HMDB0240212 RDKit 3D Dimethylguanidino valeric acid 29 28 0 0 0 0 0 0 0 0999 V2000 -3.8043 0.7454 -0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8543 -0.2150 0.2157 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2584 -1.5672 0.4454 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5217 0.2064 0.5094 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3672 1.3748 1.0162 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3915 -0.5918 0.2719 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2826 -0.7280 -0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0144 0.4862 -1.4572 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1038 0.9681 -0.5666 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1901 -0.0429 -0.3531 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1727 -1.1714 -0.9018 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2817 0.3300 0.5228 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3437 1.4366 1.0896 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2998 -0.5853 0.7374 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8429 0.5209 0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5892 1.7782 0.0653 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8224 0.7509 -1.4253 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6794 -2.3152 -0.1667 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3177 -1.7306 0.1669 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1914 -1.7997 1.5356 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4163 1.7146 1.2427 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0173 -1.1309 1.0975 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8984 -1.6555 -0.9811 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5407 -0.8836 -1.7575 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2574 1.3035 -1.5143 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3903 0.2837 -2.4727 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 1.3741 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6161 1.8074 -1.1259 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9945 -0.6640 -0.0065 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 3 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 2 0 12 14 1 0 1 15 1 0 1 16 1 0 1 17 1 0 3 18 1 0 3 19 1 0 3 20 1 0 5 21 1 0 6 22 1 0 7 23 1 0 7 24 1 0 8 25 1 0 8 26 1 0 9 27 1 0 9 28 1 0 14 29 1 0 M END