HMDB0060683 RDKit 3D 2-n-Propyl-4-oxopentanoic acid 25 24 0 0 0 0 0 0 0 0999 V2000 -2.6540 -0.8964 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9648 0.3322 -1.2043 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2952 1.1503 -0.1471 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2337 0.4124 0.6371 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8409 -0.0503 -0.3093 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9368 -0.8013 0.3029 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0856 -1.2387 -0.5588 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9979 -1.1083 1.4767 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3095 1.3660 1.6252 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1128 2.5449 1.6127 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2598 1.0774 2.5834 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9876 -1.4864 -1.5453 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9397 -1.5202 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5673 -0.6576 -0.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7993 0.9230 -1.6984 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 0.0335 -2.0074 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7477 1.9753 -0.6863 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0208 1.6327 0.5368 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7392 -0.4393 1.1441 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2929 0.8593 -0.8022 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -0.6218 -1.1792 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9816 -0.8300 -1.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0486 -0.9170 -0.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -2.3355 -0.6569 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0774 0.5957 3.4457 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 6 8 2 0 4 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 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 5 20 1 0 5 21 1 0 7 22 1 0 7 23 1 0 7 24 1 0 11 25 1 0 M END