HMDB0240863 RDKit 3D 7-MethylHexadecanoylcarnitine 76 75 0 0 0 0 0 0 0 0999 V2000 10.0243 1.9890 0.3988 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0522 0.5046 0.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6520 -0.0771 0.1995 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7491 0.6214 -0.7656 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3459 0.0450 -0.6897 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7858 0.2106 0.6755 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3746 -0.3891 0.7543 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5031 0.3172 -0.2009 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0431 -0.1744 -0.2111 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -1.6160 -0.6096 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6016 -1.8195 -1.9944 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7563 -2.3347 -0.3814 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4996 -1.9337 -1.0105 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0894 -0.6076 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3847 -0.4953 0.7802 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 0.8453 1.1158 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2355 1.0139 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2564 1.8273 -0.6431 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 0.2972 0.6056 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5943 0.4992 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 -0.8534 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9093 -1.9750 0.0279 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0458 -2.2068 0.5037 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8873 -2.8168 0.4464 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.6732 0.7899 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9692 1.0869 0.3223 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.3590 0.8200 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9324 0.3886 1.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2644 2.5164 0.5842 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0287 2.3183 0.7308 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7968 2.5921 -0.5053 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2849 2.2561 1.1758 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6958 -0.0619 0.7808 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4073 0.3388 -0.9576 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6939 -1.1523 -0.0726 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3313 0.0516 1.2416 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7072 1.7190 -0.6053 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0931 0.4082 -1.8093 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7542 0.5293 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 -1.0568 -0.9232 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 1.2843 0.9463 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3659 -0.3436 1.4293 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0013 -0.2392 1.7879 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5146 -1.4722 0.5811 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4499 1.3954 0.1097 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8248 0.2802 -1.2616 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6522 -0.0601 0.8051 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5696 0.4924 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7748 -2.1281 0.0691 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3816 -0.8853 -2.5685 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2013 -2.6971 -2.5113 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7058 -1.9207 -1.9823 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -2.3362 0.7428 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8919 -3.4389 -0.5874 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2805 -2.6871 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5273 -2.1405 -2.1316 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1492 -0.6576 -1.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6692 0.2721 -1.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1883 -1.2557 1.0091 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5387 -0.7624 1.4182 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 1.6693 0.9258 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2165 0.8035 2.2201 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3192 1.2871 -0.9212 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4514 -0.8357 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7434 -1.0837 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7083 -0.0889 1.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3421 1.6269 1.4588 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2955 1.4267 -1.2711 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6417 -0.2029 -1.2376 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6287 1.1733 -1.7666 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2264 -0.5879 0.7652 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4127 0.2012 2.1596 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8425 1.0017 1.3645 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0733 2.7036 1.6668 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6250 3.1317 -0.0649 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3330 2.6590 0.4101 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 10 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 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 11 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 14 57 1 0 14 58 1 0 15 59 1 0 15 60 1 0 16 61 1 0 16 62 1 0 20 63 1 0 21 64 1 0 21 65 1 0 25 66 1 0 25 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 29 74 1 0 29 75 1 0 29 76 1 0 M CHG 2 24 -1 26 1 M END