Mol:BMMCHC--0028

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 10 10  0  0  1  0  0  0  0  0999 V2000 
    3.8660    0.6830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0000    0.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0000   -0.8170    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    3.8660   -1.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.7321   -0.8170    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    2.5000   -1.6830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8660    1.6830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -0.8170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.7321    0.1830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.5981   -1.3170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  4  3  1  0  0  0  0 
  4  5  1  0  0  0  0 
  5  9  1  0  0  0  0 
  9  1  1  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  8  1  0  0  0  0 
  3  6  1  4  0  0  0 
  5 10  1  4  0  0  0 
  1  7  2  0  0  0  0 
S  SKP  7 
ID	BMMCHC--0028 
NAME	Mevaldic acid 
FORMULA	C6H10O4 
EXACTMASS	146.0579 
AVERAGEMASS	146.1412 
SMILES	OC(O1)CC(C)(O)CC(=O)1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C00772 
M  END