Prunin

Representations & DB's id
ChEBI:	CHEBI:28327
ChEMBL:	CHEMBL469654
PubChem:	92794
IUPAC:	(2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Standard InChI:	InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-6,14,16,18-24,26-28H,7-8H2/t14-,16+,18+,19-,20+,21+/m0/s1
Standard InChI Key:	DLIKSSGEMUFQOK-SFTVRKLSSA-N
SMILES:	OC[C@H]1O[C@@H](Oc2cc3O[C@@H](CC(=O)c3c(c2)O)c2ccc(cc2)O)[C@@H]([C@H]([C@@H]1O)O)O

Molecular propeties
AlogP:	-0.02
Hydrogen bonds acceptors:	10
Hydrogen bonds donors:	6
Rotatable bonds:	4
Number of rings:	4
Molecular Weight:	434.12
Topological polar surface area:	166
Number of aromatic rings:	2
Fsp3:	0.381
Number of carbons:	21

Plant sources

Part of plant	Plant name	Ref.
Plant	Vitis vinifera

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.