HMDB0002820 RDKit 3D Methylimidazoleacetic acid 18 18 0 0 0 0 0 0 0 0999 V2000 -2.8835 0.7267 -0.0802 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6336 -0.0382 -0.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5018 -1.3374 0.1789 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1954 -1.6449 0.0535 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -0.5390 -0.2914 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9263 -0.4511 -0.5567 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6397 -0.1926 0.7133 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7605 -1.0257 1.6544 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2424 1.0500 0.9231 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4357 0.4785 -0.3796 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 1.6419 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1449 1.0066 0.9412 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6991 0.0859 -0.5155 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3064 -2.0108 0.4592 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1269 0.4053 -1.2604 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3446 -1.3598 -1.0925 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2558 1.7242 0.1832 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1767 1.4803 -0.6432 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 5 10 2 0 10 2 1 0 1 11 1 0 1 12 1 0 1 13 1 0 3 14 1 0 6 15 1 0 6 16 1 0 9 17 1 0 10 18 1 0 M END