Mol:FL5FEGNS0005

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Copyright: ARM project http://www.metabolome.jp/
 27 29  0  0  0  0  0  0  0  0999 V2000
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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
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M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  26  27
M  SBL   3  1  28
M  SMT   3  OCH3
M  SVB   3 28    1.4901    1.7424
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  24  25
M  SBL   2  1  26
M  SMT   2  OCH3
M  SVB   2 26    0.2825   -0.9854
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  22  23
M  SBL   1  1  24
M  SMT   1  OCH3
M  SVB   1 24    1.9832    -0.022
S  SKP  8
ID	FL5FEGNS0005
KNApSAcK_ID	C00004825
NAME	5,6,7,4'-Tetrahydroxy-3,3',5'-trimethoxyflavone
CAS_RN	72357-38-1
FORMULA	C18H16O9
EXACTMASS	376.07943210999997
AVERAGEMASS	376.31424
SMILES	c(c(OC)1)(c(OC)cc(C(O2)=C(C(c(c3O)c2cc(c3O)O)=O)OC)c1)O
M  END

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