Mol:FL5FCCNS0001

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FL5FCCNS0001.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 23 25  0  0  0  0  0  0  0  0999 V2000 
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   -0.3935   -1.6403    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7189    0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.2859    1.1271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7189    0.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7189   -1.1394    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.2859    1.7816    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4197    1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4197    0.4428    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9197    1.3088    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 
 10  5  1  0  0  0  0 
  7 11  2  0  0  0  0 
  9 12  1  0  0  0  0 
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 14 15  2  0  0  0  0 
 15 16  1  0  0  0  0 
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  8 18  1  0  0  0  0 
  3 19  1  0  0  0  0 
 16 20  1  0  0  0  0 
 15 21  1  0  0  0  0 
  1 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  22  23 
M  SBL   1  1  24 
M  SMT   1  OCH3 
M  SVB   1 24   -2.4197    0.4428 
S  SKP  8 
ID	FL5FCCNS0001 
KNApSAcK_ID	C00004634 
NAME	Rhamnetin;3,5,3',4'-Tetrahydroxy-7-methoxyflavone;7-Methoxyquercetin;2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-7-methoxy-4H-1- benzopyran-4-one 
CAS_RN	90-19-7 
FORMULA	C16H12O7 
EXACTMASS	316.058302738 
AVERAGEMASS	316.26228000000003 
SMILES	COc(c3)cc(O1)c(c(O)3)C(=O)C(O)=C1c(c2)cc(O)c(O)c2 
M  END
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