Mol:BMMCIZ--m017

 
 
Copyright: ARM project http://www.metabolome.jp/ 
  8  8  0  0  0  0  0  0  0  0999 V2000 
    5.4791   -0.9384    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    4.6701   -1.5262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8611   -0.9384    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    4.1701    0.0127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.1701    0.0127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5823    0.8217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5878    0.7172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    1.5262    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
  2  1  2  0  0  0  0 
  6  7  1  0  0  0  0 
  4  6  1  0  0  0  0 
  7  8  1  0  0  0  0 
  3  2  1  0  0  0  0 
  1  5  1  0  0  0  0 
  5  4  2  0  0  0  0 
  4  3  1  0  0  0  0 
S  SKP  7 
ID	BMMCIZ--m017 
NAME	Histamine 
FORMULA	C5H9N3 
EXACTMASS	111.0796 
AVERAGEMASS	111.1451 
SMILES	NCCc(c1)ncn1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C00388 
M  END