General
Preferred name
Astilbin
Synonyms
Taxifolin 3-rhamnoside ()
Neoastilbin ()
Neoisoastilbin ()
Isoastilbin ()
Taxifolin 3-O-rhamnoside ()
Isoastilbin, Neoastilbin, Neoisoastilbin, Taxifolin 3-O-rhamnoside, Taxifolin 3-rhamnoside ()
P&D ID
PD087244
CAS
29838-67-3
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Astilbin is a flavonoid compound and enhances NRF2 activation. Astilbin also suppresses TNF-¦Á expression and NF-¦ÊB activation.
PRICE 64
DESCRIPTION Astilbin (Neoastilbin) is actions Flavonoid phytochemical found in St. John??s wort and Traditional Chinese Medicine herbal preparations.
DESCRIPTION Astilbin (Neoastilbin) is actions Flavonoid phytochemical found in St. John′s wort and Traditional Chinese Medicine herbal preparations. (TargetMol Bioactive Compound Library)
Compound Sets
6
Cayman Chemical Bioactives
28267
Drug Repurposing Hub
MedChem Express Bioactive Compound Library
HY-N0509
ReFrame library
Selleckchem Bioactive Compound Library
astilbin
TargetMol Bioactive Compound Library
T2794
External IDs
19
Properties
(calculated by RDKit )
Molecular Weight
450.12
Hydrogen Bond Acceptors
11
Hydrogen Bond Donors
7
Rotatable Bonds
3
Ring Count
4
Aromatic Ring Count
2
cLogP
0.04
TPSA
186.37
Fraction CSP3
0.38
Chiral centers
7.0
Largest ring
6.0
QED
0.31
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
NF-¦ÊB
NF-??
Apoptosis
Immunology/Inflammation
Target
Keap1-Nrf2
NF-κB
TNF Receptor
TNF-α
TNF-¦Á
Immunology & Inflammation related
MOA
TNF
nuclear factor erythroid derived, like (NRF2) activator
Source data