HMDB0301743 RDKit 3D 7-Hydroxysecoisolariciresinol 57 58 0 0 0 0 0 0 0 0999 V2000 -2.1444 -3.0319 -2.7675 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -1.9951 -2.6224 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8661 -1.4735 -1.2161 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1868 -0.8447 -0.8782 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1288 -1.9323 -0.9899 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4346 -0.3381 0.4553 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2266 -1.0058 1.6273 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5578 -0.4638 2.8433 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1181 0.7929 2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 1.3510 4.1039 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3552 1.5234 1.7383 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9270 2.8036 1.8016 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1291 3.4684 0.5696 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0068 0.9383 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3393 -0.6473 -1.0661 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6486 -1.2726 -1.3171 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0345 -1.8182 -2.6326 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4439 0.0791 0.2726 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7371 0.8427 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8623 2.0705 -0.3095 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0353 2.7854 -0.2238 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1365 2.3274 0.4663 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 3.0556 0.5483 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0303 1.0946 1.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1325 0.6117 1.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0001 -0.6490 2.4203 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8561 0.3834 1.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1998 -3.6958 -1.9015 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -3.7156 -3.6356 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -2.5308 -3.0804 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2931 -1.1517 -3.3324 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1678 -2.4746 -3.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7016 -2.4141 -0.6081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4589 -0.1523 -1.6851 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 -1.4557 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7876 -1.9904 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -1.0129 3.7838 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8654 2.2600 4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6506 4.4255 0.6824 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7417 2.8373 -0.1385 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1297 3.6899 0.1131 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1977 1.5227 -0.3601 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2354 0.2109 -1.8548 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8669 -2.1038 -0.5538 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -0.5344 -1.0231 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6315 -1.3093 -3.5222 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2034 -1.7064 -2.7212 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9502 -2.9126 -2.7636 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5628 -0.7042 1.0451 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 0.8143 0.4432 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0227 2.4692 -0.8622 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1269 3.7551 -0.7104 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0836 2.6599 1.0697 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1682 -0.5591 3.1732 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8042 -1.4599 1.7017 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9259 -0.8294 3.0299 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7483 -0.5877 1.4818 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 4 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 11 14 2 0 3 15 1 0 15 16 1 0 16 17 1 0 15 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 24 27 2 0 14 6 1 0 27 19 1 0 1 28 1 0 1 29 1 0 1 30 1 0 2 31 1 0 2 32 1 0 3 33 1 1 4 34 1 0 5 35 1 0 7 36 1 0 8 37 1 0 10 38 1 0 13 39 1 0 13 40 1 0 13 41 1 0 14 42 1 0 15 43 1 6 16 44 1 0 16 45 1 0 17 46 1 0 17 47 1 0 17 48 1 0 18 49 1 0 18 50 1 0 20 51 1 0 21 52 1 0 23 53 1 0 26 54 1 0 26 55 1 0 26 56 1 0 27 57 1 0 M END