Quercimeritrin

Representations & DB's id
ChEBI:	CHEBI:28529
ChEMBL:	CHEMBL248726
PubChem:	5282160
IUPAC:	2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Standard InChI:	InChI=1S/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)31-8-4-11(25)14-12(5-8)32-20(18(29)16(14)27)7-1-2-9(23)10(24)3-7/h1-5,13,15,17,19,21-26,28-30H,6H2/t13-,15-,17+,19-,21-/m1/s1
Standard InChI Key:	BBFYUPYFXSSMNV-HMGRVEAOSA-N
SMILES:	OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(c(c3=O)O)c2ccc(c(c2)O)O)[C@@H]([C@H]([C@@H]1O)O)O

Molecular propeties
AlogP:	-0.54
Hydrogen bonds acceptors:	12
Hydrogen bonds donors:	8
Rotatable bonds:	4
Number of rings:	4
Molecular Weight:	464.1
Topological polar surface area:	207
Number of aromatic rings:	3
Fsp3:	0.286
Number of carbons:	21

Plant sources

Part of plant	Plant name	Ref.
Plant	Ononis spinosa
Plant	Valeriana officinalis

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.