6064 -1.8901 0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7163 -0.8455 -0.4266 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 0.4164 0.6641 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4623 1.5885 0.3727 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0085 1.7127 -0.7449 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6733 2.5985 1.3142 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1746 0.7382 0.9027 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9656 -0.4174 1.7579 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1427 1.3342 1.6233 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5951 0.7376 2.2352 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5124 1.6149 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2786 1.6444 -1.7111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 2.5893 0.7922 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -0.7689 -0.1934 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5647 -0.5158 -1.6903 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1031 -2.5104 0.6009 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3289 -2.7442 -1.1304 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3584 -1.6205 -1.7759 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8918 -2.9031 -0.5835 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8256 -1.4915 1.8082 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3968 -2.4869 1.5267 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2749 -0.7835 2.2539 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0054 1.0212 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6489 0.4942 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 2.0923 -1.4518 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0789 2.2637 -1.5487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4763 2.3106 0.1327 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2156 -0.2211 -2.2721 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 1.3485 -1.5952 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5263 -0.5567 -1.0738 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -2.5096 -0.9556 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6905 -2.0892 0.7181 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5042 -1.8001 1.3003 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1833 -2.8820 -0.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6654 -1.1235 -1.5251 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0493 -0.1800 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2321 3.5220 1.1899 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1355 1.8316 1.1371 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8684 0.1494 1.7637 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 2 5 1 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 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 15 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 19 23 1 0 10 2 1 0 18 13 1 0 18 8 1 0 23 13 1 0 1 24 1 0 1 25 1 0 1 26 1 0 3 27 1 0 3 28 1 0 4 29 1 0 5 30 1 0 5 31 1 0 6 32 1 0 6 33 1 0 7 34 1 0 7 35 1 0 9 36 1 0 9 37 1 0 9 38 1 0 10 39 1 0 11 40 1 0 11 41 1 0 12 42 1 0 12 43 1 0 14 44 1 0 14 45 1 0 15 46 1 0 16 47 1 0 16 48 1 0 17 49 1 0 17 50 1 0 18 51 1 0 19 52 1 0 22 53 1 0 23 54 1 0 23 55 1 0 M END