General
Preferred name
CANTHAXANTHIN
Synonyms
CANTHAXANTHIN (euglenanone) ()
E 161g ()
all-trans-Canthaxanthin ()
E161g ()
P&D ID
PD001235
CAS
514-78-3
Tags
drug candidate
natural product
available
Drug Status
withdrawn
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
4
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
28
Properties
(calculated by RDKit )
Molecular Weight
564.4
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
10
Ring Count
2
Aromatic Ring Count
0
cLogP
10.96
TPSA
34.14
Fraction CSP3
0.4
Chiral centers
0.0
Largest ring
6.0
QED
0.25
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
NF-¦ÊB
Immunology/Inflammation
Metabolic Enzyme/Protease
NF-κB
ATC
V
Toxicity type
opthalmic
Target
Endogenous Metabolite
Reactive Oxygen Species
Source data
