Mol:FL3FACGS0016

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Copyright: ARM project http://www.metabolome.jp/
 33 36  0  0  0  0  0  0  0  0999 V2000
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  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  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
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 18  1  1  0  0  0  0
  3 19  1  0  0  0  0
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 31 32  2  0  0  0  0
 31 33  1  0  0  0  0
 26 31  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   -0.0573   -0.6588
S  SKP  5
ID	FL3FACGS0016
FORMULA	C21H18O12
EXACTMASS	462.07982604
AVERAGEMASS	462.36042
SMILES	C(C(C(O)=O)1)(O)C(C(C(Oc(c(O)4)cc(cc4)C(=C2)Oc(c3)c(c(cc(O)3)O)C(=O)2)O1)O)O
M  END

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