HMDB0241755 RDKit 3D 6-Hydroxynon-6-enoylcarnitine 51 50 0 0 0 0 0 0 0 0999 V2000 -8.1203 -0.0159 0.2348 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4969 -1.3007 -0.2367 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0868 -1.4118 0.1728 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4002 -0.5385 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9283 0.6688 1.3151 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9684 -0.7772 1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 0.2976 0.6276 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6536 0.0375 0.9862 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 1.1160 0.3997 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6447 0.8380 0.7608 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0904 1.0809 1.9195 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5281 0.3089 -0.1552 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8994 0.0429 0.1897 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0931 -1.4520 0.1441 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8172 -2.0234 -1.1819 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4536 -1.2968 -2.1337 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9531 -3.3812 -1.4102 O 0 0 0 0 0 1 0 0 0 0 0 0 3.8053 0.8296 -0.6803 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2064 0.6931 -0.4769 N 0 0 0 0 0 4 0 0 0 0 0 0 5.7954 1.9659 -0.9585 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7309 -0.3173 -1.3789 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6505 0.5298 0.8662 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6085 0.8197 -0.2812 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1748 0.0868 1.3297 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2036 -0.0626 -0.0916 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0484 -2.2045 0.1369 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5358 -1.2685 -1.3616 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5599 -2.3313 -0.1344 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3807 1.5025 1.1766 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6617 -1.7328 0.7386 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9036 -0.8249 2.3168 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3533 1.2932 1.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2672 0.3581 -0.4469 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5071 0.0421 2.0843 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3165 -0.9354 0.5804 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0866 2.1011 0.8551 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 1.1631 -0.6955 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0082 0.3413 1.2445 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0655 -1.7757 0.5417 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3455 -1.8569 0.9003 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5365 1.9161 -0.5089 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6087 0.6921 -1.7721 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4884 2.0759 -2.0052 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8723 1.9727 -0.7816 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2682 2.7587 -0.3869 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0506 -0.3508 -2.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7219 0.0241 -1.7613 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8622 -1.3048 -0.9426 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9179 0.9596 1.5541 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5878 1.1449 1.0111 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9787 -0.4979 1.1251 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 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 13 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 19 22 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 3 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 8 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 13 38 1 0 14 39 1 0 14 40 1 0 18 41 1 0 18 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 22 49 1 0 22 50 1 0 22 51 1 0 M CHG 2 17 -1 19 1 M END