Mol:BMACBZ--0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 12 12 0 0 1 0 0 0 0 0999 V2000 3.7321 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8660 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6 1 1 0 0 0 0 1 2 2 0 0 0 0 11 9 1 0 0 0 0 2 3 1 0 0 0 0 9 8 1 0 0 0 0 3 4 2 0 0 0 0 8 7 1 0 0 0 0 7 1 1 0 0 0 0 4 5 1 0 0 0 0 9 12 2 0 0 0 0 5 6 2 0 0 0 0 8 10 1 1 0 0 0 S SKP 7 ID BMACBZ--0004 NAME D-Phenylalanine FORMULA C9H11NO2 EXACTMASS 165.0789 AVERAGEMASS 165.1891 SMILES OC(=O)[C@H](N)Cc(c1)cccc1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02265 M END