HMDB0241789 RDKit 3D 4-Oxononanoylcarnitine 51 50 0 0 0 0 0 0 0 0999 V2000 7.5101 0.1123 -1.3595 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2529 -0.8489 -0.2235 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8309 -0.7165 0.3038 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6323 0.6952 0.7904 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2498 0.9265 1.3391 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1723 0.7116 0.3661 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 0.3930 -0.7734 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7639 0.8767 0.7495 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8318 0.5378 -0.3978 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5856 0.7195 -0.0326 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0143 1.8156 0.4303 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5551 -0.2773 -0.1609 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9186 -0.0693 0.1931 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1745 -0.8737 1.4608 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -2.3165 1.3013 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5437 -2.8504 0.2413 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1818 -3.1354 2.3910 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.8486 -0.3406 -0.9182 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2488 -0.1330 -0.6811 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.5274 1.1648 -0.0927 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9373 -1.2164 -0.0452 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8349 -0.0377 -2.0446 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7435 1.1141 -0.9275 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5985 0.1985 -1.9938 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3438 -0.2512 -1.9966 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9629 -0.7119 0.5926 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3478 -1.8815 -0.6473 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7488 -1.3653 1.1997 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1435 -1.0587 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8948 1.4429 0.0126 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3672 0.8311 1.6332 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 0.2833 2.2476 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2024 2.0027 1.6661 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5595 0.1773 1.6178 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5043 1.8807 1.1386 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1391 1.1615 -1.2631 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9911 -0.5296 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9978 0.9902 0.5078 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3676 -0.5381 2.1996 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -0.6037 1.9788 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5918 0.2549 -1.8475 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7592 -1.4423 -1.1609 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1279 1.9208 -0.8142 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6257 1.2695 0.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0338 1.2725 0.8803 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2046 -1.0453 1.0182 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9423 -1.3153 -0.5517 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3789 -2.1494 -0.2314 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9025 0.2024 -1.9534 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7583 -1.0832 -2.4333 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 0.6855 -2.6223 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 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 13 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 19 22 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 4 30 1 0 4 31 1 0 5 32 1 0 5 33 1 0 8 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 13 38 1 0 14 39 1 0 14 40 1 0 18 41 1 0 18 42 1 0 20 43 1 0 20 44 1 0 20 45 1 0 21 46 1 0 21 47 1 0 21 48 1 0 22 49 1 0 22 50 1 0 22 51 1 0 M CHG 2 17 -1 19 1 M END