Mol:BMAXTP--0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 25 24  0  0  1  0  0  0  0  0999 V2000 
    3.7320   -3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -3.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    4.5981   -2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -3.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301    1.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    5.4641    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    1.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    4.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    2.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    1.0000    0.0000 C   0  0  1  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 
    3.7320   -4.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -3.0000    0.0000 O   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 
    8.0622    1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    8.9282    4.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    4.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    2.5000    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 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  5 10  1  0  0  0  0 
  5 20  2  0  0  0  0 
  8 10  1  1  0  0  0 
  8  7  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 11  1  0  0  0  0 
  7 21  2  0  0  0  0 
  7 14  1  0  0  0  0 
 14 13  1  0  0  0  0 
  2  6  1  6  0  0  0 
  1 18  1  0  0  0  0 
  1 19  2  0  0  0  0 
  2  1  1  0  0  0  0 
 12 22  1  0  0  0  0 
 12 23  2  0  0  0  0 
 13 12  1  0  0  0  0 
 16 17  1  1  0  0  0 
 16 15  1  0  0  0  0 
 16 25  1  0  0  0  0 
 15 11  1  0  0  0  0 
 15 24  2  0  0  0  0 
S  SKP  7 
ID	BMAXTP--0001 
NAME	(R)-S-Lactoyl-glutathione 
FORMULA	C13H21N3O8S 
EXACTMASS	379.1049 
AVERAGEMASS	379.3872 
SMILES	OC(=O)CNC(=O)[C@@H](NC(=O)CC[C@H](N)C(O)=O)CSC(=O)[C@@H](C)O 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C03451 
M  END