HMDB0240960 RDKit 3D 16-Methyldocosanoylcarnitine 94 93 0 0 0 0 0 0 0 0999 V2000 8.0731 -1.3529 3.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2374 -1.0568 3.0622 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1586 -1.7717 1.7553 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9430 -1.4435 0.9356 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9478 0.0220 0.6321 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7208 0.4158 -0.2088 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7526 1.8579 -0.5074 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7357 2.7077 0.7697 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7626 2.4445 -1.4399 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7206 2.0128 -2.8411 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4381 0.6710 -3.2985 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1863 -0.0398 -3.0256 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7506 -0.3707 -1.6744 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4298 -1.1242 -1.6597 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3629 -0.3033 -2.2791 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0058 -1.0037 -2.2499 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4616 -1.2928 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7923 -2.0001 -0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8667 -1.2154 -1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 0.0831 -0.9229 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2008 0.9007 -1.5917 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5108 0.1705 -1.6155 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9469 -0.0982 -0.2281 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4521 -1.0452 0.4043 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9015 0.6689 0.4188 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3733 0.4971 1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9732 1.6783 2.6084 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4974 1.4595 3.9889 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9202 0.6483 4.7695 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6274 2.1794 4.3591 O 0 0 0 0 0 1 0 0 0 0 0 0 -8.8531 0.3455 1.8547 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4369 -0.7639 1.1775 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.6379 -1.9588 1.2075 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7193 -0.3964 -0.1897 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7085 -1.0885 1.8451 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9807 -0.5409 4.7253 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2262 -2.3224 4.5358 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1169 -1.4381 3.4506 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1565 -1.4593 3.5806 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4163 0.0301 2.9447 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0458 -1.4137 1.1538 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3194 -2.8632 1.8611 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0795 -1.9782 -0.0487 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0106 -1.8119 1.3623 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8290 0.2915 0.0176 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9398 0.6644 1.5142 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7979 0.0990 0.3436 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7888 -0.1973 -1.1027 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8071 2.0783 -0.9232 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9144 2.3684 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7248 2.6651 1.2369 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5189 3.7452 0.4427 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9668 3.5990 -1.5043 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7643 2.3831 -0.9137 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8001 2.2424 -3.2301 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 2.8079 -3.4844 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3633 0.0188 -3.2328 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4347 0.7819 -4.4862 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3474 0.4939 -3.5914 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2372 -1.0169 -3.6074 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6386 0.4153 -0.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4828 -1.1060 -1.1763 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2215 -1.4055 -0.6065 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6297 -2.0782 -2.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5762 -0.1540 -3.3638 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2655 0.6452 -1.7554 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6854 -0.3012 -2.7589 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0429 -1.9252 -2.8646 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -1.8966 -0.2784 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5204 -0.3310 -0.3015 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6834 -2.9553 -1.4989 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1327 -2.3390 0.0918 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5615 -1.0537 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7794 -1.8816 -1.5868 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3775 -0.1202 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1676 0.6960 -0.8452 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3664 1.8452 -0.9935 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8895 1.2563 -2.5964 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3728 -0.8003 -2.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2917 0.7302 -2.1844 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8303 -0.3912 2.1537 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2982 2.6258 2.1815 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8649 1.6748 2.6333 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3210 1.2983 1.5521 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0547 0.2542 2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9863 -2.0871 0.3191 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3457 -2.8290 1.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0932 -2.0712 2.1633 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3719 -1.1782 -0.6323 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7902 -0.2410 -0.7399 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2613 0.5925 -0.1475 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1526 -2.0187 1.4476 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4967 -1.2275 2.9233 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4295 -0.2423 1.7548 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 7 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 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 28 30 1 0 26 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 32 35 1 0 1 36 1 0 1 37 1 0 1 38 1 0 2 39 1 0 2 40 1 0 3 41 1 0 3 42 1 0 4 43 1 0 4 44 1 0 5 45 1 0 5 46 1 0 6 47 1 0 6 48 1 0 7 49 1 0 8 50 1 0 8 51 1 0 8 52 1 0 9 53 1 0 9 54 1 0 10 55 1 0 10 56 1 0 11 57 1 0 11 58 1 0 12 59 1 0 12 60 1 0 13 61 1 0 13 62 1 0 14 63 1 0 14 64 1 0 15 65 1 0 15 66 1 0 16 67 1 0 16 68 1 0 17 69 1 0 17 70 1 0 18 71 1 0 18 72 1 0 19 73 1 0 19 74 1 0 20 75 1 0 20 76 1 0 21 77 1 0 21 78 1 0 22 79 1 0 22 80 1 0 26 81 1 0 27 82 1 0 27 83 1 0 31 84 1 0 31 85 1 0 33 86 1 0 33 87 1 0 33 88 1 0 34 89 1 0 34 90 1 0 34 91 1 0 35 92 1 0 35 93 1 0 35 94 1 0 M CHG 2 30 -1 32 1 M END