HMDB0241752 RDKit 3D 6-Hydroxynon-3-enoylcarnitine 51 50 0 0 0 0 0 0 0 0999 V2000 6.3908 1.0376 -1.6258 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3255 0.0489 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3671 -0.0997 0.3292 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 -1.0775 0.8071 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 -2.3267 0.2385 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9548 -0.6269 0.4733 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6098 0.6729 1.0971 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6252 0.9032 1.9366 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6785 -0.0935 2.4109 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7465 0.2647 2.0584 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5593 0.6640 2.9285 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1867 0.1607 0.7569 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5355 0.4977 0.3765 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4471 1.6006 -0.6191 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7809 2.8270 -0.1311 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3011 3.0066 1.0068 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6596 3.9165 -1.0081 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.0556 -0.7911 -0.2024 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3827 -0.8156 -0.6653 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.6324 -0.1621 -1.9339 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3714 -0.3439 0.2811 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7161 -2.2370 -0.8911 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2177 1.0228 -0.8981 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7931 0.7077 -2.5935 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9261 2.0276 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3489 0.4221 -1.5429 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 -0.9370 -1.6502 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1954 0.9293 0.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3895 -0.4607 0.6107 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -1.2001 1.9348 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -2.7933 0.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8691 -0.5040 -0.6339 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2082 -1.4197 0.7173 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2697 1.5137 0.7981 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5055 1.9223 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8527 -1.0958 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7146 -0.1512 3.5431 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1239 0.8352 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8709 1.3012 -1.5465 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4355 1.9197 -1.0166 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9175 -1.5749 0.5708 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3713 -1.0630 -1.0341 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7013 0.0700 -2.4903 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2039 -0.8298 -2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3146 0.7141 -1.8193 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5904 0.7392 0.1791 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3442 -0.8616 0.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 -0.6321 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1872 -2.5623 -1.8111 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8220 -2.2907 -1.0842 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3987 -2.7751 0.0011 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 4 6 1 0 6 7 1 0 7 8 2 3 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 13 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 19 22 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 4 30 1 0 5 31 1 0 6 32 1 0 6 33 1 0 7 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 13 38 1 0 14 39 1 0 14 40 1 0 18 41 1 0 18 42 1 0 20 43 1 0 20 44 1 0 20 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 M CHG 2 17 -1 19 1 M END