HMDB0256567 RDKit 3D Pinosylvin 28 29 0 0 0 0 0 0 0 0999 V2000 -4.2282 -2.0726 -0.5789 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5996 -0.8833 -0.1971 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3167 0.2421 0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6459 1.3950 0.5118 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4306 2.5013 0.8422 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2689 1.4397 0.5505 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5126 0.3160 0.2141 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0365 0.3972 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7605 -0.5698 -0.0209 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2055 -0.4539 0.0413 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8146 0.7111 0.4154 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2141 0.7969 0.4674 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0065 -0.2795 0.1462 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3563 -1.4340 -0.2254 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0045 -1.5601 -0.2891 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2015 -0.8121 -0.1497 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4196 -2.1918 -1.5807 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3968 0.2247 0.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0494 3.3906 1.1261 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7477 2.3493 0.8432 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3799 1.3616 0.5741 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3057 -1.5226 -0.3261 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2625 1.6102 0.6857 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6806 1.7140 0.7617 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0834 -0.2037 0.1893 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9503 -2.3133 -0.4887 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4785 -2.4501 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -1.7027 -0.4172 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 4 6 2 0 6 7 1 0 7 8 1 0 8 9 2 3 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 7 16 2 0 16 2 1 0 15 10 1 0 1 17 1 0 3 18 1 0 5 19 1 0 6 20 1 0 8 21 1 0 9 22 1 0 11 23 1 0 12 24 1 0 13 25 1 0 14 26 1 0 15 27 1 0 16 28 1 0 M END