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Compound Detail

CHEMBL480100

E-RESVERATROLOSIDE
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OC[C@H]1O[C@@H](Oc2ccc(/C=C/c3cc(O)cc(O)c3)cc2O)[C@H](O)[C@@H](O)[C@@H]1O

Basic Information

ChEMBL ID CHEMBL480100
Name E-RESVERATROLOSIDE
Phase Preclinical
Structure Type MOL
InChI Key OLCVEOSSVCAFGR-CUYWLFDKSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

406.4
MW (Da)
0.15
ALogP
9
HBA
7
HBD
160.1
PSA (Ų)
0.34
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C20H22O9
MW 406.39
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness 1.79

Activity Summary

IC50 2 meas. best 4.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
NON-PROTEIN TARGET
CHEMBL3879801
IC50 4.0 4.0 100000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
NON-PROTEIN TARGET IC50 = 100000.0 nM 4.0 Antioxidant activity against cupric ion-induced lipid peroxidation in human LDL ... 9599270

Literature References

PubMed DOI Target Context # Activities
9599270 10.1021/np9704819 Radical scavenging activity 1
9599270 10.1021/np9704819 NON-PROTEIN TARGET 1

Data from ChEMBL 36 via Core Engine