HMDB0029012 RDKit 3D Prolyl-Asparagine 31 31 0 0 0 0 0 0 0 0999 V2000 4.0692 0.1478 1.6441 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4914 -0.2577 0.5686 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4163 -1.6074 0.2953 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9177 0.7520 -0.3535 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4177 0.5413 -0.5281 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7849 0.6604 0.7458 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4313 0.2960 0.9328 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9618 0.4485 2.2033 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2901 -0.2748 -0.1308 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5143 0.6454 -0.2353 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4893 -0.1130 0.6413 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2064 -1.5443 0.1938 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7698 -1.5785 0.2164 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9332 1.5635 -1.4845 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 2.3864 -1.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4234 1.5947 -2.7762 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4946 -0.4756 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1359 -2.1257 -0.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0629 1.7817 0.0157 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3641 0.6799 -1.3678 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2207 -0.4969 -0.9188 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6523 -0.0644 3.0174 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7877 -0.3336 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3032 1.6498 0.1526 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8466 0.6531 -1.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 0.0014 1.6861 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5398 0.1696 0.4391 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5273 -1.6377 -0.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6837 -2.2715 0.8737 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3897 -2.3050 -0.4287 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7748 0.7305 -3.1669 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 3 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 5 14 1 0 14 15 2 0 14 16 1 0 13 9 1 0 1 17 1 0 3 18 1 0 4 19 1 0 4 20 1 0 5 21 1 0 8 22 1 0 9 23 1 0 10 24 1 0 10 25 1 0 11 26 1 0 11 27 1 0 12 28 1 0 12 29 1 0 13 30 1 0 16 31 1 0 M END