HMDB0032292 RDKit 3D Geranyl tiglate 41 40 0 0 0 0 0 0 0 0999 V2000 6.5179 1.3753 0.0449 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2142 0.8386 -0.3418 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7336 -0.2392 0.2536 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5430 -0.8680 1.3006 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4246 -0.8046 -0.1123 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -1.8299 0.4802 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -0.2506 -1.0908 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3509 -0.8127 -1.4364 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4265 -0.8448 -0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7469 -0.1828 -0.3888 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1044 0.5781 -1.5913 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6509 -0.2207 0.7761 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9815 -0.8350 0.5635 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8573 -0.2404 -0.4427 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0467 0.3130 -0.1381 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4872 0.3188 1.2854 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9465 0.9207 -1.1483 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4359 2.4972 0.0137 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2547 1.0987 -0.7618 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8652 1.1178 1.0397 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6584 1.3386 -1.1179 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3744 -0.4013 2.3055 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2124 -1.9231 1.3984 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6209 -0.9074 1.0467 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5801 -1.8647 -1.7402 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9426 -0.3053 -2.3252 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6478 -1.3996 0.6057 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8943 1.3338 -1.2993 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4369 -0.0616 -2.4253 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2847 1.2108 -1.9951 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1622 -0.8108 1.6097 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7468 0.8065 1.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8173 -1.9046 0.2962 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 -0.8898 1.5741 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6184 -0.2187 -1.4972 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7756 0.8338 1.9488 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5095 -0.7627 1.6041 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5265 0.6673 1.3755 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8888 0.3802 -1.2771 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0942 2.0071 -0.8985 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3834 0.9422 -2.1252 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 3 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 3 15 16 1 0 15 17 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 4 22 1 0 4 23 1 0 4 24 1 0 8 25 1 0 8 26 1 0 9 27 1 0 11 28 1 0 11 29 1 0 11 30 1 0 12 31 1 0 12 32 1 0 13 33 1 0 13 34 1 0 14 35 1 0 16 36 1 0 16 37 1 0 16 38 1 0 17 39 1 0 17 40 1 0 17 41 1 0 M END