HMDB0060684 RDKit 3D 2-Propylglutaric acid 26 25 0 0 0 0 0 0 0 0999 V2000 2.8656 1.4710 0.2287 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 1.1108 -0.1446 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2668 -0.3371 0.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0014 -1.0250 -0.1577 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2448 -0.6449 0.5237 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 0.7173 0.3887 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0837 1.0871 -1.0183 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9101 0.3259 -1.9946 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5817 2.3590 -1.3012 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2437 -2.4957 0.1433 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3674 -2.8558 0.5432 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7596 -3.4254 -0.0209 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2597 2.2029 -0.5192 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5069 0.5779 0.1592 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9154 1.8457 1.2672 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2986 1.2832 -1.2438 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8132 1.7944 0.4587 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6349 -0.6065 1.1595 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0566 -0.8469 -0.5277 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1749 -0.9840 -1.2793 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0694 -1.3411 0.1355 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2399 -0.9177 1.6251 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8655 0.6244 0.8518 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3345 1.5226 0.9593 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5206 2.6362 -1.0738 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0516 -4.0785 0.7004 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 1 0 7 8 2 0 7 9 1 0 4 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 2 17 1 0 3 18 1 0 3 19 1 0 4 20 1 0 5 21 1 0 5 22 1 0 6 23 1 0 6 24 1 0 9 25 1 0 12 26 1 0 M END