HMDB0029136 RDKit 3D Valylserine 30 29 0 0 0 0 0 0 0 0999 V2000 -2.6870 0.1493 1.5293 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3227 -0.6820 0.3188 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5269 -1.2430 -0.3633 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5376 0.2102 -0.6300 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1872 -0.5824 -1.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3072 0.6419 0.1035 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 1.3409 1.1422 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9536 0.2536 -0.3854 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1681 0.6497 0.2935 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9385 -0.5504 0.7795 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3121 -1.3994 -0.2524 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9993 1.5092 -0.6058 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6084 1.7879 -1.7676 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2152 2.0148 -0.1763 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9313 0.0336 2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6849 -0.1314 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7158 1.2078 1.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6826 -1.5022 0.6757 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6189 -0.7686 -1.3821 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3677 -2.3205 -0.5677 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -1.0689 0.2004 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1607 1.0697 -0.9005 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7018 -1.4578 -1.5068 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5807 -0.0536 -2.4494 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0462 -0.3309 -1.2513 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9107 1.2568 1.1836 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8233 -0.1931 1.3238 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2781 -1.1128 1.4576 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2285 -1.7380 -0.1714 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 3.0097 -0.2837 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 1 0 4 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 9 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 3 19 1 0 3 20 1 0 3 21 1 0 4 22 1 6 5 23 1 0 5 24 1 0 8 25 1 0 9 26 1 1 10 27 1 0 10 28 1 0 11 29 1 0 14 30 1 0 M END