HMDB0240843 RDKit 3D 12-Methylpentadecanoylcarnitine 73 72 0 0 0 0 0 0 0 0999 V2000 10.0919 0.6855 -0.9475 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6795 0.5470 -0.3653 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5882 -0.6736 0.5004 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2263 -0.8557 1.1049 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8967 0.3517 1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1453 -1.0309 0.0271 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8041 -1.2139 0.6678 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6577 -1.3967 -0.2563 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4402 -0.2365 -1.1815 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1843 1.0462 -0.5009 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0813 1.2277 0.4343 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 1.0791 -0.0167 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2235 -0.2447 -0.5004 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -0.1619 -0.9253 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1964 0.2183 0.1449 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5524 0.2478 -0.4601 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6759 0.0151 -1.6821 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6382 0.5269 0.3187 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9998 0.5661 -0.2838 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4191 1.9649 0.0701 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7102 2.4389 -0.3664 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7262 2.5758 0.3614 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8770 2.7884 -1.7315 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.7011 -0.5125 0.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0275 -0.8652 0.1064 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.9312 -0.4712 1.1676 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1717 -2.3454 0.0517 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5229 -0.3759 -1.1409 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3432 -0.1993 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8182 0.8256 -0.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1426 1.5648 -1.6165 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9995 0.4634 -1.2562 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4297 1.4768 0.1558 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8703 -1.6004 -0.0277 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2932 -0.5283 1.3503 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1991 -1.7388 1.7523 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3015 1.0901 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8241 0.8205 2.3665 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2851 0.0795 2.8406 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1860 -0.1893 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4288 -1.9496 -0.5477 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -2.1044 1.3455 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 -0.3115 1.3131 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8132 -2.3001 -0.8829 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7544 -1.5919 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7903 -0.4609 -2.0163 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4830 -0.0978 -1.6768 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 1.4256 -0.0617 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0325 1.8109 -1.3478 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2455 2.2624 0.9194 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2123 0.5678 1.3638 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0405 1.3863 0.7968 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4994 1.8464 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7693 -0.6723 -1.3582 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2854 -1.0057 0.3376 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5277 -1.1899 -1.2766 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3295 0.5753 -1.7544 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1805 -0.5681 0.9566 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9457 1.2149 0.5781 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 0.3696 -1.3362 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3865 1.9873 1.2135 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5712 2.6611 -0.2358 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 -1.4790 0.4271 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6933 -0.2801 1.5697 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4138 0.2907 1.8003 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8038 0.0266 0.7057 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2488 -1.3412 1.7708 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2665 -2.5225 0.0413 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7685 -2.8113 0.9623 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7548 -2.7516 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9634 -1.2578 -1.7057 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4269 0.2892 -1.0189 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7707 0.0220 -1.8367 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 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 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 19 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 25 28 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 4 36 1 0 5 37 1 0 5 38 1 0 5 39 1 0 6 40 1 0 6 41 1 0 7 42 1 0 7 43 1 0 8 44 1 0 8 45 1 0 9 46 1 0 9 47 1 0 10 48 1 0 10 49 1 0 11 50 1 0 11 51 1 0 12 52 1 0 12 53 1 0 13 54 1 0 13 55 1 0 14 56 1 0 14 57 1 0 15 58 1 0 15 59 1 0 19 60 1 0 20 61 1 0 20 62 1 0 24 63 1 0 24 64 1 0 26 65 1 0 26 66 1 0 26 67 1 0 27 68 1 0 27 69 1 0 27 70 1 0 28 71 1 0 28 72 1 0 28 73 1 0 M CHG 2 23 -1 25 1 M END