Mol:BMAXDP--0010
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 13 12 0 0 1 0 0 0 0 0999 V2000 5.4641 1.8400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3400 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7321 1.8400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.3400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.8400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.3400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.8400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.8400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9 10 1 0 0 0 0 9 8 1 0 0 0 0 8 13 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 11 1 2 0 0 0 0 2 1 1 0 0 0 0 2 7 1 1 0 0 0 4 6 1 0 0 0 0 5 4 1 0 0 0 0 1 12 1 0 0 0 0 8 7 1 0 0 0 0 S SKP 7 ID BMAXDP--0010 NAME Glycyl-L-leucine FORMULA C8H16N2O3 EXACTMASS 188.116 AVERAGEMASS 188.2243 SMILES NCC(=O)N[C@@H](CC(C)C)C(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02155 M END
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