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Epitheaflavin

Cat No.:V34232 Purity: ≥98%
Neotheaflavin, developed from black tea, inhibits pancreatic lipase.
Epitheaflavin
Epitheaflavin Chemical Structure CAS No.: 36451-14-6
Product category: Natural Products
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
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5mg
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Product Description
Neotheaflavin, developed from black tea, inhibits pancreatic lipase.
Epitheaflavin (CAS# 36451-14-6), also known as Neotheaflavin, is a regioisomeric benzotropolone-based polyphenol pigment belonging to the theaflavin class, developed from black tea. It exhibits inhibitory activity against pancreatic lipase, and demonstrates potent antioxidant, anti-inflammatory, and anticancer properties. The compound plays a role in lipid metabolism regulation and antioxidant defense.
Biological Activity I Assay Protocols (From Reference)
Targets
The primary target of epitheaflavin is pancreatic lipase, an enzyme responsible for the hydrolysis of dietary triglycerides. By inhibiting pancreatic lipase, the compound reduces fat absorption, suggesting potential applications in obesity prevention and metabolic disorder research. The compound also modulates cellular signaling pathways involved in cancer and inflammation.
ln Vitro
In vitro, epitheaflavin inhibits pancreatic lipase activity. It exhibits potent antioxidant activity by neutralizing reactive oxygen species. The compound also demonstrates anti-inflammatory properties and may inhibit tumor growth by modulating cellular signaling pathways. Its strong bioactivity makes it valuable for nutraceutical and functional food research.
ln Vivo
In vivo studies on epitheaflavin are limited. Based on its mechanism as a pancreatic lipase inhibitor, the compound may reduce dietary fat absorption and support cardiovascular health. Its antioxidant and anti-inflammatory properties suggest potential therapeutic applications in metabolic and inflammatory disorders. Further in vivo studies are needed to fully characterize its pharmacological effects.
Enzyme Assay
For in vitro enzyme inhibition assays, epitheaflavin is tested against pancreatic lipase. The enzyme is incubated with varying concentrations of the compound and a substrate (such as p-nitrophenyl palmitate or triolein) in an appropriate buffer. Lipase activity is measured by monitoring the release of p-nitrophenol (absorbance at 405 nm) or free fatty acids. IC₅₀ values are calculated from dose-response curves.
Cell Assay
For in vitro cell-based assays, epitheaflavin is typically tested on adipocytes or cancer cell lines. Cells are treated with the compound at various concentrations (typically 1-100 μM) for 24-72 hours. Lipid accumulation in adipocytes can be assessed by Oil Red O staining. Cell viability and proliferation are evaluated using MTT or CCK-8 assays. Apoptosis and signaling pathway modulation can be assessed by Western blotting.
Animal Protocol
In vivo animal experiments for epitheaflavin have not been extensively reported. Based on its mechanism as a pancreatic lipase inhibitor, potential experimental models include high-fat diet-induced obesity in mice. The compound could be administered orally with the diet, and parameters such as body weight, fat mass, serum lipids, and glucose tolerance would be assessed as pharmacodynamic endpoints.
ADME/Pharmacokinetics
Pharmacokinetic data for epitheaflavin are limited. As a polyphenolic compound with a molecular weight of 564.49 g/mol and formula C₂₉H₂₄O₁₂, it is expected to have moderate oral bioavailability. The compound may undergo metabolism in the gastrointestinal tract and liver. Standard pharmacokinetic studies would be required to determine its absorption, distribution, metabolism, and excretion profile.
Toxicity/Toxicokinetics
Toxicological data for epitheaflavin are limited. As a naturally occurring polyphenol from black tea, it is generally considered to have low toxicity at dietary intake levels. However, comprehensive toxicological studies at pharmacological doses have not been extensively reported. The compound is classified as a research-grade reagent and is not for human use.
References

[1]. Prediction of Chinese green tea ranking by metabolite profiling using ultra-performance liquid chromatography-quadrupole time-of-flight mass spectrometry (UPLC-Q-TOF/MS). Food Chem. 2017 Apr 15;221:311-316.

Additional Infomation
Epitheaflavin is a research-use only compound and has not been approved for clinical applications. It is also known as Neotheaflavin and新茶黄素 in Chinese. The compound is a theaflavin-class polyphenol pigment from black tea. Its molecular weight is 564.49 and formula is C₂₉H₂₄O₁₂. It is available from various research chemical suppliers.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C29H24O12
Molecular Weight
564.494
Exact Mass
564.126
CAS #
36451-14-6
PubChem CID
135911695
Appearance
Pink to red solid
Source
Originated from plants: Theaceae Camellia sinensis (L.) O. Ktze.
LogP
2.4
Hydrogen Bond Donor Count
9
Hydrogen Bond Acceptor Count
12
Rotatable Bond Count
2
Heavy Atom Count
41
Complexity
1060
Defined Atom Stereocenter Count
4
SMILES
C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC4=C(C(=C(C=C4[C@@H]5[C@H](CC6=C(C=C(C=C6O5)O)O)O)O)O)C(=O)C(=C3)O)O
InChi Key
IPMYMEWFZKHGAX-WCQFOESSSA-N
InChi Code
InChI=1S/C29H24O12/c30-11-3-17(32)15-8-21(36)28(40-23(15)5-11)10-1-13-14(7-20(35)27(39)25(13)26(38)19(34)2-10)29-22(37)9-16-18(33)4-12(31)6-24(16)41-29/h1-7,21-22,28-33,35-37,39H,8-9H2,(H,34,38)/t21-,22+,28-,29-/m1/s1
Chemical Name
3,4,6-trihydroxy-8-[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]-1-[(2R,3S)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]benzo[7]annulen-5-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 1.7715 mL 8.8576 mL 17.7151 mL
5 mM 0.3543 mL 1.7715 mL 3.5430 mL
10 mM 0.1772 mL 0.8858 mL 1.7715 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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