Syringaresinol

Representations & DB's id
ChEBI:	CHEBI:47
ChEMBL:	CHEMBL361362
PubChem:	443023
IUPAC:	4-[(3S,3aR,6S,6aR)-6-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2,6-dimethoxyphenol
Standard InChI:	InChI=1S/C22H26O8/c1-25-15-5-11(6-16(26-2)19(15)23)21-13-9-30-22(14(13)10-29-21)12-7-17(27-3)20(24)18(8-12)28-4/h5-8,13-14,21-24H,9-10H2,1-4H3/t13-,14-,21+,22+/m0/s1
Standard InChI Key:	KOWMJRJXZMEZLD-HCIHMXRSSA-N
SMILES:	COc1cc(cc(c1O)OC)[C@H]1OC[C@H]2[C@@H]1CO[C@@H]2c1cc(OC)c(c(c1)OC)O

Molecular propeties
AlogP:	3.21
Hydrogen bonds acceptors:	8
Hydrogen bonds donors:	2
Rotatable bonds:	6
Number of rings:	4
Molecular Weight:	418.16
Topological polar surface area:	95.8
Number of aromatic rings:	2
Fsp3:	0.455
Number of carbons:	22

Plant sources

Part of plant	Plant name	Ref.
Plant	Punica granatum
Plant	Ungernia victoris

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.
IC50	15010 nM	Protein-tyrosine phosphatase 1B	P18031
Kd	1730000 nM	Forkhead box protein O3	O43524
EC50	18110 nM	Peroxisome proliferator-activated receptor delta	Q03181
Kd	27620 nM	Peroxisome proliferator-activated receptor delta	Q03181