HMDB0029167 RDKit 3D 2-Methyladipic acid 23 22 0 0 0 0 0 0 0 0999 V2000 2.3854 -0.7348 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5015 0.4363 -0.5245 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0847 0.0085 -0.8034 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5869 -0.6537 0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9811 -1.0463 -0.0241 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 0.0354 -0.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0383 -0.2710 -0.7853 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5689 1.3778 -0.3549 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6219 1.4453 0.5175 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0376 2.5918 0.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3095 1.2476 1.8541 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7973 -0.6213 0.8901 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8126 -1.6701 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2728 -0.8010 -0.8096 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8924 0.8475 -1.4758 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4818 0.8624 -1.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1579 -0.7514 -1.6356 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0044 -1.5514 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5889 0.0577 1.1965 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4156 -1.6119 0.8443 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9825 -1.7898 -0.8676 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1226 1.9719 0.2481 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7784 0.6205 2.4648 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 1 0 5 6 1 0 6 7 2 0 6 8 1 0 2 9 1 0 9 10 2 0 9 11 1 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 3 16 1 0 3 17 1 0 4 18 1 0 4 19 1 0 5 20 1 0 5 21 1 0 8 22 1 0 11 23 1 0 M END