HMDB0241142 RDKit 3D 3,6-Dihydroxydecanoylcarnitine 57 56 0 0 0 0 0 0 0 0999 V2000 7.6585 -0.0913 -0.9996 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2351 -1.5412 -0.9182 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1598 -1.6429 0.1489 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -0.7855 -0.1916 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -0.9422 0.9028 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6037 -2.3056 0.9664 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6797 -0.1802 0.6723 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9983 -0.6279 -0.5875 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7332 0.1391 -0.7991 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0692 1.4919 -0.8957 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -0.0283 0.3463 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4639 0.7852 0.0135 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5407 1.4468 -1.0679 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 0.8510 0.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7259 1.6253 0.5519 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7841 2.7477 1.5618 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 3.6642 1.4187 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7233 3.5360 0.4848 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0929 4.7083 2.3092 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.9451 0.7485 0.6196 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9407 -0.3564 -0.2861 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.3129 -0.8907 -0.2686 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6657 0.0077 -1.6527 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0614 -1.4023 0.1288 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3281 0.4625 -0.1023 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7684 -0.0022 -1.0331 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2076 0.4049 -1.8875 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0676 -2.2141 -0.6279 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7985 -1.8516 -1.9029 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8551 -2.7068 0.2396 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5611 -1.3165 1.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3048 0.2728 -0.2779 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5427 -1.1112 -1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3892 -0.6456 1.8761 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2201 -2.7250 1.6107 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0027 -0.4562 1.5249 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8349 0.9164 0.6272 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6543 -0.4100 -1.4783 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7615 -1.7142 -0.5491 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.1561 -1.7347 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0337 1.6055 -1.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4807 -1.0712 0.5628 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 0.4907 1.2276 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 2.0785 -0.4357 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8428 2.2375 2.5659 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7842 3.2721 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9021 1.2589 0.5321 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9361 0.3038 1.6592 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3073 -1.9947 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9079 -0.4866 -1.1142 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8428 -0.6052 0.6624 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6021 -0.1439 -1.9305 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2364 -0.6851 -2.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0391 1.0226 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6678 -1.1767 1.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6108 -2.3588 0.1576 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2013 -1.4514 -0.5841 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 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 15 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 21 24 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 3 30 1 0 3 31 1 0 4 32 1 0 4 33 1 0 5 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 8 38 1 0 8 39 1 0 9 40 1 0 10 41 1 0 11 42 1 0 11 43 1 0 15 44 1 0 16 45 1 0 16 46 1 0 20 47 1 0 20 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 24 55 1 0 24 56 1 0 24 57 1 0 M CHG 2 19 -1 21 1 M END