Mol:BMFYB5CAr007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 10 9 0 0 1 0 0 0 0 0999 V2000 3.7321 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0000 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 2 1 0 0 0 0 1 8 2 0 0 0 0 2 3 1 0 0 0 0 2 9 2 0 0 0 0 3 6 1 6 0 0 0 3 10 1 1 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 S SKP 7 ID BMFYB5CAr007 NAME 3-Hydroxy-3-methyl-2-oxopentanoic acid CAS_RN 17125-32-5 FORMULA C6H10O4 EXACTMASS 146.0579 AVERAGEMASS 146.1412 SMILES CC[C@](C)(O)C(=O)C(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06005 M END