Mol:FL3FAHGS0002

<pre>

Copyright: ARM project http://www.metabolome.jp/
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  3 18  1  0  0  0  0
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 14 20  1  0  0  0  0
 22 23  1  1  0  0  0
 23 24  1  1  0  0  0
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 27 45  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  3  40  41  42
M  SBL   1  1  46
M  SMT   1  COOH
M  SBV   1  46   -0.7252    0.3729
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  43  44
M  SBL   2  1  48
M  SMT   2  OCH3
M  SBV   2  48    0.0000   -0.8337
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  3  45  46  47
M  SBL   3  1  51
M  SMT   3  COOH
M  SBV   3  51   -0.2951   -0.8580
S  SKP  5
ID	FL3FAHGS0002
FORMULA	C28H28O19
EXACTMASS	668.122478714
AVERAGEMASS	668.51052
SMILES	OC(C(C(O)=O)5)C(C(C(O5)Oc(c1)cc(c(C4=O)c1OC(=C4)c(c2)cc(OC)c(c2OC(C3O)OC(C(O)=O)C(O)C3O)O)O)O)O
M  END

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