HMDB0241243 RDKit 3D (2E,4E)-Dodeca-2,4-dienoylcarnitine 57 56 0 0 0 0 0 0 0 0999 V2000 8.9502 1.3604 -0.5515 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8372 0.7094 -1.3303 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0738 -0.3120 -0.5703 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3804 0.1012 0.6531 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3389 1.1412 0.5821 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1638 0.8470 -0.2864 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4086 -0.4010 0.1519 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2906 -0.5663 -0.7814 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0167 -0.5765 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5943 -0.4182 0.9152 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6632 -0.4255 1.2571 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7888 -0.5784 0.4192 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8064 -0.7371 -0.8176 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0614 -0.5545 1.0132 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2618 -0.7034 0.2331 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8995 -1.9822 0.7859 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9708 -3.1360 0.6099 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0044 -3.2650 1.4033 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1133 -4.0848 -0.3894 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.0779 0.5030 0.5423 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3319 0.6350 -0.0948 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.5977 2.0697 -0.2906 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4692 -0.0249 -1.3555 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3764 0.1431 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8987 1.0658 0.5167 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9241 2.4730 -0.6831 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9595 1.0552 -0.9024 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3283 0.1824 -2.1873 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1809 1.4670 -1.8375 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3346 -0.7569 -1.2797 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7639 -1.1477 -0.3235 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9395 -0.8000 1.1329 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1455 0.4604 1.3967 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7086 2.1573 0.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 1.2645 1.6323 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4339 0.8202 -1.3619 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4416 1.6856 -0.1846 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0586 -1.3134 -0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1429 -0.2563 1.1792 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4779 -0.6972 -1.8636 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2766 -0.7098 -1.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3747 -0.2885 1.6847 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8457 -0.2930 2.3481 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9448 -0.8225 -0.8017 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8319 -2.2521 0.2616 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0388 -1.8683 1.8804 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1661 0.5471 1.6688 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4289 1.3969 0.3048 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5794 2.3630 0.1252 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8256 2.6834 0.2113 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6206 2.3023 -1.3839 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5450 -0.2160 -1.8993 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1143 -0.9506 -1.2771 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0840 0.6397 -2.0206 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2257 0.8561 0.8478 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7689 -0.8603 0.4492 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9476 0.0686 1.8027 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 3 9 10 1 0 10 11 2 3 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 15 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 21 24 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 3 30 1 0 3 31 1 0 4 32 1 0 4 33 1 0 5 34 1 0 5 35 1 0 6 36 1 0 6 37 1 0 7 38 1 0 7 39 1 0 8 40 1 0 9 41 1 0 10 42 1 0 11 43 1 0 15 44 1 0 16 45 1 0 16 46 1 0 20 47 1 0 20 48 1 0 22 49 1 0 22 50 1 0 22 51 1 0 23 52 1 0 23 53 1 0 23 54 1 0 24 55 1 0 24 56 1 0 24 57 1 0 M CHG 2 19 -1 21 1 M END