Mol:BMFYB4DAs005
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 11 10 0 0 1 0 0 0 0 0999 V2000 2.8660 -0.6340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.1340 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2321 0.7321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 0 0 0 0 4 7 1 0 0 0 0 4 8 2 0 0 0 0 3 4 1 0 0 0 0 2 1 1 0 0 0 0 2 9 1 1 0 0 0 1 10 1 0 0 0 0 1 11 2 0 0 0 0 2 5 1 6 0 0 0 5 6 1 0 0 0 0 S SKP 7 ID BMFYB4DAs005 NAME (R) -2-Ethyl-2-hydroxybutanedioic acid CAS_RN 873073-25-7 FORMULA C6H10O5 EXACTMASS 162.0528 AVERAGEMASS 162.1406 SMILES CC[C@](O)(CC(O)=O)C(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02488 M END