Mol:FL5FGGGS0001

Latest revision as of 09:00, 14 March 2009

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   5 SUP 
M  SLB  1   5   5 
M  SAL   5  2  39  40 
M  SBL   5  1  42 
M  SMT   5  CH2OH 
M  SVB   5 42      3.31   -0.2689 
M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  37  38 
M  SBL   4  1  40 
M  SMT   4  OCH3 
M  SVB   4 40    -0.886   -1.0246 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  35  36 
M  SBL   3  1  38 
M  SMT   3  OCH3 
M  SVB   3 38   -4.0245   -0.7269 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  33  34 
M  SBL   2  1  36 
M  SMT   2  OCH3 
M  SVB   2 36    1.1894    1.1187 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  31  32 
M  SBL   1  1  34 
M  SMT   1  OCH3 
M  SVB   1 34   -2.4757    0.7182 
S  SKP  8 
ID	FL5FGGGS0001 
KNApSAcK_ID	C00005797 
NAME	5,7,3',5'-Tetrahydroxy-3,6,8,4'-tetramethoxyflavone 3'-glucoside 
CAS_RN	101021-27-6 
FORMULA	C25H28O15 
EXACTMASS	568.1428202259999 
AVERAGEMASS	568.48082 
SMILES	c(OC)(c4O)c(O)c(OC)c(c34)OC(=C(OC)C3=O)c(c1)cc(c(c1O[C@@H](C2O)O[C@@H]([C@H](O)C2O)CO)OC)O 
M  END