54542-51-7

Name QUERCETIN-3-O-BETA-D-GLUCOPYRANOSYL-6''-ACETATE
CAS 54542-51-7
Molecular Formula C23H22O13
MDL Number MFCD00145197
Molecular Weight 506.41
MOL File 54542-51-7.mol
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Chemical Properties

Boiling point  848.3±65.0 °C(Predicted)
density  1.77±0.1 g/cm3(Predicted)
pka 6.17±0.40(Predicted)
InChIKey IGLUNMMNDNWZOA-JTQQIHAQNA-N
SMILES C1(OC2=C(C(O)=CC(O)=C2)C(=O)C=1O[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](COC(=O)C)O1)O)C1C=CC(O)=C(O)C=1 |&1:14,15,17,18,20,r|
LogP 2.110 (est)

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