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Dehydrocavidine

Cat No.:V29167 Purity: ≥98%
Dehydrocavidine is a novel and potent bioactive compound
Dehydrocavidine
Dehydrocavidine Chemical Structure CAS No.: 83218-34-2
Product category: New1
This product is for research use only, not for human use. We do not sell to patients.
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10mg
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50mg
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Product Description
Dehydrocavidine is a novel and potent bioactive compound
Dehydrocavidine (CAS 83218-34-2), also known as Dehydrocorydaline, is a main active ingredient of Corydalis saxicola Bunting (Yanhuanglian), a plant used in traditional Chinese medicine. It is an isoquinoline alkaloid with diverse pharmacological activities. Dehydrocavidine displays antinociceptive, hepatoprotective, and spasmolytic activities. It kills hepatitis viruses and promotes regeneration of hepatocytes. It has antitumor activity and inhibits MCF-7 cell proliferation by inducing apoptosis. Dehydrocavidine's mechanism of action is complex and involves modulation of various biological pathways involved in inflammation, oxidative stress, and cell signaling. It has potential to influence drug metabolism, highlighting the need for further investigation into potential herb-drug interactions.
Biological Activity I Assay Protocols (From Reference)
Targets
Dehydrocavidine targets multiple cellular pathways involved in apoptosis and cell proliferation. It induces apoptosis mediated by regulating Bax/Bcl-2, activating caspases, and cleaving PARP (poly ADP-ribose polymerase). It modulates pathways involved in inflammation, oxidative stress, and cell signaling. Dehydrocavidine also has potential to influence drug metabolism through interactions with metabolic enzymes. Its hepatoprotective and antiviral activities suggest additional targets related to hepatitis virus replication and hepatocyte regeneration. The compound's antinociceptive effects indicate interactions with pain signaling pathways.
ln Vitro
In vitro, Dehydrocavidine exhibits antitumor activity by inhibiting MCF-7 cell proliferation through induction of apoptosis mediated by regulating Bax/Bcl-2, activating caspases, and cleaving PARP. It displays antinociceptive, hepatoprotective, and spasmolytic activities in various assays. It kills hepatitis viruses and promotes regeneration of hepatocytes. The complexation behavior of dehydrocavidine with cucurbit[7]uril (CB7) has been studied in phosphate buffer saline (pH 7.2), showing significant fluorescence enhancement upon complexation. Although structurally similar to other alkaloids, the complexation stability constant of dehydrocavidine with CB7 is 5.4 times lower than that of palmatine.
ln Vivo
In vivo activity data for Dehydrocavidine is limited in publicly available literature. As an active ingredient of Corydalis saxicola used in traditional medicine, it is believed to exhibit hepatoprotective, antinociceptive, and spasmolytic effects in vivo. It kills hepatitis viruses and promotes hepatocyte regeneration. However, specific in vivo efficacy studies, including detailed pharmacokinetic and pharmacodynamic parameters, have not been extensively reported. Its potential to influence drug metabolism suggests that in vivo herb-drug interaction studies would be important for understanding its clinical relevance.
Enzyme Assay
For in vitro cell-free assays, the apoptotic activity of dehydrocavidine can be studied by measuring its effects on Bax/Bcl-2 ratio, caspase activation, and PARP cleavage using purified proteins or cell lysates. Caspase activity assays using fluorogenic substrates (e.g., DEVD-AFC for caspase-3) can quantify enzyme activation. PARP cleavage can be detected by Western blot using specific antibodies. The complexation behavior with cucurbit[7]uril (CB7) can be studied by fluorescence spectroscopy in phosphate buffer saline (pH 7.2), monitoring fluorescence enhancement upon complex formation.
Cell Assay
For in vitro cellular assays, the antitumor activity of dehydrocavidine is assessed in MCF-7 breast cancer cells. Cells are seeded in multi-well plates and treated with various concentrations of dehydrocavidine for a defined period. Cell viability is measured using MTT or SRB assays. Apoptosis is assessed by flow cytometry (Annexin V/PI staining), caspase activity assays, and Western blot analysis of Bax/Bcl-2 expression and PARP cleavage. The effect on cell cycle progression can also be evaluated. For hepatoprotective studies, liver cell lines can be used to assess protection against toxin-induced damage.
Animal Protocol
For in vivo studies, dehydrocavidine could be administered orally or intraperitoneally in rodent models of liver injury, pain, or cancer. In hepatoprotective studies, endpoints include serum liver enzyme levels (ALT, AST), histopathological examination of liver tissue, and assessment of hepatocyte regeneration. In antinociceptive studies, pain responses can be measured using standard tests such as the hot plate test or acetic acid-induced writhing test. Its potential to influence drug metabolism could be studied by measuring the pharmacokinetics of co-administered drugs.
ADME/Pharmacokinetics
Dehydrocavidine (CAS 83218-34-2) has a molecular formula of C21H18NO4 and a molecular weight of 348.37 g/mol. It is also known as Dehydrocorydaline. The compound is typically supplied as a powder. It is soluble in DMSO and other organic solvents. Storage: powder at -20°C for 3 years; in solvent at -80°C for 1 year. Purity is typically >98% for research use. The compound should be protected from light and moisture. Density data is not available.
Toxicity/Toxicokinetics
No detailed toxicity data is publicly available for dehydrocavidine. As an alkaloid from Corydalis saxicola used in traditional medicine, it is generally considered to have a manageable safety profile, but standard toxicological studies would be required for drug development. In vitro cytotoxicity assays in various cell lines are typically performed alongside efficacy studies to confirm that observed effects are not due to a general reduction in cell viability. Its potential to influence drug metabolism suggests that herb-drug interaction risks should be evaluated.
Additional Infomation
Benzo(a)-1,3-benzodioxane(4,5-g)quinolazine, 8,9-dimethoxy-6-methyl- has been reported in corydalis, berberis and other organisms for which data are available.
Dehydrocavidine is a research-grade compound and is not approved for therapeutic use. It serves primarily as a pharmacological tool for studying apoptosis, cancer cell biology, and hepatoprotection. Its mechanism of action involves the induction of apoptosis through regulation of Bax/Bcl-2, activation of caspases, and cleavage of PARP. It displays antinociceptive, hepatoprotective, and spasmolytic activities. As a main active ingredient of Corydalis saxicola Bunting (Yanhuanglian), it is used in traditional Chinese medicine. No clinical trials have been reported. Its potential to influence drug metabolism highlights the need for further investigation.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C21H18NO4
Molecular Weight
348.3719
Exact Mass
351.147
CAS #
83218-34-2
PubChem CID
158329
Appearance
Typically exists as solid at room temperature
Density
1.3±0.1 g/cm3
Boiling Point
506.0±50.0 °C at 760 mmHg
Flash Point
149.9±27.3 °C
Vapour Pressure
0.0±1.3 mmHg at 25°C
Index of Refraction
1.663
LogP
5.01
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Heavy Atom Count
26
Complexity
516
Defined Atom Stereocenter Count
0
SMILES
O(C)C1C(OC)=CC2C(=CC=[N+]3C=2C(C)=C2C(C4=C(C=C2)OCO4)=C3)C=1
InChi Key
TWSZDJCOYVYRGM-UHFFFAOYSA-N
InChi Code
InChI=1S/C21H18NO4/c1-12-14-4-5-17-21(26-11-25-17)16(14)10-22-7-6-13-8-18(23-2)19(24-3)9-15(13)20(12)22/h4-10H,11H2,1-3H3/q+1
Chemical Name
16,17-dimethoxy-12-methyl-5,7-dioxa-1-azoniapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18,20-nonaene
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

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 2.8705 mL 14.3526 mL 28.7051 mL
5 mM 0.5741 mL 2.8705 mL 5.7410 mL
10 mM 0.2871 mL 1.4353 mL 2.8705 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

Molarity Calculator allows you to calculate the mass, volume, and/or concentration required for a solution, as detailed below:

  • Calculate the Mass of a compound required to prepare a solution of known volume and concentration
  • Calculate the Volume of solution required to dissolve a compound of known mass to a desired concentration
  • Calculate the Concentration of a solution resulting from a known mass of compound in a specific volume
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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