Mol:BMMCBZ2Pq048

 
 
Copyright: ARM project http://www.metabolome.jp/ 
  8  8  0  0  0  0  0  0  0  0999 V2000 
    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 
    2.8660    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -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   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  2  1  1  0  0  0  0 
  2  3  2  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  6  1  1  0  0  0  0 
  5  6  2  0  0  0  0 
  1  7  2  0  0  0  0 
  4  8  1  0  0  0  0 
S  SKP  7 
ID	BMMCBZ2Pq048 
NAME	4-Hydroxyphenolate 
CAS_RN	123-31-9 
FORMULA	C6H6O2 
EXACTMASS	110.0367 
AVERAGEMASS	110.1106 
SMILES	OC(C=1)C=CC(=O)C1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C02389 
M  END