Mol:FL3FADGS0015

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Copyright: ARM project http://www.metabolome.jp/
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  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
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  1 19  1  0  0  0  0
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 24 23  1  1  0  0  0
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 20 26  1  0  0  0  0
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 23 41  1  0  0  0  0
 34 43  1  0  0  0  0
 43 44  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  39  40
M  SBL   1  1  44
M  SMT   1  OCH3
M  SBV   1  44   -0.3573   -0.8474
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  41  42
M  SBL   2  1  46
M  SMT   2  CH2OH
M  SBV   2  46   -0.6607    0.3487
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  43  44
M  SBL   3  1  47
M  SMT   3 ^ CH2OH
M  SBV   3  47    0.2405   -1.3599
S  SKP  5
ID	FL3FADGS0015
FORMULA	C28H32O16
EXACTMASS	624.1690349759999
AVERAGEMASS	624.54408
SMILES	OC(C5O)C(CO)OC(C5O)Oc(c4)cc(O1)c(c4O)C(C=C(c(c3)ccc(c(OC)3)OC(C(O)2)OC(C(C2O)O)CO)1)=O
M  END

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