HMDB0241331 RDKit 3D 3-Hydroxytrideca-5,8-dienoylcarnitine 61 60 0 0 0 0 0 0 0 0999 V2000 9.1237 0.8824 -1.5102 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7728 0.0155 -0.3075 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2643 -0.0934 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8507 -0.9513 0.9404 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3658 -1.0199 0.9466 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7273 -0.5607 2.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2225 -0.6242 2.0279 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7375 -1.2252 0.7772 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9534 -0.6211 -0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4429 0.7341 0.1141 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0834 0.6351 0.1484 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4952 -0.1759 1.2024 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7113 2.0201 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1818 1.8162 0.2969 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 2.8587 0.4026 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7967 0.6033 0.2134 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2801 0.4854 0.2444 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -0.2320 1.5207 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8902 -0.5227 1.9313 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3658 -1.6879 1.7898 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6650 0.4994 2.4877 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.6707 -0.1643 -1.0279 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0219 -0.3664 -1.3620 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.4162 -1.7773 -1.3478 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0000 0.4588 -0.7266 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1224 -0.0228 -2.8181 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6954 0.3544 -2.4067 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6328 1.8660 -1.3643 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2096 0.9763 -1.5701 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1475 0.5391 0.6122 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2144 -0.9733 -0.4498 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8939 -0.5556 -1.1711 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8618 0.9275 -0.0892 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2537 -0.5484 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2238 -1.9853 0.8011 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8749 -1.4407 0.0854 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2304 -0.1418 2.8637 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8267 0.3583 2.2512 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0154 -1.3173 2.9125 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0707 -2.2668 0.5456 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6356 -1.1486 -0.9809 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7521 1.3093 -0.8162 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7508 1.2881 0.9822 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3793 0.1233 -0.7896 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6344 0.3339 2.0317 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4342 2.6744 -0.5492 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3291 2.4601 1.2077 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6112 1.5343 0.3406 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8724 -1.1588 1.5977 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0917 0.4132 2.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1835 0.4301 -1.8731 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1879 -1.1899 -1.0123 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6344 -2.3420 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4346 -1.9231 -0.9373 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4004 -2.2446 -2.3501 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7657 -0.1197 -0.1632 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5482 1.2909 -0.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6157 0.9612 -1.5357 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1930 1.0915 -2.8533 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2394 -0.3853 -3.3505 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0728 -0.4664 -3.1765 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 2 3 6 7 1 0 7 8 1 0 8 9 2 3 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 17 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 23 26 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 2 31 1 0 3 32 1 0 3 33 1 0 4 34 1 0 4 35 1 0 5 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 10 43 1 0 11 44 1 0 12 45 1 0 13 46 1 0 13 47 1 0 17 48 1 0 18 49 1 0 18 50 1 0 22 51 1 0 22 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 26 59 1 0 26 60 1 0 26 61 1 0 M CHG 2 21 -1 23 1 M END