Mol:BMFYB3DAr001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
8 7 0 0 0 0 0 0 0 0999 V2000
3.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.0000 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
4.5981 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 7 1 0 0 0 0
3 8 2 0 0 0 0
3 2 1 0 0 0 0
2 4 1 0 0 0 0
2 1 1 0 0 0 0
1 5 2 0 0 0 0
1 6 1 0 0 0 0
S SKP 7
ID BMFYB3DAr001
NAME Methyl-malonic acid
FORMULA C4H6O4
EXACTMASS 118.0266
AVERAGEMASS 118.088
SMILES CC(C(O)=O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02170
M END
