General
Preferred name
FRAXETIN
Synonyms
7,8-dihydroxy-6-methoxy coumarin ()
P&D ID
PD056320
CAS
574-84-5
Tags
natural product
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 Fraxetin isolated from the bark of Fraxinus brngeana DC. It has protective against rotenone-induced cytotoxicity and apoptotic death. (BOC Sciences Bioactive Compounds)
Cell lines
2
Organisms
0
Compound Sets
6
AdooQ Bioactive Compound Library
BOC Sciences Bioactive Compounds
Cayman Chemical Bioactives
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
24
Properties
(calculated by RDKit )
Molecular Weight
208.04
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
2
Rotatable Bonds
1
Ring Count
2
Aromatic Ring Count
2
cLogP
1.21
TPSA
79.9
Fraction CSP3
0.1
Chiral centers
0.0
Largest ring
6.0
QED
0.54
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
MOA
human carbonic anhydrase 9?
Pathway
Apoptosis
Solubility
Soluble in DMSO (Slightly), Methanol (Slightly)
Target
Heme Oxygenase
Source data