Mol:FLIF1LNF0001

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Copyright: ARM project http://www.metabolome.jp/
 32 36  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
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  8 11  1  0  0  0  0
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 14  9  1  0  0  0  0
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  7 19  2  0  0  0  0
  6 20  1  0  0  0  0
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 21 22  1  0  0  0  0
 22  1  1  0  0  0  0
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  9 27  1  1  0  0  0
  8 28  1  1  0  0  0
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 29 30  1  0  0  0  0
 16 31  1  0  0  0  0
 31 32  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  31  32
M  SBL   2  1  35
M  SMT   2  OCH3
M  SVB   2 35    1.0922   -1.7324
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  29  30
M  SBL   1  1  33
M  SMT   1  OCH3
M  SVB   1 33    2.4192   -2.1046
S  SKP  8
ID	FLIF1LNF0001
KNApSAcK_ID	C00002568
NAME	Rotenone;Tubotoxin;Nicouline
CAS_RN	83-79-4
FORMULA	C23H22O6
EXACTMASS	394.141638436
AVERAGEMASS	394.41718000000003
SMILES	[C@]([H])(C5)(Oc(c45)ccc(c41)C([C@@](c32)([C@@](COc2cc(c(c3)OC)OC)(O1)[H])[H])=O)C(C)=C
M  END

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