HMDB0000736 RDKit 3D Isobutyryl-L-carnitine 38 37 0 0 0 0 0 0 0 0999 V2000 4.4576 -0.2732 -1.3397 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4623 0.0178 -0.2153 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6326 -0.9105 0.9413 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0758 0.0564 -0.7372 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8572 -0.1373 -1.9562 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0546 0.3071 0.1434 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3292 0.3730 -0.2541 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8062 1.7437 0.1493 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0885 2.8507 -0.4762 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8401 2.6544 -1.2802 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 4.1521 -0.1717 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0427 -0.7107 0.4979 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4224 -0.8808 0.2688 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.0086 -0.2429 -0.8569 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7336 -2.3145 0.2178 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1468 -0.3870 1.4555 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9902 -0.1163 -2.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7808 -1.3430 -1.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 0.3363 -1.1979 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 1.0509 0.1439 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6936 -1.2085 0.9903 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3485 -0.3604 1.8794 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0304 -1.8282 0.8265 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3241 0.2406 -1.3296 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8936 1.8719 -0.0528 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7183 1.8371 1.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0241 4.6406 0.5857 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -0.5203 1.5877 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5136 -1.6838 0.2727 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 0.5221 -0.5875 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 0.1346 -1.6273 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6178 -1.0178 -1.4177 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7549 -2.4688 0.5888 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6161 -2.6988 -0.8202 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -2.8259 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6325 0.5327 1.7875 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2061 -0.2015 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0398 -1.1915 2.2271 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 2 0 9 11 1 0 7 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 13 16 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 0 3 21 1 0 3 22 1 0 3 23 1 0 7 24 1 6 8 25 1 0 8 26 1 0 11 27 1 0 12 28 1 0 12 29 1 0 14 30 1 0 14 31 1 0 14 32 1 0 15 33 1 0 15 34 1 0 15 35 1 0 16 36 1 0 16 37 1 0 16 38 1 0 M CHG 1 13 1 M END