HMDB0029101 RDKit 3D Tyrosyl-Aspartate 37 37 0 0 0 0 0 0 0 0999 V2000 1.6288 -2.0282 0.9097 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7345 -1.0791 0.3254 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8884 0.3098 0.8926 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 0.9003 0.7214 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1453 0.6728 1.7222 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4243 1.1866 1.6604 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8015 1.9402 0.5951 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0983 2.4612 0.5321 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8984 2.1859 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6066 1.6664 -0.3553 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -1.4656 0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9181 -2.5326 1.1218 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7727 -0.6983 0.0402 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1303 -1.0934 0.2343 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 -1.2346 -1.0574 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9571 0.0115 -1.8267 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7418 0.9158 -1.4571 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1785 0.2106 -2.9355 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8505 -0.0923 1.0773 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2795 0.9166 1.5086 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1761 -0.3314 1.3595 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -2.9142 0.3593 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2859 -2.2938 1.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9227 -1.0168 -0.7823 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6323 0.3183 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1522 0.9889 0.3881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9004 0.0799 2.5929 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1334 1.0022 2.4415 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8719 1.9574 0.1002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2293 2.7884 -1.2516 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9049 1.8568 -1.1421 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5532 0.1924 -0.4698 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1652 -2.0542 0.7818 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9369 -1.5514 -0.8094 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4153 -2.0353 -1.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8578 1.0869 -3.2945 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6249 -1.2274 1.3122 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 2 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 14 19 1 0 19 20 2 0 19 21 1 0 10 4 1 0 1 22 1 0 1 23 1 0 2 24 1 0 3 25 1 0 3 26 1 0 5 27 1 0 6 28 1 0 8 29 1 0 9 30 1 0 10 31 1 0 13 32 1 0 14 33 1 0 15 34 1 0 15 35 1 0 18 36 1 0 21 37 1 0 M END