HMDB0028884 RDKit 3D Histidylglutamic acid 36 36 0 0 0 0 0 0 0 0999 V2000 2.1907 -0.4526 2.3033 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6175 0.1594 1.1268 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3692 -0.2336 -0.1466 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7729 0.1774 -0.0842 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8479 -0.5297 0.3892 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9269 0.2530 0.2413 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5274 1.4156 -0.3098 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2126 1.3916 -0.5179 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2384 -0.3648 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1861 -1.1829 1.8168 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5867 0.0023 -0.1242 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9342 -0.5761 -0.2079 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9413 0.5256 -0.2173 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3401 0.0374 -0.2887 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2194 1.2650 -0.2813 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3286 1.9155 -1.3546 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8422 1.5901 0.9033 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -1.4189 -1.4267 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9881 -1.4805 -2.1928 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0943 -2.1465 -1.7941 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4014 -0.7265 2.9315 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7108 -1.3094 1.9567 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 1.2654 1.2527 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8702 0.2756 -0.9952 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2368 -1.3230 -0.3055 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8018 -1.5236 0.7952 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8862 -0.0392 0.5232 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2005 2.2316 -0.5385 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 0.6820 -0.8408 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0669 -1.1984 0.6967 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6949 1.1994 -1.0799 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7976 1.1240 0.7167 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5525 -0.5700 0.6343 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5982 -0.6014 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5461 2.3832 1.4569 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4832 -2.2169 -2.7256 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 1 0 7 8 2 0 2 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 12 18 1 0 18 19 2 0 18 20 1 0 8 4 1 0 1 21 1 0 1 22 1 0 2 23 1 1 3 24 1 0 3 25 1 0 5 26 1 0 6 27 1 0 7 28 1 0 11 29 1 0 12 30 1 1 13 31 1 0 13 32 1 0 14 33 1 0 14 34 1 0 17 35 1 0 20 36 1 0 M END