Mol:FL5FALNS0015

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Copyright: ARM project http://www.metabolome.jp/
 28 30  0  0  0  0  0  0  0  0999 V2000
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   -0.1944    0.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7507    0.4379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7507   -1.3476    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3617    0.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3617    1.0925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2052    1.4197    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6716   -1.0256    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5377   -1.5255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2998   -1.0073    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
 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
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  3 21  1  0  0  0  0
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  1 23  1  0  0  0  0
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 25 26  1  0  0  0  0
 14 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    1.7052    0.2316
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    2.0624    1.4197
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   -2.7769    0.7355
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   -2.2998   -1.0073
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    0.0044   -0.7319
S  SKP  8
ID	FL5FALNS0015
KNApSAcK_ID	C00004756
NAME	2'-Hydroxy-3,5,7,4',5'-pentamethoxyflavone
CAS_RN	72947-61-6
FORMULA	C20H20O8
EXACTMASS	388.11581761599996
AVERAGEMASS	388.368
SMILES	c(c1OC)(C3=O)c(OC(=C3OC)c(c2)c(cc(OC)c(OC)2)O)cc(c1)OC
M  END

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