HMDB0013116 RDKit 3D Valproylglycine 33 32 0 0 0 0 0 0 0 0999 V2000 -1.8647 -2.9186 1.2385 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3176 -2.1128 0.1083 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2854 -0.6323 0.3936 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7185 0.0979 -0.8032 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6576 1.5888 -0.5853 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0199 2.1885 -0.3225 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8098 3.6845 -0.1226 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6557 -0.3534 -1.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8543 -0.8518 -2.2576 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7253 -0.2410 -0.2042 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0596 -0.6784 -0.5118 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0092 -0.4691 0.5787 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6222 0.0500 1.6543 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 -0.8248 0.4765 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7974 -2.4259 1.6429 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1787 -2.9985 2.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2071 -3.9104 0.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -2.4319 -0.1007 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9079 -2.3432 -0.7964 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6567 -0.4862 1.2991 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3068 -0.3050 0.6346 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -0.0752 -1.6571 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2143 2.0317 -1.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0189 1.8096 0.2522 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7077 2.0507 -1.1605 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3837 1.7770 0.6249 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5832 4.1083 0.5284 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7739 3.8978 0.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8956 4.1537 -1.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5378 0.1744 0.7291 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4445 -0.2245 -1.4482 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0086 -1.7771 -0.7116 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6776 -1.5530 1.0748 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 4 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 1 15 1 0 1 16 1 0 1 17 1 0 2 18 1 0 2 19 1 0 3 20 1 0 3 21 1 0 4 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 7 27 1 0 7 28 1 0 7 29 1 0 10 30 1 0 11 31 1 0 11 32 1 0 14 33 1 0 M END