HMDB0241787 RDKit 3D 3-Oxononanoylcarnitine 51 50 0 0 0 0 0 0 0 0999 V2000 6.8352 0.7518 -0.1085 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9222 -0.1312 0.7193 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7126 -1.4375 -0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8036 -2.3871 0.7153 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4739 -1.7012 0.9049 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8422 -1.2787 -0.3777 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5313 -0.6220 -0.0519 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -1.1404 0.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2434 0.7428 -0.6314 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 1.1356 -0.2386 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2407 1.7696 0.8657 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2383 0.8326 -1.0065 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5571 1.2753 -0.5076 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1246 1.9838 -1.6781 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4502 2.5734 -1.5039 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5137 2.0747 -1.9321 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5587 3.7956 -0.8016 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.1748 -0.0154 -0.0965 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 -0.0528 0.5022 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.9497 1.1187 1.1225 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4351 -0.6598 -0.4057 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3505 -1.0747 1.5929 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5376 1.8228 -0.0448 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8961 0.6097 0.1414 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7096 0.4388 -1.1752 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3311 -0.3269 1.7148 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9382 0.4146 0.7513 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3567 -1.2814 -1.0413 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 -1.9585 -0.0495 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6813 -3.3091 0.1492 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2401 -2.5205 1.7298 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5735 -0.8446 1.5768 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7611 -2.4524 1.3653 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4361 -0.6664 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5754 -2.2157 -0.9471 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9622 1.4916 -0.2253 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2773 0.7106 -1.7336 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3733 1.8582 0.3936 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4601 2.8415 -2.0164 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0941 1.2908 -2.5747 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1814 -0.7680 -0.9425 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4127 -0.4761 0.6271 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1985 1.8935 1.2085 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9225 1.4610 0.7088 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2160 0.8625 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5604 -1.7378 -0.2088 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9748 -0.5995 -1.4357 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4178 -0.1563 -0.3399 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8834 -1.9760 1.1727 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8003 -0.6227 2.4356 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3872 -1.3365 1.8873 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 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 6 34 1 0 6 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