Mol:FL3FGCNS0011

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FL3FGCNS0011.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
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  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
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  2 25  1  0  0  0  0
 25 26  1  0  0  0  0
 15 27  1  0  0  0  0
 27 28  1  0  0  0  0
M  STY  1   5 SUP
M  SLB  1   5   5
M  SAL   5  2  27  28
M  SBL   5  1  29
M  SMT   5  OCH3
M  SVB   5 29     2.241    1.0925
M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  25  26
M  SBL   4  1  27
M  SMT   4  OCH3
M  SVB   4 27   -2.9555   -0.7614
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  23  24
M  SBL   3  1  25
M  SMT   3  OCH3
M  SVB   3 25   -2.5983    0.4082
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  21  22
M  SBL   2  1  23
M  SMT   2  OCH3
M  SVB   2 23   -1.4067    0.6837
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  19  20
M  SBL   1  1  21
M  SMT   1  OCH3
M  SVB   1 21   -2.1212   -1.3346
S  SKP  8
ID	FL3FGCNS0011
KNApSAcK_ID	C00003935
NAME	3'-Hydroxy-5,6,7,8,4'-pentamethoxyflavone
CAS_RN	112448-39-2
FORMULA	C20H20O8
EXACTMASS	388.11581761599996
AVERAGEMASS	388.368
SMILES	O(C)c(c21)c(c(c(OC)c(C(=O)C=C(c(c3)cc(O)c(OC)c3)O2)1)OC)OC
M  END

</pre>

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