HMDB0030502 RDKit 3D (2S,4S,6S)-2-[2-(4-Hydroxy-3-meyhoxyphenyl)ethyl]tetrahydro-6-(4,5-dihydroxy-... 54 56 0 0 0 0 0 0 0 0999 V2000 5.3768 -0.3682 1.8363 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7552 -0.8747 0.5709 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0158 -0.4534 -0.5341 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9519 0.4212 -0.4315 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2079 0.8511 -1.5053 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 1.7793 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7704 1.1506 -1.0527 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6929 0.2625 0.1695 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9738 0.9737 1.4398 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2025 1.4595 2.2087 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 0.8847 3.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4762 1.1590 1.4878 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4589 -0.2222 0.9096 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -0.3951 0.1586 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9094 0.0777 -1.1251 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0924 -0.0834 -1.8154 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1938 0.4166 -3.1012 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1646 -0.7289 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3884 -0.9167 -1.9115 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0109 -1.2115 0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0649 -1.8697 0.6579 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0071 -2.3900 1.9518 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8246 -1.0406 0.7137 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -0.5239 0.1008 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5682 0.3634 -2.7473 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6309 -0.5154 -2.8817 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3547 -0.9251 -1.7826 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4228 -1.8087 -1.9197 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3150 0.7444 1.8484 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4268 -0.8282 2.1998 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1414 -0.6215 2.6159 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7294 0.7612 0.5656 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9907 2.3662 -2.2514 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4105 2.5306 -0.5498 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0286 1.9572 -0.9335 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4903 0.5755 -1.9502 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5819 -0.4527 0.0228 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6998 1.7953 1.2034 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5766 0.2975 2.1158 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1907 2.5558 2.3953 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1641 0.9735 3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7222 1.8702 0.6763 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3419 1.1994 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4624 -0.9512 1.7547 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0612 0.5932 -1.5854 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9871 0.3673 -3.7041 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5508 -0.5867 -2.8477 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0139 -2.9196 2.0486 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9936 -1.6081 2.7327 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7620 -3.1711 2.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6789 -1.4122 1.7334 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0139 0.6736 -3.6114 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8987 -0.8875 -3.8651 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9723 -2.1289 -1.1418 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 2 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 20 23 2 0 13 24 1 0 5 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 27 3 1 0 24 8 1 0 23 14 1 0 1 29 1 0 1 30 1 0 1 31 1 0 4 32 1 0 6 33 1 0 6 34 1 0 7 35 1 0 7 36 1 0 8 37 1 0 9 38 1 0 9 39 1 0 10 40 1 0 11 41 1 0 12 42 1 0 12 43 1 0 13 44 1 0 15 45 1 0 17 46 1 0 19 47 1 0 22 48 1 0 22 49 1 0 22 50 1 0 23 51 1 0 25 52 1 0 26 53 1 0 28 54 1 0 M END