Mol:FL5FFCNS0034

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FL5FFCNS0034.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 25 27  0  0  0  0  0  0  0  0999 V2000 
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    2.5006    1.6498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7861    2.0623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0716    1.6498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3571   -1.6505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.0718   -0.8255    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7861   -1.6505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0718   -1.5550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2150    2.0623    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7861    1.6495    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4994   -2.0623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2139    0.4130    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0  0  0  0 
  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 
  1  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  2  1  0  0  0  0 
  9 11  1  0  0  0  0 
 11 12  2  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  2  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 16 11  1  0  0  0  0 
  7 17  2  0  0  0  0 
  4 18  1  0  0  0  0 
  8 19  1  0  0  0  0 
  6 20  1  0  0  0  0 
 19 21  1  0  0  0  0 
 14 22  1  0  0  0  0 
  3 23  1  0  0  0  0 
 20 24  1  0  0  0  0 
 13 25  1  0  0  0  0 
S  SKP  8 
ID	FL5FFCNS0034 
KNApSAcK_ID	C00013367 
NAME	7,8,3',4'-Trihydroxy-3,5-dimethoxyflavone;2-(3,4-Dihydroxyphenyl)-7,8-dihydroxy-3,5-dimethoxy-4H-1-benzopyran-4-one 
CAS_RN	637774-70-0 
FORMULA	C17H14O8 
EXACTMASS	346.068867424 
AVERAGEMASS	346.28826 
SMILES	COc(c1)c(C(=O)2)c(OC(c(c3)cc(O)c(O)c3)=C(OC)2)c(O)c(O)1 
M  END
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