Phyto4Health

Epsilon-Viniferin Glucoside

Representations & DB's id

ChEBI: None
ChEMBL: CHEMBL1082598
PubChem: 46890010
IUPAC: (2S,3R,4S,5S,6R)-2-[[(2S,3S)-3-(3,5-dihydroxyphenyl)-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Standard InChI: InChI=1S/C34H32O11/c35-16-27-30(40)31(41)32(42)34(45-27)43-25-13-19(4-1-17-2-7-21(36)8-3-17)28-26(15-25)44-33(18-5-9-22(37)10-6-18)29(28)20-11-23(38)14-24(39)12-20/h1-15,27,29-42H,16H2/b4-1+/t27-,29+,30-,31+,32-,33-,34-/m1/s1
Standard InChI Key: NHYFNLFVNSLRES-YNVKLIFMSA-N
SMILES: OC[C@H]1O[C@@H](Oc2cc(/C=C/c3ccc(cc3)O)c3c(c2)O[C@@H]([C@H]3c2cc(O)cc(c2)O)c2ccc(cc2)O)[C@@H]([C@H]([C@@H]1O)O)O

Molecular propeties

AlogP: 3.12
Hydrogen bonds acceptors: 11
Hydrogen bonds donors: 8
Rotatable bonds: 7
Number of rings: 6
Molecular Weight: 616.19
Topological polar surface area: 190
Number of aromatic rings: 4
Fsp3: 0.235
Number of carbons: 34

Plant sources

Part of plant Plant name Ref.
PlantVitis vinifera

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.