HMDB0241693 RDKit 3D 3-Oxoheptanoylcarnitine 45 44 0 0 0 0 0 0 0 0999 V2000 6.1091 0.8462 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2252 0.1202 -0.4901 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0935 -0.5785 0.2748 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2195 -1.3029 -0.7333 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6032 -0.4424 -1.7315 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -0.1390 -2.7194 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2616 0.0944 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5094 -0.0912 -0.4595 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9955 -0.6356 0.5404 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8115 0.3575 -0.3763 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 0.2565 0.7412 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1736 1.5770 1.1323 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0913 2.5143 1.4623 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3406 3.7220 1.8144 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2282 2.1348 1.4071 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.7214 -0.7905 0.5468 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6055 -0.5785 -0.5353 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.2575 -1.8778 -0.7969 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6853 0.3434 -0.2396 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9618 -0.2252 -1.7794 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5331 1.4212 1.2485 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8177 0.1206 0.9697 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7216 1.5635 -0.0637 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8197 -0.6851 -0.9619 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7845 0.8357 -1.1905 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5729 -1.3608 0.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5643 0.1295 0.9049 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5688 -1.9940 -0.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9652 -2.0068 -1.2656 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3407 1.2177 -1.8546 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6702 -0.2540 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0292 -0.1521 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7624 2.0758 0.3245 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8023 1.5173 2.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3138 -0.8179 1.4891 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2231 -1.7655 0.4415 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4193 -2.3928 0.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5019 -2.4606 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1678 -1.7608 -1.3845 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6531 0.6082 0.8355 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6907 -0.0975 -0.4458 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 1.2425 -0.9062 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0549 -0.7882 -1.9833 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6351 -0.3714 -2.6543 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 0.8709 -1.7519 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 2 0 5 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 11 16 1 0 16 17 1 0 17 18 1 0 17 19 1 0 17 20 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 2 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 4 29 1 0 7 30 1 0 7 31 1 0 11 32 1 0 12 33 1 0 12 34 1 0 16 35 1 0 16 36 1 0 18 37 1 0 18 38 1 0 18 39 1 0 19 40 1 0 19 41 1 0 19 42 1 0 20 43 1 0 20 44 1 0 20 45 1 0 M CHG 2 15 -1 17 1 M END