Mol:FL3FECGS0038

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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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    0.5610   -0.6022 
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    0.6061    0.3500 
S  SKP  5 
ID	FL3FECGS0038 
FORMULA	C22H20O13 
EXACTMASS	492.090390726 
AVERAGEMASS	492.3864 
SMILES	COc(c(OC(O4)C(O)C(C(O)C4C(O)=O)O)3)c(c(c2c3)C(=O)C=C(O2)c(c1)ccc(c1O)O)O 
M  END