HMDB0030503 RDKit 3D (2S,4S,6S)-2-[2-(4-Hydroxy-3-meyhoxyphenyl)ethyl]tetrahydro-6-(4,5-dihydroxy-... 59 61 0 0 0 0 0 0 0 0999 V2000 5.0108 3.8977 1.3194 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9612 2.9315 0.8476 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5455 1.6655 0.5151 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2467 1.2265 0.5986 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8654 -0.0402 0.2599 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4344 -0.5109 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7993 -0.2174 -0.9526 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3649 -0.6058 -1.0844 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1384 -2.1014 -0.8848 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3564 -2.2214 -0.6516 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8514 -3.5082 -0.8308 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8117 -3.8595 -1.7673 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2361 -5.2638 -1.8386 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2397 -2.9213 -2.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5506 -1.6871 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0774 -0.2600 0.7289 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2848 0.5833 0.9734 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6001 1.0964 2.2337 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7211 1.8722 2.4289 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0029 2.3631 3.6878 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5803 2.1790 1.4019 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7206 2.9559 1.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2916 1.6856 0.1505 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1503 1.9878 -0.8941 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8465 1.4753 -2.1818 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1633 0.9068 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4943 0.1819 -0.4064 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8392 -0.9101 -0.1853 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1605 -0.5271 -0.2906 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4956 0.7611 0.0628 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8233 1.1418 -0.0441 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4007 3.4995 2.1468 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 4.8488 1.5554 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2926 4.1305 0.4805 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5058 1.9295 0.9506 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5071 -1.5918 0.5884 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9313 0.0676 1.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4456 -0.6642 -1.7534 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8609 0.8824 -1.1227 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1164 -0.4572 -2.1848 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6224 -2.4738 0.0411 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -2.6779 -1.7751 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8467 -1.5509 -1.3631 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -5.5061 -0.8894 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4224 -5.9689 -2.0338 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0231 -5.3229 -2.6393 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5989 -1.7981 1.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9133 -2.2398 1.4851 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4139 -0.0508 1.6245 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9077 0.8410 3.0276 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7714 2.9271 3.9515 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0282 3.3678 2.4177 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8801 1.9208 -2.5496 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6181 1.7875 -2.9227 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7071 0.3867 -2.1933 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9704 0.5389 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5186 -1.9281 -0.4551 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8684 -1.2507 -0.6433 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0971 2.0759 0.2068 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 11 12 1 0 12 13 1 0 12 14 2 0 10 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 19 21 2 0 21 22 1 0 21 23 1 0 23 24 1 0 24 25 1 0 23 26 2 0 16 27 1 0 5 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 30 3 1 0 27 8 1 0 26 17 1 0 1 32 1 0 1 33 1 0 1 34 1 0 4 35 1 0 6 36 1 0 6 37 1 0 7 38 1 0 7 39 1 0 8 40 1 0 9 41 1 0 9 42 1 0 10 43 1 0 13 44 1 0 13 45 1 0 13 46 1 0 15 47 1 0 15 48 1 0 16 49 1 0 18 50 1 0 20 51 1 0 22 52 1 0 25 53 1 0 25 54 1 0 25 55 1 0 26 56 1 0 28 57 1 0 29 58 1 0 31 59 1 0 M END