HMDB0028699 RDKit 3D Alanyltyrosine 34 34 0 0 0 0 0 0 0 0999 V2000 -2.5179 1.6493 -0.3471 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9578 0.3179 0.2451 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6161 0.6249 1.5014 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8133 -0.5972 0.4364 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5573 -0.9817 1.6014 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0428 -1.0183 -0.6513 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -1.8935 -0.5881 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1136 -1.5259 0.4586 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7261 -0.2110 0.2792 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8569 -0.0520 -0.5125 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4571 1.1769 -0.6894 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9383 2.3009 -0.0717 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5297 3.5579 -0.2364 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8315 2.1672 0.7081 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 0.9153 0.8804 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3779 -3.2687 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6019 -3.5043 -0.1588 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4916 -4.3468 -0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1818 2.3065 0.4921 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4237 2.1272 -0.7614 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7783 1.5389 -1.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7039 -0.0965 -0.4833 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3638 1.3267 1.3069 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9937 -0.2577 1.9389 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3187 -0.6572 -1.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6124 -1.8639 -1.5891 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9191 -2.2964 0.3752 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6692 -1.6793 1.4679 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3101 -0.8975 -1.0232 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3388 1.3299 -1.3006 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 4.3599 0.2267 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4221 3.0500 1.1946 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3669 0.9301 1.5215 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2218 -4.5318 -0.8359 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 2 0 7 16 1 0 16 17 2 0 16 18 1 0 15 9 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 6 3 23 1 0 3 24 1 0 6 25 1 0 7 26 1 6 8 27 1 0 8 28 1 0 10 29 1 0 11 30 1 0 13 31 1 0 14 32 1 0 15 33 1 0 18 34 1 0 M END