Mol:BMFYB6CAi002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
13 12 0 0 0 0 0 0 0 0999 V2000
2.8660 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9 8 1 0 0 0 0
4 3 1 0 0 0 0
7 6 1 0 0 0 0
3 2 1 0 0 0 0
2 1 1 0 0 0 0
6 5 1 0 0 0 0
8 10 2 0 0 0 0
8 7 1 0 0 0 0
5 4 1 0 0 0 0
1 11 1 0 0 0 0
1 12 2 0 0 0 0
2 13 2 0 0 0 0
S SKP 7
ID BMFYB6CAi002
NAME 6-Acetamido-2-oxo-hexanoic acid
FORMULA C8H13NO4
EXACTMASS 187.0844
AVERAGEMASS 187.1931
SMILES CC(=O)NCCCCC(=O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05548
M END
