HMDB0061638 RDKit 3D 3-hydroxydodecanoyl carnitine 62 61 0 0 0 0 0 0 0 0999 V2000 9.1315 -1.3274 -0.5254 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8426 -0.5068 0.7051 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6233 0.3441 0.4485 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4672 -0.5647 0.1463 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1884 0.2494 -0.1132 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1067 -0.7307 -0.3871 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7407 -0.0887 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2732 0.7252 0.4734 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9873 1.4165 0.2659 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 0.7311 0.0404 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2492 1.8201 -0.0486 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5516 -0.0353 -1.2028 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9749 -0.5536 -1.0117 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1528 -1.7829 -0.8432 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0497 0.2886 -1.0167 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 -0.1429 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2296 0.4248 -1.9646 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6952 -0.0818 -3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7244 -0.8653 -3.3099 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3018 0.3327 -4.4400 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.9001 0.3468 0.5171 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2181 -0.0309 0.8795 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.5243 -1.4257 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2762 0.7858 0.3838 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2604 0.0670 2.3629 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2246 -1.5087 -0.6759 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7719 -0.8003 -1.4414 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6492 -2.3178 -0.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5894 -1.2066 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7205 0.1121 1.0153 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8618 0.9837 -0.4178 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4121 1.0197 1.3073 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3069 -1.2728 0.9648 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7018 -1.0961 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4460 0.8613 -1.0212 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 0.9602 0.6935 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0073 -1.5034 0.3989 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3628 -1.2637 -1.3312 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8065 0.4392 -1.6233 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0866 -0.9738 -0.8076 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1093 0.0474 1.3887 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0666 1.4192 0.8757 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7989 2.1245 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 2.2045 -0.5676 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 0.1770 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 2.3779 0.7516 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5071 0.5902 -2.1206 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0272 -0.9469 -1.3828 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4095 -1.2382 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0327 1.5482 -1.9253 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 0.3260 -1.8728 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1902 -0.0267 1.2926 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8346 1.4559 0.5094 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6293 -2.0313 0.7427 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3683 -1.7043 1.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8659 -1.5232 -0.5017 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0093 0.2181 -0.2658 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9243 1.0912 1.2559 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9632 1.7461 -0.0657 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4907 -0.6174 2.7189 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0105 1.0941 2.6657 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2835 -0.1610 2.7031 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 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 16 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 22 25 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 0 2 30 1 0 3 31 1 0 3 32 1 0 4 33 1 0 4 34 1 0 5 35 1 0 5 36 1 0 6 37 1 0 6 38 1 0 7 39 1 0 7 40 1 0 8 41 1 0 8 42 1 0 9 43 1 0 9 44 1 0 10 45 1 0 11 46 1 0 12 47 1 0 12 48 1 0 16 49 1 0 17 50 1 0 17 51 1 0 21 52 1 0 21 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 25 60 1 0 25 61 1 0 25 62 1 0 M CHG 2 20 -1 22 1 M END