HMDB0304156 RDKit 3D 3-ureido-isobutyrate 20 19 0 0 0 0 0 0 0 0999 V2000 -2.3940 -0.3966 0.8946 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2874 -0.4570 -0.1519 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0493 -0.2671 0.5231 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1523 -0.3084 -0.3827 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -0.1398 0.1531 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6014 -0.1711 -0.7016 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6131 0.0370 1.3748 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4946 0.7031 -1.0503 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7038 0.5907 -2.2817 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4591 1.9832 -0.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2105 0.5485 1.4719 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3591 -0.2579 0.3766 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3841 -1.2788 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3816 -1.4209 -0.6493 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0871 0.6488 1.1374 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1665 -1.1255 1.2324 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0576 -0.4557 -1.4194 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 0.7029 -1.0753 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9802 -1.1142 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5342 2.1787 0.4490 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 5 7 2 0 2 8 1 0 8 9 2 0 8 10 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 3 15 1 0 3 16 1 0 4 17 1 0 6 18 1 0 6 19 1 0 10 20 1 0 M END