Mol:FLIACENS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 23 25  0  0  0  0  0  0  0  0999 V2000 
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    3.4203   -1.8252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  2  3  2  0  0  0  0 
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  6  1  2  0  0  0  0 
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  8  9  2  0  0  0  0 
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 14 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
  1 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  22  23 
M  SBL   2  1  24 
M  SMT   2  OCH3 
M  SVB   2 24   -2.6398    1.4439 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  20  21 
M  SBL   1  1  22 
M  SMT   1  OCH3 
M  SVB   1 22    1.9253   -1.0314 
S  SKP  8 
ID	FLIACENS0001 
KNApSAcK_ID	C00009817 
NAME	5,3'-Dihydroxy-7,4'-dimethoxyisoflavone 
CAS_RN	83459-56-7 
FORMULA	C17H14O6 
EXACTMASS	314.07903818 
AVERAGEMASS	314.28945999999996 
SMILES	COc(c3)cc(O2)c(c(O)3)C(=O)C(=C2)c(c1)cc(O)c(OC)c1 
M  END