HMDB0061640 RDKit 3D 3-Hydroxytetradecanoyl carnitine 68 67 0 0 0 0 0 0 0 0999 V2000 -5.8425 -0.6723 4.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0065 -0.5756 2.4959 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 0.8951 2.1234 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2264 1.0527 0.6467 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0597 0.3961 -0.0783 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7625 1.0220 0.3168 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6075 0.2874 -0.4064 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7484 0.3816 -1.8684 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -0.1312 -2.7476 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2749 -1.5407 -2.6596 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5999 -1.9497 -1.4087 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6671 -1.1338 -1.2098 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2985 -1.5098 -0.0061 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6445 -1.4950 -2.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8893 -0.6896 -2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8384 -0.8811 -2.8773 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9653 0.2097 -1.0571 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1509 0.9712 -0.8614 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7011 2.4178 -1.1824 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7685 3.3987 -1.0587 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2528 3.7764 0.0262 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2944 3.9646 -2.2330 O 0 0 0 0 0 1 0 0 0 0 0 0 4.6582 0.9890 0.5245 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9878 -0.2462 1.1425 N 0 0 0 0 0 4 0 0 0 0 0 0 3.9067 -0.5726 2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1862 -0.1609 1.9678 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1377 -1.3832 0.2983 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8346 -0.8755 4.4723 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4289 0.2427 4.4513 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1942 -1.5510 4.2899 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9366 -1.0661 2.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1218 -1.0609 2.0301 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1666 1.4468 2.4815 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9250 1.3519 2.6632 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1308 0.4614 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3637 2.0894 0.3382 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2156 0.5567 -1.1892 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0353 -0.6834 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5682 0.8529 1.4145 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7059 2.0966 0.0643 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6671 0.5858 0.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8335 -0.7944 -0.1214 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7433 -0.1033 -2.1989 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9544 1.4714 -2.1507 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7686 0.5670 -2.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9282 0.1455 -3.8406 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2093 -2.2036 -2.8347 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5938 -1.7451 -3.5478 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2787 -3.0549 -1.5325 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1497 -1.9377 -0.4952 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5168 -0.0614 -1.1832 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9394 -0.8872 0.7039 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9364 -2.5686 -2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2726 -1.3205 -3.3202 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8876 0.6704 -1.5926 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2797 2.3642 -2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8204 2.6858 -0.5294 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0235 1.5779 1.2208 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6311 1.5786 0.4987 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -1.6674 2.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -0.1088 1.6766 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1691 -0.1931 3.1118 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0211 0.2126 1.3735 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0118 0.3785 2.9178 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4204 -1.2224 2.2481 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1954 -1.9624 0.1589 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4595 -1.0472 -0.7047 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9651 -2.0418 0.6547 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 11 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 18 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 24 27 1 0 1 28 1 0 1 29 1 0 1 30 1 0 2 31 1 0 2 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 4 36 1 0 5 37 1 0 5 38 1 0 6 39 1 0 6 40 1 0 7 41 1 0 7 42 1 0 8 43 1 0 8 44 1 0 9 45 1 0 9 46 1 0 10 47 1 0 10 48 1 0 11 49 1 0 11 50 1 0 12 51 1 0 13 52 1 0 14 53 1 0 14 54 1 0 18 55 1 0 19 56 1 0 19 57 1 0 23 58 1 0 23 59 1 0 25 60 1 0 25 61 1 0 25 62 1 0 26 63 1 0 26 64 1 0 26 65 1 0 27 66 1 0 27 67 1 0 27 68 1 0 M CHG 2 22 -1 24 1 M END