Mol:FLIACAGS0002

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FLIACAGS0002.png

 
 
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 32 35  0  0  0  0  0  0  0  0999 V2000 
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   -3.3010    0.1431    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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  7  8  1  0  0  0  0 
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M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  31  32 
M  SBL   2  1  34 
M  SMT   2  CH2OH 
M  SVB   2 34   -2.2572   -0.1573 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  29  30 
M  SBL   1  1  32 
M  SMT   1  OCH3 
M  SVB   1 32   -1.4944    1.7255 
S  SKP  8 
ID	FLIACAGS0002 
KNApSAcK_ID	C00010167 
NAME	Prunetin 5-O-glucoside;Prunetinoside 
CAS_RN	89595-66-4 
FORMULA	C22H22O10 
EXACTMASS	446.121296924 
AVERAGEMASS	446.40408 
SMILES	[C@@H](Oc(c32)cc(OC)cc(OC=C(c(c4)ccc(c4)O)C3=O)2)([C@@H](O)1)OC(CO)[C@@H]([C@@H]1O)O 
M  END
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