HMDB0059727 RDKit 3D 2,4-Dimethyladipic acid 26 25 0 0 0 0 0 0 0 0999 V2000 0.4911 -1.8944 -0.5319 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7263 -0.4144 -0.4257 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1098 -0.2504 0.1611 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5799 1.1146 0.3393 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0426 2.1842 0.0408 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 1.2324 0.9504 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3164 0.3627 0.2584 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6443 0.3270 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2442 -1.0371 -0.4535 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6068 1.2927 0.2109 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6572 0.8608 0.7111 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3194 2.6307 0.2029 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2712 -2.2456 -1.5707 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1912 -2.3131 0.2044 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4741 -2.4612 -0.3193 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8543 -0.0606 -1.5071 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8081 -0.7463 -0.5735 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -0.8628 1.0913 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6929 1.3218 0.3572 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0011 1.3988 0.5419 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4486 -0.1172 1.2985 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4704 0.6317 -1.4797 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3506 -0.8380 -0.7103 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3142 -1.5561 0.5306 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9142 -1.6645 -1.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6518 3.1043 -0.3866 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 4 6 1 0 2 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 2 0 10 12 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 6 19 1 0 7 20 1 0 7 21 1 0 8 22 1 0 9 23 1 0 9 24 1 0 9 25 1 0 12 26 1 0 M END