HMDB0028829 RDKit 3D Glutamylthreonine 33 32 0 0 0 0 0 0 0 0999 V2000 3.9893 -0.7878 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5288 -0.8797 1.1339 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8473 -0.2308 2.1895 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -0.1248 -0.1518 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7212 -0.1781 -0.3552 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1228 0.9469 -0.2276 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4067 2.0429 0.0777 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5934 0.9527 -0.4233 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9909 -0.3896 -0.8109 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 1.3149 0.7936 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8302 1.3169 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3876 0.0365 0.0552 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5719 -0.2496 -1.1548 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -0.9310 0.9919 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9272 -0.6415 -1.2895 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4315 -1.0932 -2.3605 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 -0.6362 -1.1874 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1794 -0.8137 2.5322 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5589 -1.6489 1.0079 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4704 0.1460 1.0596 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2051 -1.9370 1.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0595 0.7392 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4965 0.9217 0.0549 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -1.0863 -0.6058 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8342 1.6338 -1.2484 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1333 -1.0101 0.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4606 -0.7767 -1.5965 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1729 0.6292 1.6507 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1178 2.3705 1.1216 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0796 2.1215 -0.2383 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3803 1.6383 1.4537 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 -1.9275 0.8335 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8448 -1.4687 -1.4863 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 2 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 4 15 1 0 15 16 2 0 15 17 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 6 3 22 1 0 4 23 1 1 5 24 1 0 8 25 1 6 9 26 1 0 9 27 1 0 10 28 1 0 10 29 1 0 11 30 1 0 11 31 1 0 14 32 1 0 17 33 1 0 M END