Dihydroxymethoxychalcone

This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.

Identification

Name
Dihydroxymethoxychalcone
Accession Number
DB14122
Type
Small Molecule
Groups
Experimental
Description

Cardamonin (also known as Dihydroxymethoxychalcone), as shown by the increasing number of publications, has received growing attention from the scientific community due to the expectations toward its benefits to human health. Cardamonin's name comes from the fact that it can be found in cardamom spice.

Structure
Thumb
Synonyms
  • (E)-1-(2,4-Dihydroxy-6-methoxyphenyl)-3-phenyl-2-propen-1-one
  • Alpinetin chalcone
  • Cardamomin
  • Cardamonin
Over the Counter Products
NameDosageStrengthRouteLabellerMarketing StartMarketing End
Isaknox White Symphony Multi Laser SpotCream0.05 mL/100mLTopicalLg Household & Health Care Ltd.2010-07-012011-07-11Us
Categories
UNII
H8KP1OJ8JX
CAS number
19309-14-9
Weight
Average: 270.284
Monoisotopic: 270.089208931
Chemical Formula
C16H14O4
InChI Key
NYSZJNUIVUBQMM-BQYQJAHWSA-N
InChI
InChI=1S/C16H14O4/c1-20-15-10-12(17)9-14(19)16(15)13(18)8-7-11-5-3-2-4-6-11/h2-10,17,19H,1H3/b8-7+
IUPAC Name
(2E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenylprop-2-en-1-one
SMILES
COC1=C(C(=O)\C=C\C2=CC=CC=C2)C(O)=CC(O)=C1

Pharmacology

Indication
Not Available
Pharmacodynamics
Not Available
Mechanism of action
Not Available
Absorption
Not Available
Volume of distribution
Not Available
Protein binding
Not Available
Metabolism
Not Available
Route of elimination
Not Available
Half life
Not Available
Clearance
Not Available
Toxicity
Not Available
Affected organisms
Not Available
Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available

Interactions

Drug Interactions
Not Available
Food Interactions
Not Available

References

General References
  1. Goncalves LM, Valente IM, Rodrigues JA: An overview on cardamonin. J Med Food. 2014 Jun;17(6):633-40. doi: 10.1089/jmf.2013.0061. Epub 2014 Jan 16. [PubMed:24433078]
External Links
Human Metabolome Database
HMDB0132913
ChemSpider
557026
BindingDB
50185446
ChEMBL
CHEMBL378104
Wikipedia
Cardamomin

Clinical Trials

Clinical Trials
Not Available

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage forms
FormRouteStrength
CreamTopical0.05 mL/100mL
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
PropertyValueSource
Water Solubility0.0777 mg/mLALOGPS
logP3.62ALOGPS
logP3.78ChemAxon
logS-3.5ALOGPS
pKa (Strongest Acidic)7.2ChemAxon
pKa (Strongest Basic)-4.9ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count4ChemAxon
Hydrogen Donor Count2ChemAxon
Polar Surface Area66.76 Å2ChemAxon
Rotatable Bond Count4ChemAxon
Refractivity77.3 m3·mol-1ChemAxon
Polarizability28.42 Å3ChemAxon
Number of Rings2ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted ADMET features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
Not Available

Taxonomy

Classification
Not classified

Drug created on June 23, 2018 16:13 / Updated on November 02, 2018 07:50