Mol:BMAXS5AMs005
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 12 11 0 0 1 0 0 0 0 0999 V2000 5.4641 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 6 1 6 0 0 0 2 1 1 0 0 0 0 1 10 2 0 0 0 0 2 3 1 0 0 0 0 4 3 1 0 0 0 0 5 12 2 0 0 0 0 4 5 1 0 0 0 0 5 7 1 0 0 0 0 1 11 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 S SKP 7 ID BMAXS5AMs005 NAME N5-Ethyl-L-glutamine FORMULA C7H14N2O3 EXACTMASS 174.1004 AVERAGEMASS 174.1977 SMILES CCNC(=O)CC[C@H](N)C(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01047 M END
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