HMDB0241214 RDKit 3D 8-Dodecenoylcarnitine 59 58 0 0 0 0 0 0 0 0999 V2000 8.1452 -1.0429 -0.8265 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4383 0.1757 -1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1349 1.1539 -0.2459 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2827 0.4906 0.7269 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0591 0.8925 1.0873 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4041 2.0804 0.5378 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1432 1.9096 -0.2162 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8984 1.4404 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9303 0.1198 1.0517 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5487 -0.3105 1.5697 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4543 -0.3880 0.4699 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7525 -0.8182 1.1017 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8636 -1.0429 2.3357 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8829 -0.9838 0.3389 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1454 -1.3719 0.7623 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4295 -2.7809 0.3636 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3488 -3.0758 -1.0687 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9205 -2.2276 -1.8669 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7523 -4.3072 -1.5361 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.2395 -0.3984 0.7462 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6461 0.2428 -0.4504 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.5315 -0.5399 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6104 0.8524 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4834 1.3903 0.0187 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4201 -1.7142 -0.3603 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9302 -0.7297 -0.1058 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6108 -1.6011 -1.6846 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0659 0.7176 -2.1112 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4667 -0.0992 -1.8214 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1448 1.3847 0.2013 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6905 2.0306 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6309 -0.4411 1.2491 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5751 0.2644 1.8629 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 2.7303 -0.0529 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1051 2.7119 1.4547 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4218 1.2189 -1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 2.8790 -0.8153 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5638 2.1793 1.2031 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1113 1.4406 -0.4108 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -0.6633 0.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4853 0.2553 2.0427 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2452 0.3692 2.3878 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6867 -1.3234 1.9924 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1567 -1.1533 -0.2759 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6822 0.5752 -0.0117 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -1.5131 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7123 -3.5062 0.8621 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4184 -3.0878 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1683 -0.8630 1.1875 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0125 0.4275 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1457 -0.6864 -2.3006 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7759 -1.5196 -0.7752 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4975 -0.0204 -1.3751 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4784 0.4015 -2.2484 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8951 1.9187 -1.4708 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6388 0.9523 -0.6873 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8208 2.1158 0.5219 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9351 1.8653 -0.8771 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2487 1.0235 0.7225 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 2 3 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 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 5 33 1 0 6 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 8 38 1 0 8 39 1 0 9 40 1 0 9 41 1 0 10 42 1 0 10 43 1 0 11 44 1 0 11 45 1 0 15 46 1 0 16 47 1 0 16 48 1 0 20 49 1 0 20 50 1 0 22 51 1 0 22 52 1 0 22 53 1 0 23 54 1 0 23 55 1 0 23 56 1 0 24 57 1 0 24 58 1 0 24 59 1 0 M CHG 2 19 -1 21 1 M END