HMDB0241771 RDKit 3D 3-Hydroxynona-4,6-dienoylcarnitine 49 48 0 0 0 0 0 0 0 0999 V2000 7.5053 0.1951 -0.8838 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1068 0.6296 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3662 1.1496 -0.1255 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2492 0.6282 0.3048 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5715 -0.5177 -0.2694 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4518 -0.9531 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8639 -0.2907 1.4188 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7051 -0.4156 2.5537 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4776 -0.8307 1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4278 -0.6119 0.6177 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2879 -1.3291 -0.4017 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4358 0.3377 0.5794 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2732 0.4722 -0.5944 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9441 1.8598 -1.1031 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6482 2.2594 -2.3123 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4415 1.5346 -2.9473 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4342 3.5470 -2.8157 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.7221 0.4871 -0.1871 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1822 -0.6795 0.5058 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.6504 -0.7143 0.3733 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7043 -1.9336 0.0223 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9259 -0.6034 1.9269 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2635 0.8130 -1.3792 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6231 0.3469 0.2026 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6959 -0.8756 -1.1305 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6507 -0.2136 -1.8058 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2079 1.4762 -2.0014 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8063 2.0179 0.3718 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7868 1.1082 1.1866 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9717 -1.0371 -1.1336 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9593 -1.7941 -0.1706 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 0.8027 1.2112 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2022 -0.0259 3.3029 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6259 -1.9135 1.9986 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1266 -0.3245 2.6888 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0093 -0.2367 -1.3762 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1403 2.5922 -0.2666 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8292 1.9108 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3626 0.6175 -1.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8751 1.3683 0.4667 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1295 -0.0526 1.0958 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0136 -1.7603 0.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8623 -0.3401 -0.6552 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7702 -2.2965 0.4773 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4742 -2.7124 0.3042 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6816 -1.9770 -1.1039 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -1.4322 2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4339 0.3328 2.3006 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8658 -0.6149 2.1739 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 2 3 6 7 1 0 7 8 1 0 7 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 4 29 1 0 5 30 1 0 6 31 1 0 7 32 1 0 8 33 1 0 9 34 1 0 9 35 1 0 13 36 1 0 14 37 1 0 14 38 1 0 18 39 1 0 18 40 1 0 20 41 1 0 20 42 1 0 20 43 1 0 21 44 1 0 21 45 1 0 21 46 1 0 22 47 1 0 22 48 1 0 22 49 1 0 M CHG 2 17 -1 19 1 M END