HMDB0241160 RDKit 3D (7E)-Undec-7-enoylcarnitine 56 55 0 0 0 0 0 0 0 0999 V2000 7.9909 -1.0760 1.0937 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8694 -1.9429 -0.1432 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4170 -2.3568 -0.3027 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5894 -1.1432 -0.4466 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6104 -0.8142 0.3844 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8063 0.4045 0.2091 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3273 0.1162 0.0268 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6362 1.4699 -0.1402 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1421 1.2402 -0.3284 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4981 2.5838 -0.4878 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9622 2.5074 -0.6816 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6242 3.5675 -0.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6814 1.3328 -0.7179 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1158 1.3035 -0.9106 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4655 0.6235 -2.1796 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9176 0.6031 -2.4187 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8003 1.1259 -1.7276 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3406 -0.0988 -3.5761 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.7792 0.7830 0.3302 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4311 -0.5313 0.7425 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.2119 -1.5917 0.1344 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0229 -0.8449 0.6375 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7376 -0.6094 2.1853 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5235 -0.0980 0.8413 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4109 -1.4911 1.9425 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0337 -0.8747 1.3472 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5392 -2.8144 -0.0468 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1816 -1.3860 -1.0473 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3199 -2.9973 -1.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1411 -2.9819 0.5511 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7896 -0.4801 -1.2774 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4191 -1.4936 1.2204 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1406 0.9455 -0.7055 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9507 1.0879 1.0534 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -0.4899 -0.8898 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9027 -0.3757 0.9317 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7526 2.0472 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0792 2.0567 -0.9429 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0515 0.6535 -1.2271 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2051 0.7617 0.6153 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1859 3.2308 0.3329 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0659 3.0351 -1.4286 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3968 2.3657 -1.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0348 1.2461 -3.0101 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -0.4236 -2.2543 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4393 1.4704 1.1707 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8454 0.9050 0.2698 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2266 -1.2265 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4674 -2.3955 0.8883 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6757 -2.1262 -0.6671 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7593 -1.0968 -0.3956 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3881 -0.0956 1.1152 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8652 -1.7966 1.2267 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9274 -0.1295 2.7667 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6521 -0.0212 2.3453 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8516 -1.6637 2.4957 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 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 5 32 1 0 6 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 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