General
Preferred name
ISOQUERCETIN
Synonyms
Hirsutrin ()
3-Glucosylquercetin ()
Quercetin 3-o-glucopyranoside ()
Isoquercitrin ()
Quercetin 3-glucoside ()
Contigoside B ()
Hirsutrin, 3-Glucosylquercetin, Quercetin 3-o-glucopyranoside ()
Quercetin 3.beta.-glucoside ()
Isotrifoliin ()
Quercetin-3-o-glucoside ()
NSC-115918 ()
FEMA NO. 4225 ()
NSC-407304 ()
Quercetin 3-d-glucoside ()
Ronacare isoquercetin ()
Quercetin-3-glucose ()
Quercetin glucoside ()
Isotrifolin ()
Quercetol 3-monoglucoside ()
Isoquercetin, (-)- ()
Isoquercitroside ()
Quercetin 3-o-glucoside ()
Glucosyl-3-quercetin ()
P&D ID
PD002964
CAS
482-35-9
Tags
natural product
drug candidate
nuisance
available
Drug indication
Thrombosis
Drug Status
investigational
Max Phase
2.0
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
3
Organisms
1
Compound Sets
12
Cayman Chemical Bioactives
ChEMBL Drugs
Drug Repurposing Hub
DrugBank
DrugMAP
MedChem Express Bioactive Compound Library
NIH Clinical Collections (NCC)
Nuisance compounds in cellular assays
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
ZINC Tool Compounds
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
51
Properties
(calculated by RDKit )
Molecular Weight
464.1
Hydrogen Bond Acceptors
12
Hydrogen Bond Donors
8
Rotatable Bonds
4
Ring Count
4
Aromatic Ring Count
3
cLogP
-0.54
TPSA
210.51
Fraction CSP3
0.29
Chiral centers
5.0
Largest ring
6.0
QED
0.23
Structural alerts
1
Nonspecific/NOS
Flavonoid
Nuisance compounds in cellular assays
Related compounds
Custom attributes
(extracted from source data)
Pathway
Stem Cells
Immunology/Inflammation
NF-κB
Target
Wnt/??-catenin
NF-¦ÊB
Wnt/??catenin
NO Synthase
MOA
Wnt/beta-catenin
Antioxidant
Source data
