HMDB0031864 RDKit 3D Methyleugenol 27 27 0 0 0 0 0 0 0 0999 V2000 4.1518 -0.1846 -0.4816 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1538 -1.0068 -0.1855 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3118 -0.8110 1.0314 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8998 -0.6201 0.6047 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0296 -1.6873 0.4599 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2787 -1.5377 0.0673 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7626 -0.2552 -0.2003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0594 -0.0150 -0.5986 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0478 -0.9792 -0.7878 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9209 0.8293 -0.0654 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4057 2.1249 -0.3345 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6051 3.2600 -0.2166 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3861 0.6324 0.3315 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3831 0.6451 0.1444 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7287 -0.3692 -1.3702 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9078 -1.8532 -0.8122 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3525 -1.7261 1.6273 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6816 0.0556 1.6246 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3658 -2.7083 0.6588 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9674 -2.3579 -0.0497 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7827 -0.5671 -1.5181 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6778 -1.9702 -1.0917 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6336 -1.1471 0.1635 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0811 3.3675 -1.0831 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0325 3.2275 0.7341 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2926 4.1501 -0.2516 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0334 1.5037 0.4315 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 7 10 1 0 10 11 1 0 11 12 1 0 10 13 2 0 13 4 1 0 1 14 1 0 1 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 5 19 1 0 6 20 1 0 9 21 1 0 9 22 1 0 9 23 1 0 12 24 1 0 12 25 1 0 12 26 1 0 13 27 1 0 M END