HMDB0028801 RDKit 3D Glutaminylleucine 39 38 0 0 0 0 0 0 0 0999 V2000 -4.2058 1.1199 -0.5149 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8829 -0.3673 -0.5676 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6162 -0.8864 -1.8142 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4316 -0.6223 -0.7579 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5846 -0.0492 0.3279 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1785 -0.3320 0.0736 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7394 0.7178 -0.1434 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4127 1.9247 -0.1331 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1914 0.4015 -0.4036 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8501 1.6515 -0.6745 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6646 -0.3447 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0727 -0.7923 0.8141 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 0.3054 0.7972 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 0.0837 0.4415 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6795 1.4669 1.0952 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8922 -0.5727 1.6692 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0151 -1.1655 2.3304 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1559 -0.4030 2.1928 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3209 1.2014 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8964 1.5799 -1.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7232 1.5896 0.3596 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3286 -0.8470 0.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8935 -1.4201 -2.4754 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3794 -1.6109 -1.5026 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0979 -0.0857 -2.3783 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -1.7082 -0.8539 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1187 -0.1367 -1.7109 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6981 1.0606 0.3068 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1572 -1.3089 0.0478 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2378 -0.2053 -1.3426 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1845 2.3675 -1.0888 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5676 1.4949 -1.4159 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4147 0.2721 1.6904 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9814 -1.2404 0.8997 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2668 -1.3559 1.7777 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3191 -1.5060 -0.0044 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6330 0.1475 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1324 -0.1207 1.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3337 -0.3037 3.1859 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 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 2 0 5 16 1 0 16 17 2 0 16 18 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 1 6 29 1 0 9 30 1 6 10 31 1 0 10 32 1 0 11 33 1 0 11 34 1 0 12 35 1 0 12 36 1 0 14 37 1 0 14 38 1 0 18 39 1 0 M END