General
Preferred name
Rubiadin
Synonyms
1,3-Dihydroxy-2-Methylanthracene-9,10-Dione ()
P&D ID
PD018091
CAS
117-02-2
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 Rubiadin is a dihydroxy anthraquinone isolated from Rubia cordifolia. Rubiadin has a potent antixidant activity[1].
PRICE 157
DESCRIPTION Rubiadin (1,3-Dihydroxy-2-Methylanthracene-9,10-Dione) possesses potent antioxidant property, it can prevent lipid peroxidation induced by FeSO4 and t-butylhydroperoxide (t-BHP) in a dose dependent manner. (TargetMol Bioactive Compound Library)
Cell lines
3
Organisms
0
Compound Sets
4
Cayman Chemical Bioactives
11753
MedChem Express Bioactive Compound Library
HY-N0444
Selleckchem Bioactive Compound Library
rubiadin
TargetMol Bioactive Compound Library
T4241
External IDs
27
Properties
(calculated by RDKit )
Molecular Weight
254.06
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
2
Rotatable Bonds
0
Ring Count
3
Aromatic Ring Count
2
cLogP
2.18
TPSA
74.6
Fraction CSP3
0.07
Chiral centers
0.0
Largest ring
6.0
QED
0.64
Structural alerts
1
quinone_A(370)
[!#6&!#1]=[#6]1[#6]=,:[#6][#6](=[!#6&!#1])[#6]=,:[#6]1
PAINS Family A
Custom attributes
(extracted from source data)
Target
caspase-3
Free radical scavengers
PARP cleavage
antioxidant
MOA
Apoptosis inducer
Pathway
Apoptosis
Chromatin/Epigenetic
DNA Damage/DNA Repair
oxidation-reduction
Proteases/Proteasome
Source data