HMDB0241137 RDKit 3D 7-Oxodecanoylcarnitine 54 53 0 0 0 0 0 0 0 0999 V2000 8.2018 -0.1429 -0.7527 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9211 0.1080 -1.5169 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7731 0.0104 -0.5581 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5116 0.2435 -1.2391 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5384 0.4967 -2.4476 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1609 0.2136 -0.6455 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1126 -0.1023 0.7947 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -0.1134 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9675 1.1869 1.0949 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4488 1.0980 1.5892 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2202 0.1130 0.8025 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7843 -0.4857 -0.2128 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -0.2357 1.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2709 -1.1842 0.3791 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6573 -2.3737 1.2312 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4136 -3.3997 0.4787 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9088 -4.4176 1.0655 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6266 -3.3210 -0.8858 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.5335 -0.4736 -0.0473 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2958 0.7098 -0.8408 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.5853 1.0307 -1.4661 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3577 0.5302 -1.9146 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 1.8433 0.0044 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9726 0.5202 -1.1756 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0496 0.0485 0.3226 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4771 -1.2165 -0.8832 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9138 1.1286 -1.9472 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8132 -0.6720 -2.3024 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9427 0.6247 0.3454 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7683 -1.0533 -0.1813 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7403 1.2403 -0.7962 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5363 -0.4562 -1.2695 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6029 0.7325 1.3713 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5297 -1.0640 1.0906 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -0.3749 2.3823 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1252 -0.9607 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9237 1.5214 0.0316 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5493 1.9618 1.6468 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 2.1244 1.5132 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 0.8676 2.6884 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7166 -1.5863 -0.4838 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7823 -2.8378 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3266 -2.0367 2.0647 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0708 -0.1311 0.8688 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2142 -1.1159 -0.6223 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0901 0.1273 -1.8283 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2176 1.4708 -0.6774 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4518 1.6966 -2.3322 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7475 0.9691 -2.8813 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1124 -0.5080 -2.1552 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4088 1.1069 -1.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9648 1.6107 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6017 2.6980 -0.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8887 2.2296 -0.3040 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 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 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 1 26 1 0 2 27 1 0 2 28 1 0 3 29 1 0 3 30 1 0 6 31 1 0 6 32 1 0 7 33 1 0 7 34 1 0 8 35 1 0 8 36 1 0 9 37 1 0 9 38 1 0 10 39 1 0 10 40 1 0 14 41 1 0 15 42 1 0 15 43 1 0 19 44 1 0 19 45 1 0 21 46 1 0 21 47 1 0 21 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 M CHG 2 18 -1 20 1 M END