General
Preferred name
HESPERETIN
Synonyms
(-)-hesperetin ()
FEMA NO. 4313 ()
NSC-57654 ()
Eriodictyol 4'-monomethyl ether ()
Hesperitin ()
P&D ID
PD001966
CAS
520-33-2
41001-90-5
Tags
available
natural product
drug
Drug indication
High blood cholesterol level
Drug Status
approved
investigational
experimental
Max Phase
0.5
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 Hesperetin is a natural flavonoid. It has antibacterial activity against Gram-negative H. pylori . (GtoPdb)
DESCRIPTION Hesperetin is a natural flavanone, and acts as a potent and broad-spectrum inhibitor against human UGT activity. Hesperetin regulates apoptosis.
PRICE 29
DESCRIPTION Hesperetin belongs to the flavanone class of flavonoids. Hesperetin, in the form of its glycoside hesperidin, is the predominant flavonoid in lemons and oranges. (TargetMol Bioactive Compound Library)
Cell lines
4
Organisms
0
Compound Sets
15
AdooQ Bioactive Compound Library
A10449
Cayman Chemical Bioactives
10006084
ChEMBL Drugs
CHEMBL399121
Drug Repurposing Hub
DrugBank
DB01094
DrugCentral
1362
DrugCentral Approved Drugs
1362
DrugMAP
DMKER83
DrugMAP Approved Drugs
DMKER83
Guide to Pharmacology
10953
MedChem Express Bioactive Compound Library
HY-N0168
Novartis Chemogenetic Library (NIBR MoA Box)
Selleckchem Bioactive Compound Library
Hesperetin
TargetMol Bioactive Compound Library
T2565
The Spectrum Collection
External IDs
46
Properties
(calculated by RDKit )
Molecular Weight
302.08
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
3
Rotatable Bonds
2
Ring Count
3
Aromatic Ring Count
2
cLogP
2.52
TPSA
96.22
Fraction CSP3
0.19
Chiral centers
1.0
Largest ring
6.0
QED
0.79
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Apoptosis
Autophagy
GPCR/G protein
MAPK
Neuroscience
Stem Cells
Immunology/Inflammation
MAPK/ERK Pathway
Metabolic Enzyme/Protease
Member status
member
MOA
Lipid Lowering Agents
Antioxidants
Triglyceride Lowering Agents
Cytochrome P450 CYP1B1 Inhibitors
TRPM3 Antagonists
ACAT inhibitor
Target
DGAT1, MTTP, SOAT1, SOAT2
Bcl-2 Family
NF-κB
p38 MAPK
Reactive Oxygen Species (ROS)
Histamine Receptor,TGF-beta/Smad
HT
TGFβ
Therapeutic Class
Anticholesteremic Agents
Source data