Mol:FL5FECGL0013

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  30  31 
M  SBL   4  1  33 
M  SMT   4  CH2OH 
M  SVB   4 33    2.8858   -1.3752 
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    1.5963    1.2114 
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   -3.6002   -0.6425 
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    0.7459    1.7877 
S  SKP  8 
ID	FL5FECGL0013 
KNApSAcK_ID	C00005680 
NAME	Quercetagetin 6,3',4'-trimethyl ether 3-glucoside 
CAS_RN	144599-13-3 
FORMULA	C24H26O13 
EXACTMASS	522.137340918 
AVERAGEMASS	522.45544 
SMILES	OC([C@@H]1OC(C(=O)2)=C(c(c4)cc(OC)c(OC)c4)Oc(c3)c(c(c(OC)c(O)3)O)2)C([C@@H](O)[C@@H](CO)O1)O 
M  END