View source for Mol:FL3FGCGS0004

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  39  40 
M  SBL   3  1  42 
M  SMT   3  OCH3 
M  SVB   3 42    3.1301    1.8019 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  37  38 
M  SBL   2  1  40 
M  SMT   2  OCH3 
M  SVB   2 40    0.0642    1.3987 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  35  36 
M  SBL   1  1  38 
M  SMT   1  OCH3 
M  SVB   1 38   -1.3518    0.1923 
S  SKP  8 
ID	FL3FGCGS0004 
KNApSAcK_ID	C00004440 
NAME	5,7,3'-Trihydroxy-6.8,4'-trimethoxyflavone 5-(6''-acetylglucoside) 
CAS_RN	72209-43-9 
FORMULA	C26H28O14 
EXACTMASS	564.147905604 
AVERAGEMASS	564.49212 
SMILES	O=C(c23)C=C(Oc2c(c(O)c(OC)c3O[C@H](O4)[C@H]([C@@H](O)[C@@H](O)C4COC(C)=O)O)OC)c(c1)ccc(c1O)OC 
M  END