HMDB0241704 RDKit 3D 4-Hydroxy-6-octenoylcarnitine 48 47 0 0 0 0 0 0 0 0999 V2000 3.9623 0.5158 1.7146 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3114 -0.8793 1.4096 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2463 -1.3295 0.1796 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8196 -0.4306 -0.9076 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5795 -0.9193 -1.6222 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 -2.1662 -2.1572 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1323 -0.0011 -2.7043 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7856 1.3808 -2.2679 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6722 1.4472 -1.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4156 2.5937 -0.8135 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0382 0.3495 -0.9186 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1227 0.5416 0.0612 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5691 -0.2022 1.2525 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3457 -0.2347 2.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0577 -1.1542 2.9247 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3194 0.9268 3.2754 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.3432 0.0001 -0.5522 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6012 0.0764 0.0540 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.6475 0.4621 -0.9543 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8011 0.9629 1.1445 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0245 -1.2623 0.4553 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0787 0.7389 2.8124 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6431 1.2284 1.1701 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8978 0.7606 1.4585 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6236 -1.5365 2.2034 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5068 -2.3559 -0.0269 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5961 0.5839 -0.5245 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6777 -0.3626 -1.6191 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7985 -1.0490 -0.8721 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0167 -2.7727 -1.3646 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -0.5044 -3.2634 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.1096 -3.4192 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 1.8630 -1.8199 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4997 1.9652 -3.1812 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1174 1.5969 0.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2735 -1.2477 0.9743 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4333 0.2727 1.5084 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4384 0.4760 -1.5836 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1048 -1.0801 -0.8365 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6037 0.3058 -0.4133 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5362 1.5328 -1.1806 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 -0.2021 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0009 1.7495 1.2678 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7074 1.6048 0.9141 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0838 0.4867 2.1102 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1144 -1.8924 0.5113 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7166 -1.6963 -0.2878 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4581 -1.2526 1.4803 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 1 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 2 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 12 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 18 21 1 0 1 22 1 0 1 23 1 0 1 24 1 0 2 25 1 0 3 26 1 0 4 27 1 0 4 28 1 0 5 29 1 0 6 30 1 0 7 31 1 0 7 32 1 0 8 33 1 0 8 34 1 0 12 35 1 0 13 36 1 0 13 37 1 0 17 38 1 0 17 39 1 0 19 40 1 0 19 41 1 0 19 42 1 0 20 43 1 0 20 44 1 0 20 45 1 0 21 46 1 0 21 47 1 0 21 48 1 0 M CHG 2 16 -1 18 1 M END