HMDB0241054 RDKit 3D 3,4-dimethylideneheptanedioylcarnitine 48 47 0 0 0 0 0 0 0 0999 V2000 2.2938 0.3899 -3.3428 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -0.3912 -2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7375 -0.4037 -1.5985 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 0.6172 -2.1296 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2101 2.0089 -1.8875 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1242 2.1884 -1.2788 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 3.0718 -2.3462 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2682 -1.1434 -1.9208 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2583 -1.8157 -1.6272 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6842 -1.1028 -0.1109 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4481 -1.4530 0.4984 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3922 -2.3797 1.3811 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7858 -0.8631 0.2312 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0053 -1.2128 0.8569 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8853 -1.9819 -0.1358 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1297 -2.3621 0.5586 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3329 -2.1889 1.7834 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2013 -2.9609 -0.1382 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.7101 0.0452 1.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0732 0.9761 2.0572 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.9801 2.1567 2.0379 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0126 0.5930 3.4409 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8101 1.4926 1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1162 0.9381 -3.6903 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3687 0.4678 -3.8843 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1341 -1.4429 -1.8256 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7351 -0.3157 -0.5014 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6729 0.5525 -1.5678 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9331 0.4171 -3.1759 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6555 4.0027 -2.1408 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6277 -1.7222 -2.3275 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0797 -2.5423 -0.8787 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9165 -0.0628 -0.1873 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4314 -1.8177 -0.1861 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7952 -1.9308 1.6467 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1455 -1.3947 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3313 -2.9280 -0.3536 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8144 0.6163 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7620 -0.0420 1.5116 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9419 1.7858 2.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1618 2.4529 0.9862 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6237 2.9571 2.6882 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7062 1.4864 4.0231 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0178 0.2957 3.8252 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2874 -0.2062 3.6717 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7694 1.6623 0.5405 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 0.9615 1.9645 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7031 2.5283 2.0972 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 2 0 5 7 1 0 2 8 1 0 8 9 2 3 8 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 14 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 20 23 1 0 1 24 1 0 1 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 4 29 1 0 7 30 1 0 9 31 1 0 9 32 1 0 10 33 1 0 10 34 1 0 14 35 1 0 15 36 1 0 15 37 1 0 19 38 1 0 19 39 1 0 21 40 1 0 21 41 1 0 21 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 M CHG 2 18 -1 20 1 M END