HMDB0241352 RDKit 3D 3,8-Dihydroxytetradecanoylcarnitine 69 68 0 0 0 0 0 0 0 0999 V2000 9.8749 1.1391 0.1193 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7497 1.5938 -0.7813 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4354 1.3845 -0.0433 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2344 -0.0658 0.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9422 -0.2269 1.0449 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7343 0.2001 0.2669 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5289 -0.0628 1.1984 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5659 -1.4163 1.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3235 0.4246 0.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0776 0.2644 1.2502 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7512 -1.1416 1.5914 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5878 -2.0396 0.4024 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -1.6078 -0.5385 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5264 -2.5425 -1.5711 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8635 -1.5353 0.1387 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8689 -1.1081 -0.8664 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4878 -0.8854 -2.0401 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2077 -0.9445 -0.5673 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1831 -0.5470 -1.4766 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1149 -1.6429 -1.9291 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8717 -2.3280 -0.8966 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8214 -2.2043 0.3304 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8129 -3.2851 -1.3587 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.7546 0.7993 -1.3244 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4054 1.1914 -0.1369 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.4520 2.6849 -0.2164 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7977 0.8120 -0.0385 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6924 0.9435 1.0843 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8213 1.6182 -0.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6843 1.3586 1.1759 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0143 0.0417 -0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8384 2.6749 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7095 0.9987 -1.7173 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4172 1.9699 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5828 1.7027 -0.6856 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0444 -0.4578 0.9617 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2450 -0.6919 -0.6096 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7658 -1.2713 1.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9248 0.3781 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7801 1.2864 0.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6007 -0.3443 -0.6827 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6595 0.4839 2.1376 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -1.6420 2.3566 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 1.4974 0.1456 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2116 -0.1264 -0.5101 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1776 0.8140 2.2394 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2333 0.8029 0.7525 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2093 -1.1975 2.1827 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5065 -1.5659 2.2624 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3182 -3.0483 0.7843 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5014 -2.0970 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3004 -0.6202 -0.9821 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5213 -2.0797 -2.4343 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8014 -0.8195 0.9872 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1536 -2.5396 0.5563 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5419 -0.4172 -2.4661 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7729 -1.2468 -2.7309 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5082 -2.4405 -2.4595 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4658 0.9696 -2.1703 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9227 1.5438 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4778 3.0754 0.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2670 3.0407 0.4504 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7307 2.9401 -1.2439 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9973 0.2057 0.8932 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1526 0.2637 -0.9559 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4980 1.6678 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6110 1.1545 0.9322 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0253 1.7328 1.8236 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8900 -0.0020 1.5813 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 13 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 4 37 1 0 5 38 1 0 5 39 1 0 6 40 1 0 6 41 1 0 7 42 1 0 8 43 1 0 9 44 1 0 9 45 1 0 10 46 1 0 10 47 1 0 11 48 1 0 11 49 1 0 12 50 1 0 12 51 1 0 13 52 1 0 14 53 1 0 15 54 1 0 15 55 1 0 19 56 1 0 20 57 1 0 20 58 1 0 24 59 1 0 24 60 1 0 26 61 1 0 26 62 1 0 26 63 1 0 27 64 1 0 27 65 1 0 27 66 1 0 28 67 1 0 28 68 1 0 28 69 1 0 M CHG 2 23 -1 25 1 M END