Mol:FL5FGANI0002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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  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 
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M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  31  32 
M  SBL   3  1  33 
M  SMT   3  OCH3 
M  SVB   3 33    2.7178    1.1426 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  29  30 
M  SBL   2  1  31 
M  SMT   2  OCH3 
M  SVB   2 31    0.6598    -1.009 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  27  28 
M  SBL   1  1  29 
M  SMT   1  OCH3 
M  SVB   1 29   -2.4787   -0.7113 
S  SKP  8 
ID	FL5FGANI0002 
KNApSAcK_ID	C00004934 
NAME	5,7,8-Trihydroxy-3,6,4'-trimethoxy-flavone 8-isovalerate 
CAS_RN	142609-03-8 
FORMULA	C23H24O9 
EXACTMASS	444.14203236599997 
AVERAGEMASS	444.43126 
SMILES	O(C)c(c3)ccc(c3)C(O2)=C(OC)C(=O)c(c21)c(O)c(c(c1OC(CC(C)C)=O)O)OC 
M  END