Mol:FL7AAAGL0034

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FL7AAAGL0034.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
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 22 20  1  0  0  0  0
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 34 33  1  1  0  0  0
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 57 58  2  0  0  0  0
 57 59  1  0  0  0  0
 54 57  1  0  0  0  0
M  CHG  1  10   1
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  55  56
M  SBL   1  1  61
M  SMT   1 ^ CH2OH
M  SBV   1  61    0.5236   -0.5765
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  3  57  58  59
M  SBL   2  1  64
M  SMT   2  COOH
M  SBV   2  64   -0.3942   -0.2117
S  SKP  5
ID	FL7AAAGL0034
FORMULA	C39H39O20
EXACTMASS	827.2034686879999
AVERAGEMASS	827.71496
SMILES	C(O)(=O)CC(OC(C(CO)1)C(C(C(Oc(c2)c(c3)c([o+1]c(c(c6)ccc(c6)O)c3OC(O4)C(C(C(O)C4COC(C=Cc(c5)ccc(O)c5)=O)O)O)cc2O)O1)O)O)=O
M  END

</pre>

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