Mol:FL5FECNS0005

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FL5FECNS0005.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 24 26  0  0  0  0  0  0  0  0999 V2000
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    1.4645    1.7816    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5983    1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5983   -0.7269    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8838   -1.1394    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
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  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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 17 12  1  0  0  0  0
  8 18  1  0  0  0  0
  1 19  1  0  0  0  0
  3 20  1  0  0  0  0
 16 21  1  0  0  0  0
 15 22  1  0  0  0  0
  2 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  23  24
M  SBL   1  1  25
M  SMT   1 ^OCH3
M  SBV   1 25   -7.2141    3.4423
S  SKP  8
ID	FL5FECNS0005
KNApSAcK_ID	C00004680
NAME	Patuletin;3,5,7,3',4'-Pentahydroxy-6-methoxyflavone;6-Methoxyquercetin;2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-6-methoxy-4H-1-benzopyran-4-one
CAS_RN	519-96-0
FORMULA	C16H12O8
EXACTMASS	332.05321735999996
AVERAGEMASS	332.26168
SMILES	COc(c(O)3)c(O)c(C(=O)1)c(c3)OC(c(c2)cc(O)c(O)c2)=C(O)1
M  END

</pre>

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