HMDB0241299 RDKit 3D 7-Hydroxydodecanoylcarnitine 62 61 0 0 0 0 0 0 0 0999 V2000 6.9912 -3.7939 -0.3103 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7404 -2.4962 -1.0639 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5288 -1.8371 -0.4377 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2437 -0.5333 -1.1612 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0243 0.0907 -0.5057 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7491 1.3808 -1.2213 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 1.0785 -2.5755 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5687 2.1419 -0.6728 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3252 1.3159 -0.7818 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1088 2.0533 -0.2367 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2851 2.3926 1.2077 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8872 3.1160 1.7411 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1315 2.3266 1.6799 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2475 2.8518 2.0466 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2362 1.0166 1.2513 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 0.3256 1.2357 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4145 -0.9370 2.0298 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0573 -0.7160 3.4614 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8536 0.4440 3.8882 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9371 -1.7533 4.3631 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.8297 -0.0239 -0.2116 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0664 -0.6875 -0.4207 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.1755 -0.2289 0.3737 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9953 -2.1347 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4551 -0.3344 -1.8216 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6329 -3.6636 0.7405 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3456 -4.5725 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0640 -4.0769 -0.3242 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5898 -1.7940 -0.9883 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5119 -2.6876 -2.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6636 -2.5137 -0.4469 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7822 -1.5502 0.6217 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1418 0.1067 -1.0174 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0181 -0.6891 -2.2286 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2035 -0.6258 -0.5387 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2424 0.2999 0.5803 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6548 2.0146 -1.1665 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 1.8872 -3.0402 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4672 3.0513 -1.3284 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8241 2.4301 0.3623 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1341 1.1005 -1.8508 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4597 0.3984 -0.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 2.9775 -0.8596 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7792 1.4454 -0.4142 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4043 1.4541 1.8078 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1854 3.0190 1.3958 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6697 3.3998 2.8118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0882 4.0901 1.2407 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2366 1.0110 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3378 -1.5443 2.0384 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6245 -1.6263 1.6388 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8614 0.9706 -0.7478 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 -0.5529 -0.6915 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9067 -1.0929 0.4382 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 0.0332 1.4046 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7745 0.5605 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7612 -2.4919 0.4002 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3049 -2.5550 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9869 -2.5213 -0.1107 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3771 0.7631 -1.9356 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6991 -0.7703 -2.5047 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4484 -0.7430 -2.0076 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 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 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 7 38 1 0 8 39 1 0 8 40 1 0 9 41 1 0 9 42 1 0 10 43 1 0 10 44 1 0 11 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