Mol:BMFYS6CAp008
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
9 8 0 0 0 0 0 0 0 0999 V2000
2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.7500 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
3.7321 0.7500 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
4.5981 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6 5 1 0 0 0 0
5 4 1 0 0 0 0
4 3 1 0 0 0 0
3 2 1 0 0 0 0
2 1 1 0 0 0 0
1 7 1 0 0 0 0
1 8 2 0 0 0 0
2 9 2 0 0 0 0
S SKP 7
ID BMFYS6CAp008
NAME 2-Oxo-hexanoic acid
FORMULA C6H10O3
EXACTMASS 130.0629
AVERAGEMASS 130.1418
SMILES CCCCC(=O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00902
M END
