Mol:FL5FBCGS0002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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  3 34  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  3  31  32  33 
M  SBL   1  1  36 
M  SMT   1 COOH 
M  SBV   1  36   -1.0957    0.0315 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  34  35 
M  SBL   2  1  38 
M  SMT   2 OCH3 
M  SBV   2  38    0.0000    0.6704 
S  SKP  5 
ID	FL5FBCGS0002 
FORMULA	C22H20O13 
EXACTMASS	492.090390726 
AVERAGEMASS	492.3864 
SMILES	c(c(C(O2)=C(OC(C(O)4)OC(C(O)C4O)C(O)=O)C(=O)c(c(OC)3)c2cc(c3)O)1)cc(c(c1)O)O 
M  END