HMDB0241291 RDKit 3D 3,5-Dihydroxydodecanoylcarnitine 63 62 0 0 0 0 0 0 0 0999 V2000 6.5612 -0.9180 -2.2165 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8241 -2.0457 -1.2619 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1363 -1.5522 0.1353 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0127 -0.7403 0.7329 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7566 -1.5676 0.8228 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6121 -0.7796 1.4269 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2814 0.4404 0.6125 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1371 1.2053 1.2381 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4502 1.6239 2.5285 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8327 0.4454 1.1894 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2086 1.3274 1.8452 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2933 2.5150 1.1387 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5568 0.6459 1.9542 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0967 0.2682 0.6325 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -0.7710 0.0484 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0312 1.0701 0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6125 0.8049 -1.2472 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 1.8546 -2.2661 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7762 1.5842 -3.5875 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9060 1.9891 -3.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 0.8198 -4.5390 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.0935 0.7302 -1.2341 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6625 -0.2769 -0.3795 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.7878 0.2661 0.9739 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9845 -1.5288 -0.3736 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0438 -0.5273 -0.8211 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 -0.0061 -1.8078 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4572 -0.7727 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9588 -1.2043 -3.2127 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9952 -2.7799 -1.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7222 -2.6184 -1.6353 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0367 -0.8846 0.0193 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4091 -2.4187 0.7786 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8812 0.1444 0.0742 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3621 -0.4319 1.7447 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4668 -2.0162 -0.1287 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9749 -2.4070 1.5372 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8352 -0.5330 2.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7249 -1.4490 1.4096 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1639 1.1096 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0237 0.1993 -0.4347 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9534 2.1482 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4935 0.8644 3.1707 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -0.4954 1.7624 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6075 0.1930 0.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1373 1.5546 2.8731 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0775 3.2776 1.6676 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2458 1.3865 2.4222 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4987 -0.2000 2.6625 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1962 -0.1504 -1.6203 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0672 1.9168 -2.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5176 2.8692 -1.9597 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 1.7157 -1.0144 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4050 0.4699 -2.2899 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8501 0.2137 1.5361 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1727 1.3206 0.8622 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6202 -0.2948 1.4547 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2855 -1.6609 0.4772 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7422 -2.3373 -0.2407 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4854 -1.7514 -1.3436 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0911 -1.4739 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4302 0.2785 -1.4529 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7130 -0.6593 0.0534 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 8 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 17 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 23 26 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 2 31 1 0 3 32 1 0 3 33 1 0 4 34 1 0 4 35 1 0 5 36 1 0 5 37 1 0 6 38 1 0 6 39 1 0 7 40 1 0 7 41 1 0 8 42 1 0 9 43 1 0 10 44 1 0 10 45 1 0 11 46 1 0 12 47 1 0 13 48 1 0 13 49 1 0 17 50 1 0 18 51 1 0 18 52 1 0 22 53 1 0 22 54 1 0 24 55 1 0 24 56 1 0 24 57 1 0 25 58 1 0 25 59 1 0 25 60 1 0 26 61 1 0 26 62 1 0 26 63 1 0 M CHG 2 21 -1 23 1 M END