HMDB0303098 RDKit 3D [6]-Gingerdiol acetate methyl ether 57 57 0 0 0 0 0 0 0 0999 V2000 6.4330 2.1769 1.9451 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4136 1.2136 1.3395 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 1.2710 -0.1473 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5881 0.3530 -0.8285 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1369 0.6575 -0.5304 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -0.3433 -1.2907 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8273 -0.1927 -1.1147 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4398 -0.3464 0.3185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8294 -1.6118 0.7381 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0054 -0.0612 0.5988 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -0.9275 -0.1251 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3431 -0.5239 0.2557 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0265 -1.0690 1.3222 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3121 -0.6645 1.6451 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9527 0.3054 0.9016 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2492 0.7261 1.2122 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8903 0.1269 2.3161 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2707 0.8557 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9527 1.8326 -0.8961 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3318 2.4437 -2.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9969 0.4432 -0.4762 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -1.6426 -0.8593 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2304 -2.5758 -1.6959 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5646 -3.9138 -1.1628 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4416 -2.2531 -2.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6318 2.9621 1.2081 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3199 1.6381 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9663 2.6745 2.8397 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 0.1869 1.6963 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3964 1.6284 1.6031 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3216 2.3166 -0.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5838 1.0785 -0.4501 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8018 0.3898 -1.9197 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8558 -0.6928 -0.5195 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9412 1.7013 -0.8432 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0114 0.5993 0.5585 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -0.1945 -2.3789 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5421 0.8233 -1.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3714 -0.9790 -1.7609 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0263 0.3813 0.9192 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8736 -1.7106 1.7161 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2569 1.0032 0.4213 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1582 -0.2233 1.6955 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8403 -1.9766 0.2734 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -0.8935 -1.2145 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5731 -1.8254 1.9306 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8280 -1.1188 2.5004 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0388 -0.9557 2.1922 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8897 0.5813 2.4825 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2687 0.2586 3.2308 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3775 1.7851 -2.8944 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8777 3.3974 -2.2295 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2829 2.7238 -1.8223 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5068 0.9035 -1.3227 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6532 -4.5142 -1.1414 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3416 -4.4074 -1.7601 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -3.8211 -0.1049 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 4 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 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 15 18 1 0 18 19 1 0 19 20 1 0 18 21 2 0 6 22 1 0 22 23 1 0 23 24 1 0 23 25 2 0 21 12 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 0 2 30 1 0 3 31 1 0 3 32 1 0 4 33 1 0 4 34 1 0 5 35 1 0 5 36 1 0 6 37 1 0 7 38 1 0 7 39 1 0 8 40 1 0 9 41 1 0 10 42 1 0 10 43 1 0 11 44 1 0 11 45 1 0 13 46 1 0 14 47 1 0 17 48 1 0 17 49 1 0 17 50 1 0 20 51 1 0 20 52 1 0 20 53 1 0 21 54 1 0 24 55 1 0 24 56 1 0 24 57 1 0 M END