HMDB0241866 RDKit 3D (8S)-8-Amino-7-oxononanoylcarnitine 53 52 0 0 0 0 0 0 0 0999 V2000 6.8101 -1.1902 -1.2669 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8123 -0.5832 0.1175 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5047 -1.4776 1.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4047 -0.3733 0.6154 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0745 -0.9434 1.6257 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5171 0.5117 -0.1564 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 0.5790 0.3946 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4405 -0.7398 0.3738 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0316 -0.6801 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1507 0.2547 0.1814 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2285 0.3062 0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5362 -0.3806 1.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2244 1.0936 0.2019 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 1.1843 0.6789 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8522 2.5705 1.2243 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7045 3.6085 0.1809 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3548 3.3242 -0.9939 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9502 4.9374 0.4745 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.5978 0.7798 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5216 -0.5872 -0.7101 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.4030 -1.5467 0.3321 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7304 -0.8782 -1.4821 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4111 -0.7152 -1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6761 -0.3918 -2.0347 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0447 -1.9783 -1.3328 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8454 -1.5842 -1.4328 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 0.3988 0.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4246 -2.4800 0.7225 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1946 -1.3916 2.0014 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 1.5469 -0.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5328 0.2739 -1.2488 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5738 1.2988 -0.2729 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1588 1.0520 1.3979 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -0.9894 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -1.5247 0.8606 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1555 -0.3072 1.9968 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6514 -1.7119 0.9834 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1262 -0.0348 -0.8687 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6232 1.2796 0.2113 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5915 0.5007 1.5759 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8541 2.5706 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 2.7311 2.0642 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5737 0.8820 0.2889 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 1.4163 -1.1476 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 -2.4344 0.0763 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -1.9088 0.3636 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7618 -1.1856 1.3158 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6695 -1.9010 -1.9104 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6243 -0.7455 -0.8369 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8322 -0.1471 -2.3106 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6205 -1.3525 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7129 -1.2283 -2.5874 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0345 0.2920 -1.9302 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 14 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 20 23 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 8 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 10 38 1 0 10 39 1 0 14 40 1 0 15 41 1 0 15 42 1 0 19 43 1 0 19 44 1 0 21 45 1 0 21 46 1 0 21 47 1 0 22 48 1 0 22 49 1 0 22 50 1 0 23 51 1 0 23 52 1 0 23 53 1 0 M CHG 2 18 -1 20 1 M END