HMDB0304170 RDKit 3D 4-amino-4-deoxychorismate 27 27 0 0 0 0 0 0 0 0999 V2000 -3.2974 -0.7003 0.2308 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1001 -0.8998 0.7343 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2421 0.1348 0.9094 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3519 0.6519 -0.0576 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6158 -0.3199 -0.5421 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9065 -0.1052 -0.5436 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8568 -1.1147 -1.0432 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0788 -0.8975 -1.0387 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3724 -2.3095 -1.5184 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4494 1.1463 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6521 2.0672 0.4073 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1979 1.9405 0.4591 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4231 3.1010 -0.2058 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6962 -2.2418 1.1052 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5589 -2.4806 1.5912 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5446 -3.3488 0.9453 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0059 -1.5255 0.0816 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6141 0.2940 -0.0509 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0239 0.9251 -0.9316 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3049 -1.2917 -0.9344 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2417 -2.4783 -2.5061 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5351 1.2915 -0.0628 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0801 2.9952 0.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0839 2.0771 1.5494 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3636 3.2853 0.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 3.9197 0.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1609 -4.1159 0.3998 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 7 9 1 0 6 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 2 14 1 0 14 15 2 0 14 16 1 0 12 4 1 0 1 17 1 0 1 18 1 0 4 19 1 6 5 20 1 0 9 21 1 0 10 22 1 0 11 23 1 0 12 24 1 1 13 25 1 0 13 26 1 0 16 27 1 0 M END