HMDB0303099 RDKit 3D 6-Methylgingediol 52 52 0 0 0 0 0 0 0 0999 V2000 6.4017 -0.8325 -2.1684 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0977 -0.6099 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2878 0.5814 -0.5096 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0717 0.9145 0.3117 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9275 1.2328 -0.5887 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6676 1.5906 0.1777 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8544 2.6970 0.9875 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1769 0.4307 1.0108 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0775 0.8699 1.7392 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1982 1.9507 2.5699 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7135 -0.2155 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1883 -1.4065 1.7572 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2381 -1.1217 0.7739 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9209 -0.8224 -0.5246 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8989 -0.5384 -1.4912 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 -0.5594 -1.1304 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -0.2931 -2.0127 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0665 0.0261 -3.3664 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5535 -0.8610 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8914 -0.8776 0.5236 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2558 -1.1819 1.8518 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5962 -1.1398 1.1291 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 -0.0104 -2.8638 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2119 -0.9339 -1.4447 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3324 -1.8171 -2.7059 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9363 -1.4940 -0.7852 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2848 -0.4625 -2.1709 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1681 0.3415 0.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6228 1.4543 -1.1255 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8745 0.0017 0.9466 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3474 1.7632 0.9827 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7261 0.3673 -1.2424 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 2.1173 -1.1944 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8824 1.8252 -0.5686 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0031 3.5204 0.4593 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9132 0.1764 1.8141 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -0.4470 0.3743 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7463 1.2727 0.9392 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 2.8012 2.2002 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6044 0.2273 3.0685 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0088 -0.5060 3.3491 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3429 -1.9698 1.3093 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6338 -2.1096 2.5126 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8982 -0.7964 -0.8657 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -0.3073 -2.5012 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0855 -0.8876 -3.9674 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8809 0.6950 -3.7573 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1213 0.5538 -3.5745 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9003 -0.3864 2.5647 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7800 -2.1207 2.2194 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3477 -1.3273 1.9631 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8368 -1.3753 2.1483 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 6 8 1 0 8 9 1 0 9 10 1 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 17 18 1 0 16 19 1 0 19 20 1 0 20 21 1 0 19 22 2 0 22 13 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 4 30 1 0 4 31 1 0 5 32 1 0 5 33 1 0 6 34 1 0 7 35 1 0 8 36 1 0 8 37 1 0 9 38 1 0 10 39 1 0 11 40 1 0 11 41 1 0 12 42 1 0 12 43 1 0 14 44 1 0 15 45 1 0 18 46 1 0 18 47 1 0 18 48 1 0 21 49 1 0 21 50 1 0 21 51 1 0 22 52 1 0 M END