Mol:FL5FGGNS0005

<pre>

Copyright: ARM project http://www.metabolome.jp/
 30 32  0  0  0  0  0  0  0  0999 V2000
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   -0.3262   -1.9881    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9306   -3.9334    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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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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  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  3 18  1  0  0  0  0
 14 19  1  0  0  0  0
 16 20  1  0  0  0  0
 15 21  1  0  0  0  0
 21 22  1  0  0  0  0
  8 23  1  0  0  0  0
 23 24  1  0  0  0  0
  1 25  1  0  0  0  0
 25 26  1  0  0  0  0
  2 27  1  0  0  0  0
 27 28  1  0  0  0  0
  6 29  1  0  0  0  0
 29 30  1  0  0  0  0
M  STY  1   5 SUP
M  SLB  1   5   5
M  SAL   5  2  29  30
M  SBL   5  1  31
M  SMT   5  OCH3
M  SVB   5 31   -1.4067    0.7182
M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  27  28
M  SBL   4  1  29
M  SMT   4  OCH3
M  SVB   4 29   -2.9555   -0.7269
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  25  26
M  SBL   3  1  27
M  SMT   3  OCH3
M  SVB   3 27   -2.5983    0.4428
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  23  24
M  SBL   2  1  25
M  SMT   2  OCH3
M  SVB   2 25     0.183   -1.0246
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  21  22
M  SBL   1  1  23
M  SMT   1  OCH3
M  SVB   1 23     2.241     1.127
S  SKP  8
ID	FL5FGGNS0005
KNApSAcK_ID	C00004862
NAME	5,3',5'-Trihydroxy-3,6,7,8,4'-pentamethoxyflavone
CAS_RN	78516-77-5
FORMULA	C20H20O10
EXACTMASS	420.10564686
AVERAGEMASS	420.3668
SMILES	O(C)c(c31)c(c(c(c1C(C(OC)=C(O3)c(c2)cc(O)c(c(O)2)OC)=O)O)OC)OC
M  END

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