HMDB0241329 RDKit 3D 5-Hydroxytrideca-8,11-dienoylcarnitine 61 60 0 0 0 0 0 0 0 0999 V2000 7.5193 3.0777 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2437 1.6536 -0.3802 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3209 1.1407 0.8185 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0427 -0.3161 1.0769 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6914 -1.0261 -0.1529 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5657 -1.6602 -0.3974 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4042 -1.8054 0.4965 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1445 -1.1969 -0.1338 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0118 -1.3872 0.8382 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4023 -0.7221 2.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -0.7227 0.3691 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2904 -1.2873 -0.9352 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -0.6824 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -0.9550 -0.5499 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9355 -1.6716 0.4627 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3683 -0.4417 -0.7373 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4689 -0.6621 0.0988 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5223 -1.5548 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9183 -2.9020 -0.8631 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3901 -3.4726 0.1322 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9442 -3.4574 -2.1368 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.0048 0.5168 0.8113 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4712 1.6226 0.0789 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.8295 1.4339 -1.2893 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6836 2.1309 0.7517 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5522 2.7675 0.1105 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3977 3.1972 -1.2819 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6913 3.6548 0.3096 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6638 3.5613 -1.1414 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9744 1.0217 -1.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5844 1.7378 1.6732 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2368 -0.3357 1.8168 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9355 -0.7582 1.5644 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4575 -1.0277 -0.9595 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4688 -2.1436 -1.3924 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1783 -2.8843 0.7111 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 -1.2589 1.4288 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9881 -1.7602 -1.0794 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3214 -0.1372 -0.3837 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8324 -2.4456 1.0469 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3138 -1.3187 2.8043 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0318 -0.7425 1.1566 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0245 0.3500 0.1606 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1484 -2.3978 -0.7804 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1339 -1.2079 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8709 0.4246 -1.5428 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1786 -1.1349 -2.4699 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0648 -1.3366 0.9356 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3033 -1.7747 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9061 -1.1834 -1.4929 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7710 0.1535 1.5332 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1719 0.8895 1.4847 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9287 2.4768 -1.7313 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8333 0.9995 -1.4476 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0137 0.9831 -1.8533 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2512 1.2781 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3063 2.7113 0.0625 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3342 2.7515 1.6099 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5672 3.1807 1.1245 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5625 2.5279 -0.2797 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0298 3.5284 -0.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 3 3 4 1 0 4 5 1 0 5 6 2 3 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 17 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 23 26 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 3 31 1 0 4 32 1 0 4 33 1 0 5 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 8 38 1 0 8 39 1 0 9 40 1 0 10 41 1 0 11 42 1 0 11 43 1 0 12 44 1 0 12 45 1 0 13 46 1 0 13 47 1 0 17 48 1 0 18 49 1 0 18 50 1 0 22 51 1 0 22 52 1 0 24 53 1 0 24 54 1 0 24 55 1 0 25 56 1 0 25 57 1 0 25 58 1 0 26 59 1 0 26 60 1 0 26 61 1 0 M CHG 2 21 -1 23 1 M END