HMDB0041249 RDKit 3D 6-Hydroxyshogaol 45 45 0 0 0 0 0 0 0 0999 V2000 7.5340 0.5885 0.8831 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1441 1.1487 0.6822 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4683 0.5647 -0.5133 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0091 0.8758 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 0.1727 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6175 -1.2008 0.4208 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7838 0.1861 0.2174 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3717 -0.3653 -0.8894 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0454 -0.4761 -1.4553 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0011 -0.9851 -2.6743 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2218 -0.1192 -0.9505 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6265 -1.0811 0.2101 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1101 -1.0044 0.3945 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -2.2525 0.4382 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 -2.1836 0.3256 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9382 -1.0969 0.1731 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2831 -1.0122 0.0869 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2835 0.1595 0.0969 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0121 1.1432 -0.1112 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7789 2.1921 -0.3322 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8731 0.1060 0.2294 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8248 -0.0880 0.0624 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2289 1.3928 1.0902 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4714 -0.1105 1.7868 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2538 2.2647 0.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5538 1.0969 1.5675 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 -0.5924 -0.4451 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9882 0.8045 -1.4749 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 0.8708 -1.5888 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9081 2.0272 -0.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5031 0.5480 1.4552 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3225 -1.6175 -0.3976 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0806 0.5742 0.9121 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2352 -0.7342 -1.5675 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2138 0.9219 -0.4756 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0614 -0.1256 -1.6593 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0589 -0.9898 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4872 -2.1311 -0.2579 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2679 -3.0995 0.5077 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6863 -3.1985 0.3567 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9935 -1.7381 0.1594 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8777 2.0936 0.0274 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5467 3.2041 -0.0899 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1311 2.1641 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2896 1.1021 0.2254 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 5 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 1 0 18 21 2 0 21 13 1 0 1 22 1 0 1 23 1 0 1 24 1 0 2 25 1 0 2 26 1 0 3 27 1 0 3 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 6 32 1 0 7 33 1 0 8 34 1 0 11 35 1 0 11 36 1 0 12 37 1 0 12 38 1 0 14 39 1 0 15 40 1 0 17 41 1 0 20 42 1 0 20 43 1 0 20 44 1 0 21 45 1 0 M END