Quercetin-3-O-Rhamnoside

Representations & DB's id
ChEBI:	None
ChEMBL:	CHEMBL2262641
PubChem:	15939939
IUPAC:	2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one
Standard InChI:	InChI=1S/C21H20O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-9(22)6-13(14)31-19(20)8-2-3-10(23)11(24)4-8/h2-7,15,17-18,21-26,28-29H,1H3/t7-,15-,17+,18+,21-/m1/s1
Standard InChI Key:	OXGUCUVFOIWWQJ-JHPRLSDPSA-N
SMILES:	Oc1cc(O)c2c(c1)oc(c(c2=O)O[C@H]1O[C@H](C)[C@H]([C@@H]([C@@H]1O)O)O)c1ccc(c(c1)O)O

Molecular propeties
AlogP:	0.49
Hydrogen bonds acceptors:	11
Hydrogen bonds donors:	7
Rotatable bonds:	3
Number of rings:	4
Molecular Weight:	448.1
Topological polar surface area:	186
Number of aromatic rings:	3
Fsp3:	0.286
Number of carbons:	21

Plant sources

Part of plant	Plant name	Ref.
Plant	Hypericum perforatum
Plant	Capsicum annuum

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.
Ki	10000 nM	Carbonic anhydrase I	P00915
Ki	6367.7 nM	Carbonic anhydrase II	P00918
Ki	67.3 nM	Carbonic anhydrase IV	P22748
Ki	3.9 nM	Carbonic anhydrase VII	P43166
Ki	43.5 nM	Carbonic anhydrase XII	O43570