Mol:BMSUM6Ar--01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 11 11 0 0 1 0 0 0 0 0999 V2000 2.8660 1.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8660 -0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7321 -0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 1.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4641 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5 11 1 0 0 0 0 11 1 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 4 5 1 0 0 0 0 5 6 1 6 0 0 0 1 7 1 4 0 0 0 2 8 1 1 0 0 0 3 9 1 6 0 0 0 4 10 1 1 0 0 0 S SKP 7 ID BMSUM6Ar--01 NAME 6-Deoxy-D-glucose FORMULA C6H12O5 EXACTMASS 164.0684 AVERAGEMASS 164.1564 SMILES C[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)C(O)1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02522 M END