HMDB0240870 RDKit 3D 9-Methylheptadecanoylcarnitine 79 78 0 0 0 0 0 0 0 0999 V2000 10.3493 -1.8333 0.4576 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0177 -1.2009 0.0598 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9069 -2.1536 0.3542 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5253 -1.6153 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3908 -1.2925 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1108 -0.8641 -1.9936 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3874 0.3393 -1.5779 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8782 0.4785 -0.2037 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1304 1.8169 0.0315 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6796 1.7844 1.4397 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1315 1.9888 -1.0477 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2724 3.1825 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2735 3.4724 -0.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9286 2.6394 0.1622 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8468 1.2227 0.5169 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2336 0.5464 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0071 1.2173 1.6924 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3641 0.6642 1.9312 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8218 0.6078 3.1098 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2256 0.1820 0.9768 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4801 -0.3314 1.0922 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4735 0.6093 0.4327 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3937 1.9172 1.1502 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4170 1.9910 2.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2858 3.1230 0.4483 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.7840 -1.7197 0.6968 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5896 -2.1670 -0.6199 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.3207 -1.9519 -1.2293 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7515 -3.6412 -0.5586 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6822 -1.7565 -1.5099 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2538 -2.1662 1.4953 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1455 -1.0722 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5342 -2.6785 -0.2638 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0123 -0.9954 -1.0449 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9409 -0.2559 0.5976 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0421 -3.1332 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8697 -2.3880 1.4382 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7876 -2.3274 0.3892 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4889 -0.6428 0.5875 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2083 -0.5527 -1.7355 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7193 -2.2265 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 -1.7588 -1.9351 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2176 -0.7731 -3.1418 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4976 0.4247 -2.2941 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9991 1.2348 -1.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1799 -0.3389 0.0924 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6507 0.5044 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9324 2.6162 -0.0585 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6101 2.7884 1.8915 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8359 1.1191 1.5802 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 1.2927 2.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6424 1.0119 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7981 2.1648 -1.9983 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0168 4.0734 -0.9991 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 3.3773 -2.0718 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7539 3.7573 0.9663 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1563 4.5161 -0.3178 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6618 2.7897 -0.6992 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5066 3.1602 1.0135 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4723 1.1503 1.5936 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2554 0.5477 -0.0864 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7083 0.7186 -0.3657 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0336 -0.5210 0.8206 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4819 1.2838 2.6506 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 2.2855 1.3579 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7514 -0.2818 2.1938 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2675 0.8131 -0.6119 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5245 0.2628 0.6131 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3209 -2.4440 1.4372 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8903 -1.8576 0.9191 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4972 -1.7736 -2.3321 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6581 -2.8678 -1.2119 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7263 -1.1217 -0.8837 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7634 -4.0157 -0.2211 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5571 -3.8461 0.1572 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0017 -4.0094 -1.5834 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5777 -1.5639 -0.9143 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3718 -0.9420 -2.1957 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9691 -2.5942 -2.2142 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 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 21 26 1 0 26 27 1 0 27 28 1 0 27 29 1 0 27 30 1 0 1 31 1 0 1 32 1 0 1 33 1 0 2 34 1 0 2 35 1 0 3 36 1 0 3 37 1 0 4 38 1 0 4 39 1 0 5 40 1 0 5 41 1 0 6 42 1 0 6 43 1 0 7 44 1 0 7 45 1 0 8 46 1 0 8 47 1 0 9 48 1 0 10 49 1 0 10 50 1 0 10 51 1 0 11 52 1 0 11 53 1 0 12 54 1 0 12 55 1 0 13 56 1 0 13 57 1 0 14 58 1 0 14 59 1 0 15 60 1 0 15 61 1 0 16 62 1 0 16 63 1 0 17 64 1 0 17 65 1 0 21 66 1 0 22 67 1 0 22 68 1 0 26 69 1 0 26 70 1 0 28 71 1 0 28 72 1 0 28 73 1 0 29 74 1 0 29 75 1 0 29 76 1 0 30 77 1 0 30 78 1 0 30 79 1 0 M CHG 2 25 -1 27 1 M END