Mol:BMFYB4CAb017

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 10  9  0  0  0  0  0  0  0  0999 V2000 
    2.8660   -1.6830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -0.6830    0.0000 C   0  3  0  0  0  0  0  0  0  0  0  0 
    3.7321   -0.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    0.8170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    1.3170    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0 
    5.4641    1.8170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.0981    2.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.0981    0.4510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -2.1830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -2.1830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  6  5  1  0  0  0  0 
  5  7  1  0  0  0  0 
  5  8  1  0  0  0  0 
  5  4  1  0  0  0  0 
  4  3  1  0  0  0  0 
  3  2  2  0  0  0  0 
  2  1  1  0  0  0  0 
  1  9  1  0  0  0  0 
  1 10  2  0  0  0  0 
S  SKP  7 
ID	BMFYB4CAb017 
NAME	Crotono-betaine 
FORMULA	C7H13NO2 
EXACTMASS	143.0946 
AVERAGEMASS	143.1836 
SMILES	OC(=O)[C+1]=CC[N+1](C)(C)C 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C11458 
M  END