Mol:BMAXS6AMl001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 13 12  0  0  1  0  0  0  0  0999 V2000 
    6.3301    2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    2.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    5.4641    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    2.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -2.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -2.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
 10  9  1  0  0  0  0 
  9  8  1  0  0  0  0 
  9 13  2  0  0  0  0 
  8  6  1  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 
  2  7  1  6  0  0  0 
  1 11  1  0  0  0  0 
  1 12  2  0  0  0  0 
S  SKP  7 
ID	BMAXS6AMl001 
NAME	L-Homocitrulline 
FORMULA	C7H15N3O3 
EXACTMASS	189.1113 
AVERAGEMASS	189.2124 
SMILES	NC(=O)NCCCC[C@H](N)C(O)=O 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C02427 
M  END