Mol:FLIAEANS0006

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FLIAEANS0006.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 23 25  0  0  0  0  0  0  0  0999 V2000 
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    2.6398   -1.3058    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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   -2.2825    1.3062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7824    2.1723    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 
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  2 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   -2.2825    1.3062 
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   -2.6398    0.1365 
S  SKP  8 
ID	FLIAEANS0006 
KNApSAcK_ID	C00009463 
NAME	7-O-Methyltectorigenin;5,4'-Dihydroxy-6,7-dimethoxyisoflavone 
CAS_RN	1096-58-8 
FORMULA	C17H14O6 
EXACTMASS	314.07903818 
AVERAGEMASS	314.28945999999996 
SMILES	COc(c1)c(OC)c(O)c(C(=O)2)c(OC=C(c(c3)ccc(O)c3)2)1 
M  END
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