HMDB0241157 RDKit 3D (2E)-Undec-2-enoylcarnitine 56 55 0 0 0 0 0 0 0 0999 V2000 7.4960 0.4892 1.6216 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1761 0.2027 0.9007 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4802 -0.4615 -0.4211 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2395 -0.7900 -1.2141 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4315 0.4438 -1.5378 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1941 0.1246 -2.3305 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2591 -0.8067 -1.6162 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7743 -0.2375 -0.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8721 -1.2516 0.2888 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3916 -1.1290 0.5951 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2309 0.0414 0.4357 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8102 1.1051 -0.0355 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5874 0.0154 0.8186 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4472 1.1008 0.7017 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1049 1.4842 1.9878 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1002 1.8508 3.0063 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8837 1.8009 2.7062 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4626 2.2516 4.2936 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.4765 0.8917 -0.4071 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3144 -0.2408 -0.2323 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.8435 -0.5791 -1.5661 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6138 -1.4312 0.2087 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4417 -0.0459 0.6289 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4254 0.2512 2.7038 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3314 -0.0617 1.1701 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7456 1.5730 1.5463 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6184 -0.5086 1.5401 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5870 1.1128 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0895 0.2526 -1.0276 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0611 -1.3719 -0.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5564 -1.3414 -2.1077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6026 -1.4385 -0.5511 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1397 0.9476 -0.6106 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 1.0930 -2.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4033 -0.2890 -3.3246 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6526 1.0818 -2.4893 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -1.8073 -1.4354 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3639 -0.9329 -2.2596 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3226 0.7307 -0.3795 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6552 -0.1899 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3203 -2.2566 0.5001 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8599 -2.0509 1.0308 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8524 1.9666 0.3333 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7307 2.3990 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6993 0.6569 2.4336 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0890 1.8058 -0.4357 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9174 0.7949 -1.3394 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0006 -1.0045 -2.1365 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 0.4019 -2.0335 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7165 -1.2418 -1.4967 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7113 -1.6525 -0.3708 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4695 -1.4464 1.3071 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3218 -2.2877 0.0023 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4150 -0.7434 1.5169 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5587 1.0192 0.9633 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3954 -0.2908 0.1185 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 1 0 9 10 2 3 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 14 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 20 23 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 2 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 4 32 1 0 5 33 1 0 5 34 1 0 6 35 1 0 6 36 1 0 7 37 1 0 7 38 1 0 8 39 1 0 8 40 1 0 9 41 1 0 10 42 1 0 14 43 1 0 15 44 1 0 15 45 1 0 19 46 1 0 19 47 1 0 21 48 1 0 21 49 1 0 21 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 M CHG 2 18 -1 20 1 M END