Mol:FL5FDDNI0005

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FL5FDDNI0005.png

 
 
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 30 32  0  0  0  0  0  0  0  0999 V2000 
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    0.2621   -0.3209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2942    0.0002    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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    2.9522    0.6548    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4068    0.6424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   -1.9629    1.6055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.1281   -1.4633    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.6686    1.5583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1099    2.4556    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 
  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 
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 27 28  1  0  0  0  0 
 16 29  1  0  0  0  0 
 29 30  1  0  0  0  0 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  29  30 
M  SBL   3  1  31 
M  SMT   3  OCH3 
M  SVB   3 31    1.6686    1.5583 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  27  28 
M  SBL   2  1  29 
M  SMT   2  OCH3 
M  SVB   2 29    0.4724   -1.1483 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  25  26 
M  SBL   1  1  27 
M  SMT   1  OCH3 
M  SVB   1 27   -2.3203    0.2978 
S  SKP  8 
ID	FL5FDDNI0005 
KNApSAcK_ID	C00005027 
NAME	5,4'-Dihydroxy-3,7,3'-trimethoxy-8-prenylflavone 
CAS_RN	40073-85-6 
FORMULA	C23H24O7 
EXACTMASS	412.152203122 
AVERAGEMASS	412.43246 
SMILES	O=C(c23)C(OC)=C(Oc2c(c(OC)cc(O)3)CC=C(C)C)c(c1)cc(OC)c(O)c1 
M  END
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