Phyto4Health

4'-O-Beta-D-Glucopyranoside

Representations & DB's id

ChEBI: None
ChEMBL: CHEMBL486596
PubChem: 14406834
IUPAC: 5,7-dihydroxy-2-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
Standard InChI: InChI=1S/C22H22O11/c1-30-15-4-9(14-7-12(26)18-11(25)5-10(24)6-16(18)31-14)2-3-13(15)32-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1
Standard InChI Key: XEZXZKDKCCSHBV-MIUGBVLSSA-N
SMILES: OC[C@H]1O[C@@H](Oc2ccc(cc2OC)c2cc(=O)c3c(o2)cc(cc3O)O)[C@@H]([C@H]([C@@H]1O)O)O

Molecular propeties

AlogP: 0.06
Hydrogen bonds acceptors: 11
Hydrogen bonds donors: 6
Rotatable bonds: 5
Number of rings: 4
Molecular Weight: 462.12
Topological polar surface area: 175
Number of aromatic rings: 3
Fsp3: 0.318
Number of carbons: 22

Plant sources

Part of plant Plant name Ref.
PlantEucalyptus australiana

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.