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Purine

Cat No.:V82161 Purity: ≥98%
Purine is an endogenously produced metabolite.
Purine
Purine Chemical Structure CAS No.: 120-73-0
Product category: Endogenous Metabolite
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
250mg
500mg
1g
Other Sizes
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Product Description
Purine is an endogenously produced metabolite.
Purine (CAS: 120-73-0) is a heterocyclic aromatic organic compound that serves as the parent structure for the nucleobases adenine and guanine. It is a fundamental component of DNA, RNA, and ATP, and is essential for life.
Biological Activity I Assay Protocols (From Reference)
Targets
Human Endogenous Metabolite
Purine targets enzymes involved in nucleotide metabolism, including purine nucleoside phosphorylase (PNP), xanthine oxidase (XO), and hypoxanthine-guanine phosphoribosyltransferase (HGPRT). It is a substrate for these enzymes in the purine salvage pathway and degradation pathway.
ln Vitro
In vitro, purine and its derivatives have been shown to inhibit the growth of cancer cells by interfering with DNA synthesis. It is used as a substrate to study the purine salvage pathway and as a standard for purine metabolism assays.
ln Vivo
In vivo, purine metabolism is critical for health and disease. Purine analogs (e.g., 6-mercaptopurine, azathioprine) are used as chemotherapeutic agents and immunosuppressants. The unlabeled compound is used to study hyperuricemia and gout by feeding purine-rich diets to animals.
Enzyme Assay
A non-cell assay using purified xanthine oxidase (XO) and purine as a substrate is performed. The conversion of purine to uric acid is monitored spectrophotometrically by measuring the increase in absorbance at 290 nm, which corresponds to the production of uric acid. The reaction is performed in phosphate buffer, pH 7.5, at 25degC.
Cell Assay
Human cancer cell lines (e.g., MCF-7, HeLa) are cultured in the presence of purine or its analogs (1-100 uM). Cell viability is measured by MTT assay. DNA synthesis is assessed by [3H]-thymidine incorporation. Purine levels in cells and culture medium are analyzed by HPLC or LC-MS.
Animal Protocol
In animal studies, purine is typically administered to rodents as part of a high-purine diet (e.g., yeast extract) to induce hyperuricemia and gout-like symptoms. Blood uric acid levels are measured by enzymatic colorimetric assay. This model is used to test the efficacy of xanthine oxidase inhibitors such as allopurinol.
ADME/Pharmacokinetics
Purine is water-soluble and rapidly absorbed from the gut. It is extensively metabolized by the liver, primarily by xanthine oxidase and purine nucleoside phosphorylase. The half-life of purine in the blood is very short (minutes). It is converted to uric acid, which is excreted by the kidneys.
Toxicity/Toxicokinetics
Purine is generally recognized as safe in normal dietary amounts. However, high levels of purine in the diet can lead to hyperuricemia and gout in susceptible individuals due to the production of uric acid. In animal studies, high-purine diets are well tolerated but lead to elevated uric acid levels.
Additional Infomation
7H-purine is the 7H-tautomer of purine. It is a tautomer of 1H-purine, 3H-purine, and 9H-purine. Purines are metabolites present in or produced by Escherichia coli (K12 strain, MG1655 strain). Purines have been reported in humans, ginseng, and cattle, but relevant data are unclear. Purines are also present in or produced by Saccharomyces cerevisiae.
Purine is not a drug itself, but it is the core structure for many important pharmaceuticals, including antiviral drugs (acyclovir), chemotherapeutic agents (6-mercaptopurine, fludarabine), immunosuppressants (azathioprine), and anti-gout medications (allopurinol). It is a fundamental building block in medicinal chemistry.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C5H4N4
Molecular Weight
120.11
Exact Mass
120.043
CAS #
120-73-0
PubChem CID
1044
Appearance
Off-white to gray solid powder
Density
1.5±0.1 g/cm3
Boiling Point
424ºC at 760mmHg
Melting Point
214 °C
Flash Point
225.4ºC
Vapour Pressure
0.0976mmHg at 25°C
Index of Refraction
1.738
LogP
-0.37
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
0
Heavy Atom Count
9
Complexity
105
Defined Atom Stereocenter Count
0
SMILES
C1=C2C(=NC=N1)N=CN2
InChi Key
KDCGOANMDULRCW-UHFFFAOYSA-N
InChi Code
InChI=1S/C5H4N4/c1-4-5(8-2-6-1)9-3-7-4/h1-3H,(H,6,7,8,9)
Chemical Name
7H-purine
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 :~50 mg/mL (~416.29 mM)
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 2.5 mg/mL (20.81 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween80 + 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 25.0 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.

Solubility in Formulation 2: ≥ 2.5 mg/mL (20.81 mM) (saturation unknown) in 10% DMSO + 90% (20% SBE-β-CD in 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 25.0 mg/mL clear DMSO stock solution to 900 μL of 20% SBE-β-CD physiological saline solution and mix evenly.
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.

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Solubility in Formulation 3: ≥ 2.5 mg/mL (20.81 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (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 25.0 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly.


 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 8.3257 mL 41.6285 mL 83.2570 mL
5 mM 1.6651 mL 8.3257 mL 16.6514 mL
10 mM 0.8326 mL 4.1629 mL 8.3257 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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