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Lignine

Lignin (Lignine) is a natural complex biopolymer that is biodegradable and biocompatible.
Lignine
Lignine Chemical Structure CAS No.: 9005-53-2
Product category: New1
This product is for research use only, not for human use. We do not sell to patients.
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Purity & Quality Control Documentation

Purity: Specification: Dealkaline

Product Description
Lignin (Lignine) is a natural complex biopolymer that is biodegradable and biocompatible. Lignin is the major component of plant cell walls and is a renewable aromatic polymer. Lignin has strong anti-oxidant effect.
Lignin (CAS: 9005-53-2) is a natural complex biopolymer and the primary component of plant cell walls, making it a renewable aromatic polymer. It is formed through the free-radical coupling of three hydroxypropanoids: coumarinol, coniferol, and sinapyl alcohol. It is biodegradable and biocompatible, and it has strong antioxidant activity.
Biological Activity I Assay Protocols (From Reference)
Targets
Lignin does not have a specific pharmacological target. Its biological role is structural, providing rigidity and water impermeability to plant cell walls. In research, it is studied for its antioxidant properties and its potential as a natural polymer for various biomedical and industrial applications.
ln Vitro
Looking at it from a structural perspective, lignin is a multifunctional natural phenolic polymer that is created in the cell walls of all vascular plants by coupling three hydroxypropyl alcohols together using free radicals: coumarin, coniferyl, and glucosinolates. Natural antioxidants have the potential to do so[1].
In vitro, Lignin demonstrates strong antioxidant activity. It is used in cell culture studies to assess its cytotoxic or anti-proliferative effects on tumor cell lines. Its ability to scavenge free radicals makes it a compound of interest for research into oxidative stress and its related pathologies.
ln Vivo
In vivo, Lignin is not used as a therapeutic agent. However, its antioxidant properties suggest potential health benefits, such as reducing oxidative stress. Studies have investigated the acute toxicity of lignin-based polymers, indicating that they are generally safe. Its biodegradability and biocompatibility make it a promising material for drug delivery.
Enzyme Assay
The in vitro antioxidant assay for Lignin involves measuring its ability to scavenge free radicals, such as DPPH or ABTS. The compound is incubated with the radical, and the decrease in absorbance is measured. For cytotoxicity, cancer cell lines are treated with Lignin, and cell viability is assessed using an MTT assay.
Cell Assay
In vitro cell culture studies for Lignin utilize various cancer cell lines to assess its potential anti-proliferative effects. Cells are treated with the compound, and cell viability is measured using the MTT or SRB assay. The production of reactive oxygen species (ROS) is also measured to evaluate its antioxidant effects.
Animal Protocol
In vivo animal experiments for Lignin are limited. However, acute toxicity studies have been performed in animal models to assess the safety of lignin-based materials. In these studies, the compound is administered orally or intraperitoneally, and parameters such as body weight, organ weight, and histopathology are assessed.
ADME/Pharmacokinetics
Lignin is a high molecular weight polymer with a complex and variable structure. It is a brown or black powder that is insoluble in water and most organic solvents. It is typically stored at room temperature in a dry place. Its stability is maintained under recommended storage conditions.
Toxicity/Toxicokinetics
Toxicological data for Lignin indicate that it is generally considered non-toxic and biocompatible. Acute toxicity studies have shown that it is safe at moderate doses. However, as a research compound, it is not intended for human therapeutic use, and standard safety precautions should be followed.
References

[1]. Short time hydrothermal treatment of poplar wood for production of lignin-derived polyphenol antioxidant. ChemSusChem. 2020 Mar 23.

[2]. A new method for the direct tracking of in vivo lignin nanocapsules in Eragrostis tef (Poaceae) tissues. Eur J Histochem. 2020 Mar 26;64(2).

Additional Infomation
Lignin is a research compound with no clinical approval. It is a valuable material for studying plant cell wall structure and for developing sustainable biomaterials. Its strong antioxidant activity makes it a compound of interest for research into oxidative stress and its related diseases. It is also used as a precursor for the production of various chemicals and materials.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C81H92O28
Molecular Weight
1513.58038
Exact Mass
508.993
CAS #
9005-53-2
PubChem CID
175586
Appearance
Brown to black solid powder
LogP
-0.8
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
10
Rotatable Bond Count
3
Heavy Atom Count
33
Complexity
863
Defined Atom Stereocenter Count
0
InChi Key
NBNRHKNCHFFYTL-UHFFFAOYSA-N
InChi Code
InChI=1S/C10H11N5O2/c1-7-10(17)9(8(4-16)2-11-7)3-14-15-5-12-13-6-15/h2-3,5-6,16-17H,4H2,1H3
Chemical Name
5-(hydroxymethyl)-2-methyl-4-(1,2,4-triazol-4-yliminomethyl)pyridin-3-ol
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)
DMSO : ~12.5 mg/mL
H2O : < 0.1 mg/mL
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 0.71 mg/mL (Infinity mM) (saturation unknown) in 10% DMSO + 40% PEG300 +5% Tween-80 + 45% Saline (add these co-solvents sequentially from left to right, and one by one), clear solution.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 7.1 mg/mL clear DMSO stock solution to 400 μL PEG300 and mix evenly; then add 50 μL Tween-80 + to the above solution and mix evenly; then add 450 μL normal saline to adjust the volume to 1 mL.
Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH₂ O to obtain a clear solution.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 0.6607 mL 3.3034 mL 6.6069 mL
5 mM 0.1321 mL 0.6607 mL 1.3214 mL
10 mM 0.0661 mL 0.3303 mL 0.6607 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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