Mol:FL5FEAGS0025

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FL5FEAGS0025.png

 
 
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M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  3  32  33  34 
M  SBL   1  1  38 
M  SMT   1  COOH 
M  SBV   1  38   -0.9209    0.1232 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  35  36 
M  SBL   2  1  40 
M  SMT   2  OCH3 
M  SBV   2  40   -0.6706    0.3872 
S  SKP  5 
ID	FL5FEAGS0025 
FORMULA	C23H20O13 
EXACTMASS	504.090390726 
AVERAGEMASS	504.3971 
SMILES	O=C(C=3OC)c(c(O)1)c(OC(c(c4)ccc(OC(O5)C(O)C(C(O)C5C(O)=O)O)c4)3)cc(O2)c(OC2)1 
M  END
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