Mol:FLIFWYNF0002

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FLIFWYNF0002.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 30 34  0  0  0  0  0  0  0  0999 V2000
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   -0.2033    0.5462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0865   -1.9402    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0987   -1.4252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0987   -1.4252    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  1  0  0  0  0
  8  9  2  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
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 13 14  1  0  0  0  0
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 15 16  1  0  0  0  0
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  7 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19  9  1  0  0  0  0
  1  2  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22  1  1  0  0  0  0
 21 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 19 26  1  0  0  0  0
 13 27  1  0  0  0  0
 27 28  1  0  0  0  0
 14 29  1  0  0  0  0
 29 30  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  29  30
M  SBL   2  1  33
M  SMT   2  OCH3
M  SVB   2 33    2.3356   -1.6315
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  27  28
M  SBL   1  1  31
M  SMT   1  OCH3
M  SVB   1 31    1.0865   -1.9402
S  SKP  8
ID	FLIFWYNF0002
KNApSAcK_ID	C00009603
NAME	Amorpholone
CAS_RN	57103-58-9
FORMULA	C23H20O7
EXACTMASS	408.120902994
AVERAGEMASS	408.40070000000003
SMILES	c(c5)(OC)c(cc(c54)OC(O)C(=C34)Oc(c12)c(C3=O)ccc1OC(C(C)=C)C2)OC
M  END

</pre>

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