Mol:FL5FELGS0001

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  30  31 
M  SBL   5  1  33 
M  SMT   5  CH2OH 
M  SVB   5 33    3.7328   -0.1727 
M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  38  39 
M  SBL   4  1  41 
M  SMT   4  OCH3 
M  SVB   4 41   -3.6627   -0.6929 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  36  37 
M  SBL   3  1  39 
M  SMT   3  OCH3 
M  SVB   3 39   -3.7426    0.7069 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  34  35 
M  SBL   2  1  37 
M  SMT   2  OCH3 
M  SVB   2 37   -0.7626   -0.7236 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  32  33 
M  SBL   1  1  35 
M  SMT   1  OCH3 
M  SVB   1 35    1.5042    1.4806 
S  SKP  8 
ID	FL5FELGS0001 
KNApSAcK_ID	C00005788 
NAME	5,2',5'-Trihydroxy-3,6,7,4'-tetramethoxyflavone 5'-glucoside 
CAS_RN	71827-15-1 
FORMULA	C25H28O14 
EXACTMASS	552.147905604 
AVERAGEMASS	552.4814200000001 
SMILES	c(c12)(O)c(OC)c(cc1OC(c(c(O)3)cc(O[C@@H](C4O)O[C@@H]([C@H](O)C4O)CO)c(c3)OC)=C(C2=O)OC)OC 
M  END