Mol:FL5FECGS0012

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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  9 12  1  0  0  0  0 
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  8 19  1  0  0  0  0 
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M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  34  35 
M  SBL   2  1  37 
M  SMT   2  CH2OH 
M  SVB   2 37   -3.1754    0.5881 
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    3.0759    1.7424 
S  SKP  8 
ID	FL5FECGS0012 
KNApSAcK_ID	C00005654 
NAME	Quercetagetin 3'-methyl ether 7-glucoside 
CAS_RN	29741-08-0 
FORMULA	C22H22O13 
EXACTMASS	494.10604078999995 
AVERAGEMASS	494.40228 
SMILES	O(c(c1)c(O)ccc1C(O4)=C(O)C(=O)c(c43)c(O)c(O)c(c3)O[C@@H]([C@@H](O)2)OC(CO)[C@@H]([C@@H]2O)O)C 
M  END