Mol:BMFYB2HOb002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
  7  6  0  0  0  0  0  0  0  0999 V2000 
    3.7321    0.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -0.0670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -0.5670    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0 
    2.3660    0.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -1.0670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.3660   -1.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    1.4330    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  7  1  0  0  0  0 
  3  4  1  0  0  0  0 
  3  2  1  0  0  0  0 
  3  6  1  0  0  0  0 
  2  1  1  0  0  0  0 
  3  5  1  0  0  0  0 
S  SKP  7 
ID	BMFYB2HOb002 
NAME	Choline 
FORMULA	C5H14NO 
EXACTMASS	104.1075 
AVERAGEMASS	104.1708 
SMILES	OCC[N+1](C)(C)C 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C00114 
M  END