HMDB0240793 RDKit 3D 3,4-Dimethylideneoctanedioylcarnitine 51 50 0 0 0 0 0 0 0 0999 V2000 3.9299 1.2881 1.1081 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4909 0.0589 0.9735 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4038 -1.0720 0.7595 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7996 -0.7055 0.3892 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9332 -0.0110 -0.9451 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3587 0.3259 -1.1792 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2393 0.0013 -0.3552 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7006 1.0137 -2.3386 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0457 -0.1745 1.0314 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5693 -1.3935 0.9131 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0816 0.9449 1.2071 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3125 0.4336 1.2316 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8089 0.1350 2.3636 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1133 0.2557 0.1213 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4888 -0.2588 0.2891 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3881 -1.6128 -0.3458 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6003 -2.4433 -0.3378 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -2.7385 -1.3659 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0955 -2.9847 0.8532 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.3185 0.7585 -0.3833 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7256 0.6640 -0.3878 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.2973 0.2180 -1.6614 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3482 -0.0292 0.6892 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2053 2.0802 -0.2955 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9861 1.5449 1.0732 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2086 2.0922 1.2595 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3747 -1.7732 1.6466 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9873 -1.6270 -0.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 -1.6424 0.2861 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2612 -0.0419 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6863 -0.7539 -1.7849 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2481 0.8394 -1.0059 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1235 1.7706 -2.6799 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2778 -2.2103 0.7713 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5055 -1.5560 0.9611 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3037 1.5758 2.0753 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1722 1.5916 0.3063 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6274 -0.3961 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -2.2439 0.1776 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9599 -1.5449 -1.3933 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0022 1.7603 0.0606 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9535 0.8656 -1.4498 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5034 -0.1312 -2.3511 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8573 1.0019 -2.1944 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0264 -0.6233 -1.4784 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6425 -0.1972 1.5276 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1531 0.6377 1.1223 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9173 -0.9452 0.3993 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 2.4137 0.7336 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2572 2.1485 -0.5767 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5643 2.6901 -0.9859 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 2 9 1 0 9 10 2 3 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 3 27 1 0 3 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 8 33 1 0 10 34 1 0 10 35 1 0 11 36 1 0 11 37 1 0 15 38 1 0 16 39 1 0 16 40 1 0 20 41 1 0 20 42 1 0 22 43 1 0 22 44 1 0 22 45 1 0 23 46 1 0 23 47 1 0 23 48 1 0 24 49 1 0 24 50 1 0 24 51 1 0 M CHG 2 19 -1 21 1 M END