Mol:FLIAEANS0008

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FLIAEANS0008.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 24 27  0  0  0  0  0  0  0  0999 V2000
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    3.7361   -1.6763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8470   -0.1502    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1326   -0.5627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
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  9 10  1  0  0  0  0
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  8 11  1  0  0  0  0
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  3 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  23  24
M  SBL   2  1  26
M  SMT   2  OCH3
M  SVB   2 26    -1.847   -0.1502
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  21  22
M  SBL   1  1  24
M  SMT   1  OCH3
M  SVB   1 24    2.2409   -0.8826
S  SKP  8
ID	FLIAEANS0008
KNApSAcK_ID	C00009468
NAME	Irisolone methyl ether;5,4'-Dimethoxy-6,7-methylenedioxyisoflavone
CAS_RN	3405-76-3
FORMULA	C18H14O6
EXACTMASS	326.07903818
AVERAGEMASS	326.30016
SMILES	c(c34)c(c1c(c3OCO4)OC)OC=C(c(c2)ccc(OC)c2)C1=O
M  END

</pre>

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