General
Preferred name
ASTAXANTHIN
Synonyms
??-Carotene-4,4'-dione ()
trans-Astaxanthin ()
AstaXin ()
AstaREAL ()
Ovoester ()
β-Carotene-4,4'-dione, trans-Astaxanthin ()
¦Â-Carotene-4,4'-dione ()
??Carotene-4,4'-dione, trans-Astaxanthin ()
¦Â-Carotene-4,4'-dione, trans-Astaxanthin ()
Bioastin ()
E161j ()
NSC-635689 ()
All-trans-astaxanthin ()
P&D ID
PD019299
CAS
472-61-7
Tags
drug candidate
nuisance
natural product
available
Drug Status
investigational
Max Phase
Phase 3
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 ]]
Cell lines
0
Organisms
1
Compound Sets
8
ChEMBL Drugs
Drug Repurposing Hub
DrugBank
MedChem Express Bioactive Compound Library
Nuisance compounds in cellular assays
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
33
Properties
(calculated by RDKit )
Molecular Weight
596.39
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
2
Rotatable Bonds
10
Ring Count
2
Aromatic Ring Count
0
cLogP
8.91
TPSA
74.6
Fraction CSP3
0.4
Chiral centers
2.0
Largest ring
6.0
QED
0.25
Structural alerts
1
Singlet oxygen quenching
Nuisance compounds in cellular assays
Related compounds
Custom attributes
(extracted from source data)
Pathway
NF-¦ÊB
Metabolism
DNA Damage/DNA Repair
Apoptosis
Cell Cycle/DNA Damage
Immunology/Inflammation
JAK/STAT Signaling
Metabolic Enzyme/Protease
NF-κB
Stem Cell/Wnt
Vitamin D Related/Nuclear Receptor
Target
PPAR??
PPAR¦Ã
Reactive Oxygen Species
STAT
MOA
PPAR
Antioxidant
Source data
