Mol:FL5FEANS0014

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FL5FEANS0014.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 27  0  0  0  0  0  0  0  0999 V2000
   -1.9630    0.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9630   -0.5256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2941   -1.3476    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3202    0.7355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8201    1.6016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8431   -1.0073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1286   -1.4198    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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  2 18  1  0  0  0  0
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  1 22  1  0  0  0  0
 22 23  1  0  0  0  0
  3 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  24  25
M  SBL   3  1  26
M  SMT   3  OCH3
M  SVB   3 26   -1.8431   -1.0073
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   -2.3202    0.7355
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    0.4611   -0.7319
S  SKP  8
ID	FL5FEANS0014
KNApSAcK_ID	C00004602
NAME	6-Hydroxykaempferol 3,5,7-trimethyl ether
CAS_RN	154662-03-0
FORMULA	C18H16O7
EXACTMASS	344.089602866
AVERAGEMASS	344.31543999999997
SMILES	c(c3OC)c(O1)c(c(c3O)OC)C(C(=C1c(c2)ccc(O)c2)OC)=O
M  END

</pre>

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