HMDB0029056 RDKit 3D Threonylasparagine 31 30 0 0 0 0 0 0 0 0999 V2000 -3.4391 -0.1095 0.8801 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9316 0.8150 -0.1714 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1288 1.7991 0.3888 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1924 0.1017 -1.2880 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0415 -0.9378 -1.8784 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9549 -0.5424 -0.7965 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8622 -1.7937 -0.8694 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1387 0.1610 -0.2467 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3374 -0.4494 0.2419 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4632 0.0149 -0.6835 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7716 -0.5823 -0.2413 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8746 0.2881 -0.0226 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9065 -1.8047 -0.0647 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6852 0.0228 1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9887 0.9200 2.2029 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7728 -0.4661 2.3144 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6603 -1.1420 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4267 0.2881 1.2721 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7545 -0.1174 1.7691 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8274 1.3308 -0.6165 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2306 2.6996 -0.0463 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9928 0.8785 -2.0456 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0095 -0.6326 -2.0491 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9343 -1.7683 -1.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0425 1.2026 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3179 -1.5490 0.2348 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5183 1.1055 -0.6748 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -0.3383 -1.7275 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7568 1.3332 -0.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7972 -0.0841 0.2737 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7219 -0.6015 3.3369 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 4 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 2 0 9 14 1 0 14 15 2 0 14 16 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 6 3 21 1 0 4 22 1 6 5 23 1 0 5 24 1 0 8 25 1 0 9 26 1 1 10 27 1 0 10 28 1 0 12 29 1 0 12 30 1 0 16 31 1 0 M END