HMDB0241511 RDKit 3D 3-Oxohexadecanoylcarnitine 72 71 0 0 0 0 0 0 0 0999 V2000 8.1880 2.4183 1.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9645 1.7005 0.6716 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 2.0305 1.5479 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 1.4380 1.2089 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7876 1.6920 -0.0232 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3223 1.3876 -1.3515 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7018 -0.0629 -1.5616 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4187 -0.9000 -1.3529 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7859 -2.3276 -1.5728 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -3.3561 -1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5654 -3.4095 -2.2687 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6163 -2.2700 -2.3254 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0275 -1.8800 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8976 -0.7350 -1.1746 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5255 0.4177 -1.2828 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3547 -1.0051 -1.2353 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9974 -0.7161 0.0915 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -0.3071 1.0609 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3575 -0.8888 0.2922 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0437 -0.6478 1.4851 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5445 -1.9754 2.0067 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4392 -2.6007 1.0078 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7187 -2.1253 -0.1136 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0496 -3.8341 1.2999 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.1737 0.3113 1.4127 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8294 1.6402 0.9868 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.1359 2.3791 2.0416 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1063 2.3539 0.8031 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1179 1.7284 -0.2464 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2800 2.1220 2.2792 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0911 2.1446 0.6746 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0463 3.5059 1.1482 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1676 0.6001 0.8447 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8532 1.8170 -0.3893 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0938 1.5932 2.5596 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7527 3.1248 1.7954 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6137 0.3092 1.3897 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7881 1.6964 2.0696 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7757 1.1754 0.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 2.7889 -0.0616 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0923 2.0148 -1.7854 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4594 1.5135 -2.1245 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5036 -0.3909 -0.8974 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9935 -0.1597 -2.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6553 -0.4892 -1.9953 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0701 -0.7745 -0.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6812 -2.5922 -0.9094 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2267 -2.4073 -2.6254 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2287 -4.4022 -1.4716 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3827 -3.3464 -0.3125 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0183 -4.3898 -2.0969 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9138 -3.5572 -3.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9693 -1.4461 -2.9285 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2722 -2.6845 -2.9489 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5307 -2.7458 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8379 -1.6441 -0.2588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8378 -0.3035 -1.9547 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5406 -2.0594 -1.5032 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2838 -0.2934 2.2291 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6845 -2.6919 2.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0697 -1.8662 2.9802 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5550 0.4271 2.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0164 -0.0483 0.8293 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1155 2.0139 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1491 3.4395 1.7461 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7781 2.2988 2.9627 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9379 3.4476 0.8326 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4773 2.0204 -0.1902 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7711 2.0121 1.6079 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0451 1.9796 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4665 2.6400 -0.8175 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 0.8921 -0.9364 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 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 20 25 1 0 25 26 1 0 26 27 1 0 26 28 1 0 26 29 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 3 35 1 0 3 36 1 0 4 37 1 0 4 38 1 0 5 39 1 0 5 40 1 0 6 41 1 0 6 42 1 0 7 43 1 0 7 44 1 0 8 45 1 0 8 46 1 0 9 47 1 0 9 48 1 0 10 49 1 0 10 50 1 0 11 51 1 0 11 52 1 0 12 53 1 0 12 54 1 0 13 55 1 0 13 56 1 0 16 57 1 0 16 58 1 0 20 59 1 0 21 60 1 0 21 61 1 0 25 62 1 0 25 63 1 0 27 64 1 0 27 65 1 0 27 66 1 0 28 67 1 0 28 68 1 0 28 69 1 0 29 70 1 0 29 71 1 0 29 72 1 0 M CHG 2 24 -1 26 1 M END