Mol:FL5F1CNS0005

Revision as of 09:00, 7 October 2008

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Copyright: ARM project http://www.metabolome.jp/
 24 26  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
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  8  9  2  0  0  0  0
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 23 24  1  0  0  0  0
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    2.0624    1.0956
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     1.212    1.6718
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   -2.7769    0.4113
S  SKP  8
ID	FL5F1CNS0005
KNApSAcK_ID	C00004583
NAME	Fisetin 7,3',4'-trimethyl ether
CAS_RN	58544-90-4
FORMULA	C18H16O6
EXACTMASS	328.094688244
AVERAGEMASS	328.31604
SMILES	O(c23)C(=C(C(c2ccc(OC)c3)=O)O)c(c1)cc(OC)c(OC)c1
M  END

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