Mol:BMMCIZ--j022
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 11 11 0 0 0 0 0 0 0 0999 V2000 4.0779 1.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4901 0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8968 -0.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -0.9531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -0.9531 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -2.4920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -1.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0724 1.4739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6711 2.4920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4955 0.8739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 0 0 0 0 1 9 1 0 0 0 0 1 10 2 0 0 0 0 2 1 1 0 0 0 0 2 11 2 0 0 0 0 4 8 2 0 0 0 0 7 6 2 0 0 0 0 6 5 1 0 0 0 0 5 4 1 0 0 0 0 8 7 1 0 0 0 0 4 3 1 0 0 0 0 S SKP 7 ID BMMCIZ--j022 NAME Imidazole-pyruvic acid FORMULA C6H6N2O3 EXACTMASS 154.0378 AVERAGEMASS 154.1235 SMILES OC(=O)C(=O)Cc(c1)ncn1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03277 M END
</pre>