HMDB0013286 RDKit 3D N-Undecanoylglycine 42 41 0 0 0 0 0 0 0 0999 V2000 -4.4279 -0.0861 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1659 0.8808 1.5198 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8785 0.4638 0.0826 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3795 0.5509 -0.1034 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0476 0.1494 -1.5045 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 0.1983 -1.8053 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8095 -0.7155 -0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6581 -0.6912 -1.1838 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2869 0.6477 -1.0093 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7454 0.7117 -1.2734 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6023 -0.1245 -0.4447 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1854 -0.8866 0.4908 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0026 -0.1199 -0.6608 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 -0.9146 0.1108 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -0.5741 1.5574 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0908 0.3118 2.0185 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6751 -1.2256 2.4767 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2498 -1.0640 1.9143 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0182 -0.2712 3.3401 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4529 0.3404 2.7635 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2432 0.7813 1.7602 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7712 1.8859 1.6896 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3977 1.1413 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2309 -0.5959 -0.0602 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9185 -0.0735 0.6675 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1178 1.6373 0.0141 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4479 -0.8936 -1.6672 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 0.7896 -2.1974 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2346 1.2348 -1.6113 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4328 -0.1189 -2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1487 -1.7814 -1.0609 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -0.4660 0.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8726 -1.0561 -2.2281 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1674 -1.4153 -0.5192 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8001 1.3831 -1.7135 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0074 1.0217 0.0068 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9082 0.4300 -2.3472 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0611 1.7804 -1.1112 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3844 0.4876 -1.4139 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9474 -0.7588 -0.2302 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7140 -2.0017 0.0382 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6668 -0.9937 2.5077 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 5 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 2 0 15 17 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 4 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 8 33 1 0 8 34 1 0 9 35 1 0 9 36 1 0 10 37 1 0 10 38 1 0 13 39 1 0 14 40 1 0 14 41 1 0 17 42 1 0 M END