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Cassiaside

Cat No.:V71454 Purity: ≥98%
Cassiaside is a naphthyl glycoside that displays mixed inhibitory effects on BACE1 (IC50= 4.45 μM; Ki=9.85 μM).
Cassiaside
Cassiaside Chemical Structure CAS No.: 13709-03-0
Product category: Beta-secretase
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
1mg
5mg
10mg
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Product Description
Cassiaside is a naphthyl glycoside that displays mixed inhibitory effects on BACE1 (IC50= 4.45 μM; Ki=9.85 μM). Cassiaside has potential anti-AD/Alzheimer's disease activity.
Cassiaside is a phenolic glycoside isolated from Cassia species, particularly Cassia tora and Cassia obtusifolia, plants widely used in traditional medicine. It has a molecular weight of 420.37 and a molecular formula of C20H20O10. Cassiaside is a naphthyl glycoside that exhibits mixed inhibition of BACE1 (IC50 = 4.45 μM; Ki = 9.85 μM). It possesses potential anti-Alzheimer's disease activity.
Biological Activity I Assay Protocols (From Reference)
Targets
Cassiaside targets BACE1 (beta-site amyloid precursor protein cleaving enzyme 1). It exhibits mixed inhibition of BACE1 with an IC50 of 4.45 μM and a Ki of 9.85 μM. By inhibiting BACE1, Cassiaside reduces the production of amyloid-beta peptides, which are involved in Alzheimer's disease pathology. The compound's mechanism involves binding to BACE1 and preventing it from cleaving amyloid precursor protein. Cassiaside also exhibits antioxidant, hepatoprotective, and anti-inflammatory effects.
ln Vitro
In vitro, Cassiaside exhibits mixed inhibition of BACE1 with an IC50 of 4.45 μM and a Ki of 9.85 μM. The compound shows antioxidant, hepatoprotective, and anti-inflammatory effects. Standard in vitro assays include BACE1 enzyme activity assays using fluorogenic substrates, antioxidant assays (e.g., DPPH radical scavenging), and anti-inflammatory assays measuring cytokine production in immune cells. The compound's potential anti-Alzheimer's disease activity is assessed through its BACE1 inhibitory activity.
ln Vivo
In vivo, Cassiaside has shown promise in protecting against oxidative liver injury and metabolic disorders. It possesses mild laxative properties. The compound exhibits strong antioxidant and hepatoprotective effects. However, comprehensive in vivo efficacy data for Alzheimer's disease are limited. The compound is used in research to study its potential therapeutic applications in liver protection, inflammation, and Alzheimer's disease. Further in vivo studies are needed to fully characterize its efficacy.
Enzyme Assay
For non-cell-based receptor binding assays, Cassiaside can be evaluated using purified BACE1 enzyme. Enzyme activity assays are performed using a fluorogenic substrate that is cleaved by BACE1. Increasing concentrations of the test compound are added, and the rate of substrate cleavage is measured by fluorescence. IC50 values are calculated from the inhibition curves. The mixed inhibition mechanism is confirmed by performing enzyme kinetics at various substrate concentrations and analyzing Lineweaver-Burk plots. Ki values are calculated from the kinetic data.
Cell Assay
For in vitro cellular assays, cells expressing amyloid precursor protein (APP) are cultured in appropriate media. Cells are treated with various concentrations of Cassiaside, and Aβ production in the cell culture supernatant is measured using ELISA or immunoassay. For antioxidant assays, cells are treated with oxidative stressors in the presence or absence of the compound, and oxidative stress markers are measured. For anti-inflammatory assays, immune cells are stimulated with LPS or other inflammatory stimuli, and cytokine production is measured.
Animal Protocol
For in vivo animal studies, Cassiaside is typically administered to rodents via oral gavage. In models of oxidative liver injury, liver enzyme levels (ALT, AST) and oxidative stress markers are measured following compound administration. In inflammation models, inflammatory markers and tissue damage are assessed. In Alzheimer's disease models, brain Aβ levels and cognitive function may be evaluated. Dosing regimens vary depending on the specific model. Blood and tissue samples may be collected for pharmacokinetic analysis.
ADME/Pharmacokinetics
Cassiaside has a molecular weight of 420.37 and a molecular formula of C20H20O10. It is a phenolic glycoside with an anthraquinone or naphthopyrone core linked to a sugar moiety. The compound is soluble in appropriate solvents for research use. It is supplied in high purity (≥95%). Cassiaside is isolated from Cassia species, particularly Cassia tora and Cassia obtusifolia. It should be stored according to the manufacturer's recommendations. It is for research use only.
Toxicity/Toxicokinetics
The toxicity profile of Cassiaside has not been extensively reported. As a natural product from Cassia species, it is expected to have a favorable safety profile. The compound exhibits strong antioxidant and hepatoprotective effects, suggesting it may have protective rather than toxic properties. It possesses mild laxative properties. The compound is for research use only and not for human consumption. Standard toxicological evaluation would include acute and repeated-dose toxicity studies.
References

[1]. Inhibitory activities of major anthraquinones and other constituents from Cassia obtusifolia against β-secretase and cholinesterases. J Ethnopharmacol. 2016;191:152-160.

Additional Infomation
Cassiaside is a glycoside and a benzochrome ketone. It has been reported that cassia glycoside exists in Cassia obtusifolia and Cassia tora, and relevant data are available for reference.
Cassiaside is a phenolic glycoside isolated from Cassia species, particularly Cassia tora and Cassia obtusifolia. It exhibits mixed inhibition of BACE1 with an IC50 of 4.45 μM and a Ki of 9.85 μM. The compound possesses potential anti-Alzheimer's disease activity. It also exhibits strong antioxidant, hepatoprotective, and anti-inflammatory effects. Cassiaside is used in research to study its potential therapeutic applications in liver protection, inflammation, and Alzheimer's disease.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C20H20O9
Molecular Weight
404.367406845093
Exact Mass
404.11
CAS #
13709-03-0
PubChem CID
164146
Appearance
Off-white to light yellow solid powder
LogP
1.2
Hydrogen Bond Donor Count
5
Hydrogen Bond Acceptor Count
9
Rotatable Bond Count
3
Heavy Atom Count
29
Complexity
652
Defined Atom Stereocenter Count
5
SMILES
O1[C@H]([C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O)OC1=CC=CC2=CC3=C(C(C=C(C)O3)=O)C(=C12)O
InChi Key
SBVZTBIAKFTNIJ-CZNQJBLBSA-N
InChi Code
InChI=1S/C20H20O9/c1-8-5-10(22)15-12(27-8)6-9-3-2-4-11(14(9)17(15)24)28-20-19(26)18(25)16(23)13(7-21)29-20/h2-6,13,16,18-21,23-26H,7H2,1H3/t13-,16-,18+,19-,20-/m1/s1
Chemical Name
5-hydroxy-2-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzo[g]chromen-4-one
HS Tariff Code
2934.99.9001
Storage

Powder      -20°C    3 years

                     4°C     2 years

In solvent   -80°C    6 months

                  -20°C    1 month

Note: This product requires protection from light (avoid light exposure) during transportation and storage.
Shipping Condition
Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)
Solubility Data
Solubility (In Vitro)
May dissolve in DMSO (in most cases), if not, try other solvents such as H2O, Ethanol, or DMF with a minute amount of products to avoid loss of samples
Solubility (In Vivo)
Note: Listed below are some common formulations that may be used to formulate products with low water solubility (e.g. < 1 mg/mL), you may test these formulations using a minute amount of products to avoid loss of samples.

Injection Formulations
(e.g. IP/IV/IM/SC)
Injection Formulation 1: DMSO : Tween 80: Saline = 10 : 5 : 85 (i.e. 100 μL DMSO stock solution 50 μL Tween 80 850 μL Saline)
*Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH ₂ O to obtain a clear solution.
Injection Formulation 2: DMSO : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL DMSO 400 μLPEG300 50 μL Tween 80 450 μL Saline)
Injection Formulation 3: DMSO : Corn oil = 10 : 90 (i.e. 100 μL DMSO 900 μL Corn oil)
Example: Take the Injection Formulation 3 (DMSO : Corn oil = 10 : 90) as an example, if 1 mL of 2.5 mg/mL working solution is to be prepared, you can take 100 μL 25 mg/mL DMSO stock solution and add to 900 μL corn oil, mix well to obtain a clear or suspension solution (2.5 mg/mL, ready for use in animals).
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Injection Formulation 4: DMSO : 20% SBE-β-CD in saline = 10 : 90 [i.e. 100 μL DMSO 900 μL (20% SBE-β-CD in saline)]
*Preparation of 20% SBE-β-CD in Saline (4°C,1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution.
Injection Formulation 5: 2-Hydroxypropyl-β-cyclodextrin : Saline = 50 : 50 (i.e. 500 μL 2-Hydroxypropyl-β-cyclodextrin 500 μL Saline)
Injection Formulation 6: DMSO : PEG300 : castor oil : Saline = 5 : 10 : 20 : 65 (i.e. 50 μL DMSO 100 μLPEG300 200 μL castor oil 650 μL Saline)
Injection Formulation 7: Ethanol : Cremophor : Saline = 10: 10 : 80 (i.e. 100 μL Ethanol 100 μL Cremophor 800 μL Saline)
Injection Formulation 8: Dissolve in Cremophor/Ethanol (50 : 50), then diluted by Saline
Injection Formulation 9: EtOH : Corn oil = 10 : 90 (i.e. 100 μL EtOH 900 μL Corn oil)
Injection Formulation 10: EtOH : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL EtOH 400 μLPEG300 50 μL Tween 80 450 μL Saline)


Oral Formulations
Oral Formulation 1: Suspend in 0.5% CMC Na (carboxymethylcellulose sodium)
Oral Formulation 2: Suspend in 0.5% Carboxymethyl cellulose
Example: Take the Oral Formulation 1 (Suspend in 0.5% CMC Na) as an example, if 100 mL of 2.5 mg/mL working solution is to be prepared, you can first prepare 0.5% CMC Na solution by measuring 0.5 g CMC Na and dissolve it in 100 mL ddH2O to obtain a clear solution; then add 250 mg of the product to 100 mL 0.5% CMC Na solution, to make the suspension solution (2.5 mg/mL, ready for use in animals).
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Oral Formulation 3: Dissolved in PEG400
Oral Formulation 4: Suspend in 0.2% Carboxymethyl cellulose
Oral Formulation 5: Dissolve in 0.25% Tween 80 and 0.5% Carboxymethyl cellulose
Oral Formulation 6: Mixing with food powders


Note: Please be aware that the above formulations are for reference only. InvivoChem strongly recommends customers to read literature methods/protocols carefully before determining which formulation you should use for in vivo studies, as different compounds have different solubility properties and have to be formulated differently.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 2.4730 mL 12.3649 mL 24.7298 mL
5 mM 0.4946 mL 2.4730 mL 4.9460 mL
10 mM 0.2473 mL 1.2365 mL 2.4730 mL

*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles.

Calculator

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An example of molarity calculation using the molarity calculator is shown below:
What is the mass of compound required to make a 10 mM stock solution in 5 ml of DMSO given that the molecular weight of the compound is 350.26 g/mol?
  • Enter 350.26 in the Molecular Weight (MW) box
  • Enter 10 in the Concentration box and choose the correct unit (mM)
  • Enter 5 in the Volume box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 17.513 mg appears in the Mass box. In a similar way, you may calculate the volume and concentration.

Dilution Calculator allows you to calculate how to dilute a stock solution of known concentrations. For example, you may Enter C1, C2 & V2 to calculate V1, as detailed below:

What volume of a given 10 mM stock solution is required to make 25 ml of a 25 μM solution?
Using the equation C1V1 = C2V2, where C1=10 mM, C2=25 μM, V2=25 ml and V1 is the unknown:
  • Enter 10 into the Concentration (Start) box and choose the correct unit (mM)
  • Enter 25 into the Concentration (End) box and select the correct unit (mM)
  • Enter 25 into the Volume (End) box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 62.5 μL (0.1 ml) appears in the Volume (Start) box
g/mol

Molecular Weight Calculator allows you to calculate the molar mass and elemental composition of a compound, as detailed below:

Note: Chemical formula is case sensitive: C12H18N3O4  c12h18n3o4
Instructions to calculate molar mass (molecular weight) of a chemical compound:
  • To calculate molar mass of a chemical compound, please enter the chemical/molecular formula and click the “Calculate’ button.
Definitions of molecular mass, molecular weight, molar mass and molar weight:
  • Molecular mass (or molecular weight) is the mass of one molecule of a substance and is expressed in the unified atomic mass units (u). (1 u is equal to 1/12 the mass of one atom of carbon-12)
  • Molar mass (molar weight) is the mass of one mole of a substance and is expressed in g/mol.
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Reconstitution Calculator allows you to calculate the volume of solvent required to reconstitute your vial.

  • Enter the mass of the reagent and the desired reconstitution concentration as well as the correct units
  • Click the “Calculate” button
  • The answer appears in the Volume (to add to vial) box
In vivo Formulation Calculator (Clear solution)
Step 1: Enter information below (Recommended: An additional animal to make allowance for loss during the experiment)
Step 2: Enter in vivo formulation (This is only a calculator, not the exact formulation for a specific product. Please contact us first if there is no in vivo formulation in the solubility section.)
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Calculation results

Working concentration mg/mL;

Method for preparing DMSO stock solution mg drug pre-dissolved in μL DMSO (stock solution concentration mg/mL). Please contact us first if the concentration exceeds the DMSO solubility of the batch of drug.

Method for preparing in vivo formulation:Take μL DMSO stock solution, next add μL PEG300, mix and clarify, next addμL Tween 80, mix and clarify, next add μL ddH2O,mix and clarify.

(1) Please be sure that the solution is clear before the addition of next solvent. Dissolution methods like vortex, ultrasound or warming and heat may be used to aid dissolving.
             (2) Be sure to add the solvent(s) in order.

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