HMDB0241249 RDKit 3D 3-Hydroxydodeca-7,10-dienoylcarnitine 58 57 0 0 0 0 0 0 0 0999 V2000 7.2312 -3.9035 -5.3415 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 -2.7549 -4.9173 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7368 -2.7784 -3.7863 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9044 -1.5927 -3.3796 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3802 -1.0605 -2.1056 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8648 -0.8904 -0.9504 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5449 -1.1744 -0.4292 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5773 -1.7968 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2517 -2.0243 -0.5851 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.7009 -0.1374 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 0.1795 -1.1673 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -0.9507 0.5424 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1863 0.3481 1.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5927 1.4194 0.6992 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3244 0.4531 1.7471 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8615 1.7308 2.1843 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6029 1.7364 3.6512 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2291 0.6628 4.4151 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0034 -0.1541 3.9222 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9386 0.5440 5.7728 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.2407 1.7605 1.7025 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0943 2.8501 1.9297 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.0420 3.5411 3.1685 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8963 3.8687 0.8783 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4755 2.3946 1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7217 -4.3237 -4.4381 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0050 -3.5721 -6.0953 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5762 -4.6822 -5.8251 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -1.8830 -5.5509 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7502 -3.6182 -3.1178 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1102 -0.7768 -4.1583 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8857 -1.8528 -3.5217 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4879 -0.7120 -2.1561 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5722 -0.4194 -0.1619 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6277 -1.7769 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -0.1832 -0.0185 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9113 -2.7784 -1.7521 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2997 -1.0700 -2.1335 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4677 -2.6576 0.3026 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -2.5404 -1.2406 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3516 -0.2615 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2993 -0.1575 -1.6886 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4326 -1.5510 1.4544 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3178 -1.5029 -0.0922 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1694 2.4675 1.7078 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4806 1.5596 3.7544 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7317 2.7314 4.1279 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7405 0.7838 1.9873 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1758 1.6326 0.5675 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0311 4.0981 3.2553 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2944 4.3164 3.2852 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1167 2.8169 4.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2433 4.6672 1.2737 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4671 3.3722 -0.0213 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8781 4.3495 0.6704 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4596 1.2782 1.8263 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8782 2.6804 0.7465 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0764 2.7535 2.5747 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 10 11 1 0 10 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 16 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 22 25 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 0 3 30 1 0 4 31 1 0 4 32 1 0 5 33 1 0 6 34 1 0 7 35 1 0 7 36 1 0 8 37 1 0 8 38 1 0 9 39 1 0 9 40 1 0 10 41 1 0 11 42 1 0 12 43 1 0 12 44 1 0 16 45 1 0 17 46 1 0 17 47 1 0 21 48 1 0 21 49 1 0 23 50 1 0 23 51 1 0 23 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 M CHG 2 20 -1 22 1 M END