HMDB0013946 RDKit 3D 8-Hydroxycarvedilol 57 60 0 0 0 0 0 0 0 0999 V2000 7.6709 -1.1248 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3196 -0.9104 -2.3757 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 -1.5054 -1.2348 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6243 -2.2950 -0.4478 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1693 -2.9043 0.6974 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8701 -2.7172 1.0702 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0617 -1.9120 0.2661 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4935 -1.2955 -0.8773 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7464 -0.5128 -1.6756 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4558 -0.0613 -1.6667 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0478 0.8164 -0.5299 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6637 1.2009 -0.6679 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2283 2.0524 0.3839 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1693 1.3174 1.7409 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2644 2.2456 2.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6699 0.0836 1.6161 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9589 0.2008 1.2387 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 0.7212 1.7983 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1805 1.2860 3.0479 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3827 1.7773 3.4959 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4935 1.7026 2.6838 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4164 1.1405 1.4247 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3233 0.9380 0.4323 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7233 0.3401 -0.6125 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1485 -0.0883 -1.8528 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5035 0.1098 -2.1734 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3140 -0.6863 -2.7621 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9737 -0.8795 -2.4395 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5237 -0.4595 -1.2047 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3715 0.1396 -0.3006 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2226 0.6488 0.9686 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7937 -2.2043 -2.9068 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9385 -0.5115 -3.6015 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3106 -0.8777 -1.8411 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6692 -2.4670 -0.7185 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8453 -3.5165 1.2767 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4644 -3.1792 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0211 -1.7798 0.5638 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2446 0.4358 -2.6482 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7647 -0.9585 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6283 1.7801 -0.6633 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2995 0.4042 0.4376 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3966 1.4843 -1.6111 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9852 2.8580 0.5162 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7914 2.4232 0.2108 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2314 1.0461 2.0397 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3513 2.3984 3.3999 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1378 -0.6903 0.9767 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5902 -0.4022 2.6592 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3221 1.3094 3.6897 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 2.2315 4.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4481 2.0752 2.9997 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3229 1.2065 0.4824 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1429 0.5441 -1.5348 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7056 -1.0021 -3.7204 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3487 -1.3538 -3.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4612 -0.6224 -0.9717 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 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 25 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 8 3 1 0 31 18 1 0 31 22 2 0 30 24 1 0 1 32 1 0 1 33 1 0 1 34 1 0 4 35 1 0 5 36 1 0 6 37 1 0 7 38 1 0 10 39 1 0 10 40 1 0 11 41 1 0 11 42 1 0 12 43 1 0 13 44 1 0 13 45 1 0 14 46 1 0 15 47 1 0 16 48 1 0 16 49 1 0 19 50 1 0 20 51 1 0 21 52 1 0 23 53 1 0 26 54 1 0 27 55 1 0 28 56 1 0 29 57 1 0 M END