HMDB0241898 RDKit 3D 2-Propylpent-4-enoylcarnitine 47 46 0 0 0 0 0 0 0 0999 V2000 4.0285 2.6331 1.4687 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9351 1.9408 1.7732 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0174 1.5725 0.6615 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8807 0.0473 0.5709 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2369 -0.5139 0.3153 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3039 -2.0049 0.2013 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7393 -2.4720 -0.0531 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9034 -0.2299 -0.5341 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1806 -0.9080 -1.5477 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3888 0.2730 -0.4707 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3974 0.0843 -1.4263 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7294 1.2849 -2.2513 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1865 2.4747 -1.5223 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4129 2.7180 -1.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3069 3.3764 -0.9102 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.5002 -0.8048 -1.0192 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2585 -0.5364 0.1329 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.5004 -1.8505 0.7777 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5708 0.0270 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6441 0.2573 1.1686 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2698 2.9323 0.4598 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 2.9064 2.2721 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7215 1.6535 2.8064 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4379 1.8712 -0.3155 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0105 2.0089 0.8237 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -0.3546 1.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9477 -0.1398 1.0969 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6624 -0.1034 -0.6483 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7197 -2.3804 -0.6599 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9975 -2.4859 1.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0697 -2.2522 -1.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4181 -1.8903 0.6209 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8524 -3.5552 0.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8298 -0.5815 -2.2224 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8426 1.6336 -2.8631 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4617 0.9817 -3.0544 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2165 -0.8486 -1.8886 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0954 -1.8656 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5686 -2.1525 0.6798 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 -1.8451 1.8435 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8965 -2.6509 0.3087 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8687 -0.0357 -1.1718 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6565 1.0671 0.3144 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3156 -0.5512 0.5022 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2462 0.0278 2.1054 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6268 -0.0920 1.4399 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7241 1.3336 1.0562 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 1 0 4 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 11 16 1 0 16 17 1 0 17 18 1 0 17 19 1 0 17 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 5 27 1 0 5 28 1 0 6 29 1 0 6 30 1 0 7 31 1 0 7 32 1 0 7 33 1 0 11 34 1 0 12 35 1 0 12 36 1 0 16 37 1 0 16 38 1 0 18 39 1 0 18 40 1 0 18 41 1 0 19 42 1 0 19 43 1 0 19 44 1 0 20 45 1 0 20 46 1 0 20 47 1 0 M CHG 2 15 -1 17 1 M END