Mol:BMAAB5AK0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
9 8 0 0 1 0 0 0 0 0999 V2000
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 2 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 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5000 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
2.8660 1.0000 0.0000 N 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
4.5981 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 0 0 0 0
1 9 2 0 0 0 0
3 4 1 0 0 0 0
1 8 1 0 0 0 0
4 5 1 0 0 0 0
1 2 1 0 0 0 0
4 6 1 0 0 0 0
2 7 1 6 0 0 0
S SKP 7
ID BMAAB5AK0003
NAME L-Leucine
FORMULA C6H13NO2
EXACTMASS 131.0946
AVERAGEMASS 131.1729
SMILES CC(C)C[C@H](N)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00123
M END
