HMDB0061635 RDKit 3D 3-hydroxynonanoyl carnitine 53 52 0 0 0 0 0 0 0 0999 V2000 7.3632 -1.1171 -0.9057 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3697 -0.0914 -0.3686 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9802 -0.6056 -0.7323 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9639 0.4071 -0.2032 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5954 -0.0827 -0.5521 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 0.8578 -0.0668 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5235 1.0394 1.4102 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3281 -0.1671 2.0948 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4929 2.0463 1.8206 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8984 1.6920 1.4755 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8104 2.5335 1.7616 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3176 0.5448 0.8762 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6666 0.2101 0.5548 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0653 -1.0585 1.2322 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9963 -1.0479 2.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2861 -2.0698 3.3751 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6119 0.0847 3.3841 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.8192 0.1280 -0.9517 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1018 -0.2052 -1.4381 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.1762 -1.6379 -1.7084 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2388 0.1663 -0.6818 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 0.4157 -2.7758 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4859 -1.0048 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9793 -2.1113 -0.6621 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3354 -0.9207 -0.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4846 -0.0192 0.7229 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4994 0.8841 -0.8986 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9347 -0.6719 -1.8279 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7918 -1.6013 -0.3165 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1088 0.4994 0.8824 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 1.3780 -0.6908 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4977 -0.1360 -1.6692 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -1.1219 -0.1841 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5466 0.5065 -0.4454 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7461 1.8477 -0.5545 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5177 1.4146 1.7542 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8763 -0.8467 1.5729 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5616 2.2319 2.9165 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7424 3.0296 1.3555 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 1.0540 0.9631 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0652 -1.4264 0.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3702 -1.8944 0.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0961 -0.6659 -1.3004 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 1.1274 -1.3641 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0247 -2.1175 -1.1717 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2515 -1.8788 -2.7858 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2472 -2.1160 -1.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0756 0.7695 0.2178 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9054 0.8110 -1.3288 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8924 -0.7266 -0.4766 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2019 1.5239 -2.6984 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2221 0.0778 -3.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4053 0.0616 -3.3838 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 1 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 7 36 1 0 8 37 1 0 9 38 1 0 9 39 1 0 13 40 1 0 14 41 1 0 14 42 1 0 18 43 1 0 18 44 1 0 20 45 1 0 20 46 1 0 20 47 1 0 21 48 1 0 21 49 1 0 21 50 1 0 22 51 1 0 22 52 1 0 22 53 1 0 M CHG 2 17 -1 19 1 M END