General
Preferred name
CASTICIN
Synonyms
Quercetagetin 3,6,7,4'-Tetramethyl Ether ()
Vitexicarpin ()
P&D ID
PD043667
CAS
479-91-4
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 Casticin is a methyoxylated flavonol isolated from Vitex rotundifolia, with antimitotic and anti-inflammatory effect. Casticin inhibits the activation of STAT3.
PRICE 94
DESCRIPTION 1. Casticin (Vitexicarpin) can significantly reduce vascular inflammation, through inhibition of ROS-NF-??B pathway in vascular endothelial cells. 2. Casticin may become a potential leading drug in the therapy of prostate carcinoma.
DESCRIPTION 1. Casticin (Vitexicarpin) can significantly reduce vascular inflammation, through inhibition of ROS-NF-κB pathway in vascular endothelial cells. 2. Casticin may become a potential leading drug in the therapy of prostate carcinoma. (TargetMol Bioactive Compound Library)
Cell lines
2
Organisms
0
Compound Sets
4
Cayman Chemical Bioactives
16976
MedChem Express Bioactive Compound Library
HY-N0516
Selleckchem Bioactive Compound Library
casticin
TargetMol Bioactive Compound Library
T6S1373
External IDs
26
Properties
(calculated by RDKit )
Molecular Weight
374.1
Hydrogen Bond Acceptors
8
Hydrogen Bond Donors
2
Rotatable Bonds
5
Ring Count
3
Aromatic Ring Count
3
cLogP
2.91
TPSA
107.59
Fraction CSP3
0.21
Chiral centers
0.0
Largest ring
6.0
QED
0.7
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
STAT
STAT3
Immunology & Inflammation related
Pathway
JAK/STAT Signaling
Stem Cells
Stem Cell/Wnt
Source data