HMDB0241076 RDKit 3D 5-Hydroxydec-8-enoylcarnitine 54 53 0 0 0 0 0 0 0 0999 V2000 8.1002 0.1471 0.0137 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0774 0.5084 -0.9981 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8154 0.1193 -0.8119 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7477 0.4524 -1.7929 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 1.2727 -1.1018 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0989 0.5360 0.0471 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1299 1.4126 0.6049 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4489 -0.7274 -0.4057 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8121 -1.5515 0.6537 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7104 -0.9305 1.4299 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4475 -0.5344 0.5937 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4272 -0.7523 -0.6503 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5381 0.0736 1.2105 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6588 0.4437 0.3273 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7417 1.9183 0.5173 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7665 2.6288 -0.2601 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 3.2274 0.2744 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7222 2.7005 -1.6581 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.7576 -0.4042 0.8228 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0273 -0.4024 0.2114 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.0486 -0.2392 -1.2251 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0316 0.4243 0.8372 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5465 -1.7925 0.4041 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9256 0.8723 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5786 0.0583 0.9945 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5071 -0.8589 -0.2917 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3454 1.0745 -1.8682 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5347 -0.4556 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 -0.4745 -2.2236 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1999 1.0404 -2.6532 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9074 1.6220 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2118 2.2222 -0.7738 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8353 0.2842 0.8172 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5035 1.7684 1.4355 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7588 -0.5209 -1.2593 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2329 -1.4078 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4125 -2.4787 0.1461 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6113 -1.9036 1.3506 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3182 -1.6459 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1041 -0.0842 2.0144 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3694 0.1385 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7672 2.4210 0.2236 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8096 2.1944 1.6164 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3501 -1.4716 0.7753 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9312 -0.2730 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0760 -0.1728 -1.6966 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5932 0.7251 -1.4295 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6541 -1.0086 -1.7299 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5996 0.9657 1.7171 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8491 -0.2036 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5124 1.1184 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6434 -1.8120 0.2562 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9857 -2.5120 -0.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3256 -1.9888 1.4887 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 3 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 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 3 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 6 33 1 0 7 34 1 0 8 35 1 0 8 36 1 0 9 37 1 0 9 38 1 0 10 39 1 0 10 40 1 0 14 41 1 0 15 42 1 0 15 43 1 0 19 44 1 0 19 45 1 0 21 46 1 0 21 47 1 0 21 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 M CHG 2 18 -1 20 1 M END