Mol:FL5FECGL0008

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FL5FECGL0008.png

 
 
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M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  32  33 
M  SBL   2  1  35 
M  SMT   2  CH2OH 
M  SVB   2 35    2.8066   -1.4143 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  34  35 
M  SBL   1  1  37 
M  SMT   1  OCH3 
M  SVB   1 37   -3.3222     0.488 
S  SKP  8 
ID	FL5FECGL0008 
KNApSAcK_ID	C00005651 
NAME	Quercetagetin 7-methyl ether 3-glucoside 
CAS_RN	65180-49-6 
FORMULA	C22H22O13 
EXACTMASS	494.10604078999995 
AVERAGEMASS	494.40228 
SMILES	C(O[C@H](O4)C(O)C([C@H]([C@@H](CO)4)O)O)(=C(c(c3)cc(c(O)c3)O)2)C(=O)c(c(O)1)c(O2)cc(OC)c(O)1 
M  END
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