Mol:FL5FEAGS0007

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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  2 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   -0.9385   -0.2351 
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    0.6960    0.4018 
S  SKP  5 
ID	FL5FEAGS0007 
FORMULA	C22H20O13 
EXACTMASS	492.090390726 
AVERAGEMASS	492.3864 
SMILES	c(c1)(ccc(C(O3)=C(OC(C(O)4)OC(C(O)C4O)C(O)=O)C(=O)c(c32)c(c(OC)c(c2)O)O)c1)O 
M  END