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L-Threonine-13C4,15N (L-threonine 13C4,15N)

L-Threonine-13C4,15N is L-Threonine with a 13C tag and a 15N tag.
L-Threonine-13C4,15N (L-threonine 13C4,15N)
L-Threonine-13C4,15N (L-threonine 13C4,15N) Chemical Structure CAS No.: 202468-39-1
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
5mg
10mg
50mg
100mg
Other Sizes

Other Forms of L-Threonine-13C4,15N (L-threonine 13C4,15N):

  • N-(((9H-Fluoren-9-yl)methoxy)carbonyl)-O-benzyl-N-methyl-L-threonine
  • BOC-O-Benzyl-L-threonine
  • L-Threonine-13C4 (L-Threonine-13C4)
  • N-Methyl-L-threonine
  • L-Threonine
Official Supplier of:
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Top Publications Citing lnvivochem Products
Product Description
L-Threonine-13C4,15N is L-Threonine with a 13C tag and a 15N tag. L-Threonine is a natural amino acid (AA) produced by microbial fermentation and may be utilized in food, medicine and feed.
L-Threonine-13C4,15N is the isotopically labeled version of L-Threonine, featuring four 13C markers on all carbon atoms and one 15N marker on the nitrogen atom. It has a molecular formula of 13C4H9^{15}NO3 and a molecular weight of 124.08. L-Threonine is a naturally occurring amino acid produced through microbial fermentation, utilized in food, pharmaceutical, and feed applications.
Biological Activity I Assay Protocols (From Reference)
Targets
L-Threonine-13C4,15N does not have a specific pharmacological receptor target. As a stable isotope-labeled compound, it is used as a tracer in metabolic studies. L-Threonine itself is a proteinogenic amino acid involved in protein synthesis and various metabolic pathways. The 13C and 15N labeling allows for the tracking of carbon and nitrogen atoms through metabolic pathways.
ln Vitro
Drug compounds have included stable heavy isotopes of carbon, hydrogen, and other elements, mostly as quantitative tracers while the drugs were being developed. Because deuteration may have an effect on a drug's pharmacokinetics and metabolic properties, it is a cause for concern [1].
In vitro, L-Threonine-13C4,15N is not used for biological activity assays. Its primary utility is as a tracer in metabolic studies to track the incorporation of threonine into proteins and other metabolites. Cells are cultured in media containing the labeled threonine, and the incorporation of 13C and 15N into proteins and metabolites is analyzed using mass spectrometry.
ln Vivo
In vivo, L-Threonine-13C4,15N is used as a metabolic tracer to study protein synthesis, amino acid metabolism, and nitrogen flux. By administering the labeled compound and measuring the incorporation of 13C and 15N into proteins and metabolites using mass spectrometry, researchers can map metabolic pathways. It is used in systems biology, nutritional research, and isotopic labeling experiments.
Enzyme Assay
For non-cell-based assays, L-Threonine-13C4,15N is used as an analytical standard. Its identity and purity are confirmed using techniques such as NMR and mass spectrometry. The compound is typically supplied with 98 atom% 13C and 98 atom% 15N enrichment. It is not used in receptor binding assays. Its role is to serve as a quantitative tracer in metabolic studies.
Cell Assay
For in vitro cellular assays, cells are cultured in media containing L-Threonine-13C4,15N instead of unlabeled threonine. The cells incorporate the labeled amino acid into proteins and other metabolites. After a defined incubation period, cells are harvested, and proteins or metabolites are extracted. The incorporation of 13C and 15N is analyzed using mass spectrometry to determine protein synthesis rates and metabolic fluxes.
Animal Protocol
For in vivo animal studies, L-Threonine-13C4,15N can be administered to rodents via oral gavage or intraperitoneal injection. Blood or tissue samples are collected at various time points post-administration. The samples are processed and analyzed by mass spectrometry to track the distribution and metabolism of the labeled threonine. This allows for the study of protein synthesis and amino acid metabolism in vivo.
ADME/Pharmacokinetics
L-Threonine-13C4,15N has a molecular weight of 124.08 and a molecular formula of 13C4H9^{15}NO3. It has a purity of 98 atom% 13C and 98 atom% 15N. The compound is soluble in water and should be stored according to the manufacturer's recommendations. It is for research use only and is not intended for human consumption.
Toxicity/Toxicokinetics
The toxicity profile of L-Threonine-13C4,15N is not applicable, as it is used as a metabolic tracer at very low concentrations. The 13C and 15N labeling is not expected to introduce new toxicities, as these are stable, non-radioactive isotopes. The compound is not intended for human consumption. Standard safety precautions should be observed when handling the compound.
References
[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216.
Additional Infomation
L-Threonine-13C4,15N (CAS 202468-39-1) is the isotopically labeled version of L-Threonine, featuring four 13C markers and one 15N marker. L-Threonine is a naturally occurring amino acid utilized in food, pharmaceutical, and feed applications. The labeled compound is ideal for applications in systems biology, nutritional research, and isotopic labeling experiments. It is available for research purposes only.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C4H9NO3
Molecular Weight
124.0832
Exact Mass
124.068
CAS #
202468-39-1
Related CAS #
L-Threonine;72-19-5
PubChem CID
16217559
Appearance
White to off-white solid powder
LogP
-2.9
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Heavy Atom Count
8
Complexity
93.3
Defined Atom Stereocenter Count
2
SMILES
[13CH3][13C@H]([13C@@H]([13C](=O)O)[15NH2])O
InChi Key
AYFVYJQAPQTCCC-KJQIOZMZSA-N
InChi Code
InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3+/m1/s1/i1+1,2+1,3+1,4+1,5+1
Chemical Name
(2S,3R)-2-(15N)azanyl-3-hydroxy(1,2,3,4-13C4)butanoic acid
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 8.0593 mL 40.2966 mL 80.5932 mL
5 mM 1.6119 mL 8.0593 mL 16.1186 mL
10 mM 0.8059 mL 4.0297 mL 8.0593 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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