Mol:BMAXS4SFi001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 12 11  0  0  1  0  0  0  0  0999 V2000 
    6.3301    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    0.5000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    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  0  0  0  0  0  0  0  0  0  0 
    5.4641   -0.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    1.0000    0.0000 S   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   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7320   -0.5000    0.0000 C   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 
    7.1962    0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301    2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  2  5  1  1  0  0  0 
  2  1  1  0  0  0  0 
  1 11  2  0  0  0  0 
  2  3  1  0  0  0  0 
  4  3  1  0  0  0  0 
  6  7  1  0  0  0  0 
  4  6  1  0  0  0  0 
  5  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  8 10  2  0  0  0  0 
  1 12  1  0  0  0  0 
S  SKP  7 
ID	BMAXS4SFi001 
NAME	N-Acetyl-L-methionine 
FORMULA	C7H13NO3S 
EXACTMASS	191.0616 
AVERAGEMASS	191.249 
SMILES	CC(=O)N[C@@H](CCSC)C(O)=O 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C02712 
M  END