Mol:FL5FFCGS0002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 35 38  0  0  0  0  0  0  0  0999 V2000 
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    0.3306    1.3682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.8397   -3.6284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  5  6  1  0  0  0  0 
  6  1  2  0  0  0  0 
  4  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
  9 10  1  0  0  0  0 
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  7 11  2  0  0  0  0 
  9 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
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 15 16  1  0  0  0  0 
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 24 28  1  0  0  0  0 
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 23 22  1  1  0  0  0 
 15 29  1  0  0  0  0 
  3 30  1  0  0  0  0 
 16 31  1  0  0  0  0 
  6 32  1  0  0  0  0 
 33 34  2  0  0  0  0 
 33 35  1  0  0  0  0 
 23 33  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  3  33  34  35 
M  SBL   1  1  38 
M  SMT   1  COOH 
M  SBV   1  38   -0.2002    1.1775 
S  SKP  5 
ID	FL5FFCGS0002 
FORMULA	C21H18O14 
EXACTMASS	494.06965528399996 
AVERAGEMASS	494.35922 
SMILES	C(C(C(O)=O)1)(O)C(C(C(OC(=C3c(c4)cc(c(O)c4)O)C(c(c2O3)c(cc(c2O)O)O)=O)O1)O)O 
M  END