Mol:BMACIZ--o001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 10 10  0  0  1  0  0  0  0  0999 V2000 
    6.4736   -0.9384    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    5.6646   -1.5262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.8556   -0.9384    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    5.1646    0.0127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.1646    0.0127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5768    0.8217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5823    0.7172    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    2.9945    1.5262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1756   -0.1964    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    1.4216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  7  9  1  6  0  0  0 
  7  8  1  0  0  0  0 
  8 10  2  0  0  0  0 
  7  6  1  0  0  0  0 
  4  3  1  0  0  0  0 
  4  5  2  0  0  0  0 
  3  2  1  0  0  0  0 
  5  1  1  0  0  0  0 
  2  1  2  0  0  0  0 
  6  4  1  0  0  0  0 
S  SKP  7 
ID	BMACIZ--o001 
NAME	L-Histidinal 
FORMULA	C6H9N3O 
EXACTMASS	139.0745 
AVERAGEMASS	139.1552 
SMILES	O=C[C@@H](N)Cc(c1)ncn1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C01929 
M  END