HMDB0005809 RDKit 3D Eugenol 24 24 0 0 0 0 0 0 0 0999 V2000 3.2944 1.5143 0.0992 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8381 0.3394 -0.2672 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0193 -0.4542 0.6692 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6707 -0.7369 0.1332 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -1.8759 -0.6121 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8134 -2.1670 -1.1312 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -1.2801 -0.8741 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0896 -1.5788 -1.3937 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5931 -0.1450 -0.1237 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6416 0.7115 0.1084 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4523 1.8799 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3427 0.1574 0.3976 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1082 1.9600 1.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8904 2.0957 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0697 -0.0381 -1.2619 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5975 -1.4054 0.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 0.0813 1.6392 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2603 -2.5671 -0.8103 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9878 -3.0651 -1.7199 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9082 -1.0305 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4735 2.2932 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9794 1.6176 1.8229 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 2.6327 0.3416 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 1.0609 0.9793 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 7 9 1 0 9 10 1 0 10 11 1 0 9 12 2 0 12 4 1 0 1 13 1 0 1 14 1 0 2 15 1 0 3 16 1 0 3 17 1 0 5 18 1 0 6 19 1 0 8 20 1 0 11 21 1 0 11 22 1 0 11 23 1 0 12 24 1 0 M END