HMDB0241889 RDKit 3D 8-{3-[(2Z,5Z)-Octa-2,5-dien-1-yl]oxiran-2-yl}octanoylcarnitine 74 74 0 0 0 0 0 0 0 0999 V2000 9.6375 0.5879 2.8959 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8533 1.2303 1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5874 1.0830 0.4883 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1832 0.4728 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 -0.1999 -0.6883 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0494 0.3950 -1.7682 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8862 0.9570 -1.5554 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1853 1.0997 -0.2647 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8418 0.3502 -0.3708 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9745 0.7590 -1.3436 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6587 -0.4375 -1.6274 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8925 -1.7006 -1.5991 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -1.6631 -1.2329 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1406 -1.1104 0.1147 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -1.2214 0.4027 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1462 -0.4506 -0.5907 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6338 -0.5430 -0.2946 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1402 -1.9628 -0.3381 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5859 -1.9777 -0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 -3.0617 -0.0665 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2804 -0.8278 0.2565 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6412 -0.7853 0.5399 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8141 -0.4340 2.0045 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1413 -1.4872 2.8057 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -1.4431 2.9014 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8032 -2.5167 3.4557 O 0 0 0 0 0 1 0 0 0 0 0 0 -7.4695 0.0409 -0.3724 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1325 1.4242 -0.4414 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.7085 1.6785 -0.5514 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6370 2.2170 0.6329 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7156 1.9396 -1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9067 0.2280 3.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3516 1.3358 3.3127 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2468 -0.2591 2.5239 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8348 2.3452 1.9706 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8208 0.9095 1.7697 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5922 1.5458 0.4563 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8070 0.4098 -1.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0840 -1.2612 -1.0317 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3665 -0.2724 0.2705 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4856 0.3405 -2.7736 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3838 1.3892 -2.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9389 2.2069 -0.1668 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7485 0.7510 0.5967 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5447 -0.0927 0.5931 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3727 -0.2957 -2.4735 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3645 -2.4575 -0.8789 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0188 -2.1964 -2.6054 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1099 -2.7505 -1.2465 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8518 -1.1550 -2.0354 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -1.5843 0.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3877 0.0057 0.1088 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6273 -2.3102 0.3088 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5675 -0.8656 1.4157 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0368 -0.8275 -1.6352 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8754 0.6219 -0.5058 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7683 -0.1994 0.7703 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2374 0.1084 -0.9254 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 -2.5636 0.4447 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9345 -2.3422 -1.3651 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0196 -1.8475 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8782 -0.4358 2.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2901 0.5157 2.2389 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5274 -0.0336 -0.0312 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4478 -0.4092 -1.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3068 1.1971 -1.4547 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6232 2.7892 -0.7463 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1524 1.5003 0.3696 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1707 3.1054 0.2414 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3822 1.6682 1.2588 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 2.6458 1.2742 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8019 3.0470 -1.6523 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7066 1.4527 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0135 1.6281 -2.4957 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 3 4 5 1 0 5 6 1 0 6 7 2 3 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 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 22 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 28 31 1 0 11 9 1 0 1 32 1 0 1 33 1 0 1 34 1 0 2 35 1 0 2 36 1 0 3 37 1 0 4 38 1 0 5 39 1 0 5 40 1 0 6 41 1 0 7 42 1 0 8 43 1 0 8 44 1 0 9 45 1 0 11 46 1 0 12 47 1 0 12 48 1 0 13 49 1 0 13 50 1 0 14 51 1 0 14 52 1 0 15 53 1 0 15 54 1 0 16 55 1 0 16 56 1 0 17 57 1 0 17 58 1 0 18 59 1 0 18 60 1 0 22 61 1 0 23 62 1 0 23 63 1 0 27 64 1 0 27 65 1 0 29 66 1 0 29 67 1 0 29 68 1 0 30 69 1 0 30 70 1 0 30 71 1 0 31 72 1 0 31 73 1 0 31 74 1 0 M CHG 2 26 -1 28 1 M END