Mol:FLIE1CNF0001

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FLIE1CNF0001.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 24 29  0  0  0  0  0  0  0  0999 V2000
   -2.0196    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2056    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3507    1.1574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9512   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3565    0.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3449   -0.8138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6044   -1.0262    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0081   -0.4706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6044    0.0850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6306    1.0347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0081    0.5150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6306   -0.0046    0.0000 C   0  0  0  0  0  0  0  0  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
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 11  2  0  0  0  0
  7 17  1  0  0  0  0
  1  2  1  0  0  0  0
 12 17  1  0  0  0  0
  9 18  2  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 15  1  0  0  0  0
  1 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24  2  1  0  0  0  0
S  SKP  8
ID	FLIE1CNF0001
KNApSAcK_ID	C00009773
NAME	Erosnin;Erosnine;Erosinin
CAS_RN	3736-83-2
FORMULA	C18H8O6
EXACTMASS	320.032087988
AVERAGEMASS	320.25252
SMILES	O(C3=O)c(c2c(o4)c3c(c6)c(cc(c65)OCO5)4)cc(c(c2)1)occ1
M  END

</pre>

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