Mol:FL5FAAGS0031

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Copyright: ARM project http://www.metabolome.jp/
 44 48  0  0  0  0  0  0  0  0999 V2000
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  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
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  8  9  2  0  0  0  0
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  1 19  1  0  0  0  0
 15 20  1  0  0  0  0
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 23 24  1  1  0  0  0
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  8 21  1  0  0  0  0
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 34 33  1  1  0  0  0
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 42 43  2  0  0  0  0
 42 44  1  0  0  0  0
 25 42  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  40  41
M  SBL   1  1  45
M  SMT   1 ^ CH2OH
M  SBV   1  45    0.4005   -0.5023
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  3  42  43  44
M  SBL   2  1  48
M  SMT   2  COOH
M  SBV   2  48   -0.8770    0.4896
S  SKP  5
ID	FL5FAAGS0031
FORMULA	C27H28O17
EXACTMASS	624.1326494699999
AVERAGEMASS	624.50102
SMILES	C(C(O)5)(OC(CO)C(O)C5O)Oc(c4)cc(c(c34)C(C(=C(O3)c(c2)ccc(c2)O)OC(O1)C(C(C(C1C(O)=O)O)O)O)=O)O
M  END

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