Mol:BMCCPUXAp020
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
12 13 0 0 0 0 0 0 0 0999 V2000
3.7321 1.9744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.4744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -0.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1229 -0.1948 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5296 -1.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5241 -1.0038 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.9744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.9744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0296 -1.9744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 6 1 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
5 6 1 0 0 0 0
5 4 2 0 0 0 0
9 8 1 0 0 0 0
8 7 1 0 0 0 0
7 5 1 0 0 0 0
4 9 1 0 0 0 0
6 11 2 0 0 0 0
2 10 2 0 0 0 0
8 12 2 0 0 0 0
S SKP 7
ID BMCCPUXAp020
NAME Uric acid
FORMULA C5H4N4O3
EXACTMASS 168.0283
AVERAGEMASS 168.1104
SMILES O=C(N1)NC(N2)=C(NC(=O)2)C(=O)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00366
M END
