Mol:FL3FGCGS0008

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FL3FGCGS0008.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  39  40
M  SBL   1  1  43
M  SMT   1  OCH3
M  SBV   1  43   -0.4386   -0.8587
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  3  41  42  43
M  SBL   2  1  46
M  SMT   2  COOH
M  SBV   2  46   -0.8109   -1.8302
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  44  45
M  SBL   3  1  48
M  SMT   3  OCH3
M  SBV   3  48   -0.3504   -0.8078
M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  46  47
M  SBL   4  1  50
M  SMT   4 ^ OCH3
M  SBV   4  50    0.7329    0.5480
S  SKP  5
ID	FL3FGCGS0008
FORMULA	C30H34O17
EXACTMASS	666.179599662
AVERAGEMASS	666.58076
SMILES	OC(C1O)C(C(OC(Oc(c(OC)2)c(c(O)c(C4=O)c(OC(=C4)c(c3)ccc(O)c3OC)2)OC)1)COC(=O)CC(CC(O)=O)(C)O)O
M  END

</pre>

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