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Ethyl palmitate-d31

Cat No.:V48326 Purity: ≥98%
Ethyl palmitate-d31 is the deuterium labelled form of Ethyl palmitate.
Ethyl palmitate-d31
Ethyl palmitate-d31 Chemical Structure CAS No.: 1215721-57-5
Product category: New3
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
1mg
5mg
10mg
25mg
100mg
Other Sizes

Other Forms of Ethyl palmitate-d31:

  • Glycidyl palmitate (Oxiran-2-ylmethyl palmitate)
  • Methyl palmitate-13C16
  • DMTr-2'-O-(Methyl palmitate)-rU-3'-CE-phosphoramidite
  • Ethyl palmitate
Official Supplier of:
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Top Publications Citing lnvivochem Products
Product Description
Ethyl palmitate-d31 is the deuterium labelled form of Ethyl palmitate. Ethyl palmitate is a fatty acid ethyl ester (FAEE) that is synthesized in greater amounts than other FAEEs in human subjects after consuming alcohol. Ethyl palmitate is used as a hair and skin conditioner.
Ethyl palmitate-d31 (1215721-57-5) is a deuterium-labeled form of ethyl palmitate, a fatty acid ethyl ester (FAEE). With 31 hydrogen atoms replaced by deuterium, it is used as an internal standard in mass spectrometry and NMR spectroscopy for the accurate quantification of palmitate esters in metabolic studies.
Biological Activity I Assay Protocols (From Reference)
Targets
Target: Isotope-Labeled Compounds / Endogenous Metabolite. Ethyl palmitate is a fatty acid ethyl ester that is synthesized in greater amounts than other FAEEs in human subjects after consuming alcohol, making it a biomarker for ethanol consumption.
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, ethyl palmitate-d31 serves as a model compound for identifying other lipids in biological samples. No direct pharmacological activity is reported. It is used in cell culture studies as a tracer to monitor lipid metabolism pathways.
ln Vivo
In vivo, the compound is used in metabolic tracer studies to investigate the absorption, distribution, and transformation of fatty acids. It does not exert pharmacological activity but is a valuable tool for studying lipid metabolism under various conditions.
Enzyme Assay
For cell-free assays: biological samples (plasma, urine, or tissue homogenates) are processed by liquid-liquid extraction, spiked with ethyl palmitate-d31 internal standard, and analyzed by GC-MS or LC-MS. Quantitation is achieved by comparing analyte peak areas to the internal standard.
Cell Assay
No cell-based assays are performed with the labeled standard. The unlabeled compound is used in cosmetic science as a skin- and hair-conditioning agent, but the deuterated form is intended solely for analytical and research applications, not for biological activation studies.
Animal Protocol
No animal studies are conducted directly with the labeled internal standard. For pharmacokinetic studies of unlabeled ethyl palmitate, the compound is administered orally to rodents and the internal standard is used in LC-MS/MS bioanalysis of harvested tissues or plasma to quantify the analyte.
ADME/Pharmacokinetics
PK properties of ethyl palmitate: rapid absorption and metabolism, with hydrolysis to palmitic acid and ethanol. The compound is incorporated into lipid structures and undergoes beta-oxidation. The deuterated standard does not exhibit distinct PK behavior and co-elutes with the unlabeled analyte.
Toxicity/Toxicokinetics
No toxicity data are reported for ethyl palmitate-d31. The unlabeled compound is used as a cosmetic ingredient and is generally regarded as safe for topical use. The deuterated standard is for research use only and not intended for human consumption or therapeutic administration.
References

[1]. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216.

[2]. Ethyl palmitate and ethyl oleate are the predominant fatty acid ethyl esters in the blood after ethanol ingestion and their synthesis is differentially influenced by the extracellular concentrations of their corresponding fatty acids. Alcohol Clin Exp Res. 1997 Apr;21(2):286-92.

Additional Infomation
Ethyl palmitate-d31 is a research standard, not a drug. It is not FDA-approved for clinical use. It is widely used in forensic toxicology and clinical research as a biomarker of alcohol consumption and as a reference standard for lipidomics and fatty acid metabolism studies.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C18H36O2
Molecular Weight
284.47724
Exact Mass
315.466
CAS #
1215721-57-5
Related CAS #
Ethyl palmitate;628-97-7
PubChem CID
57369475
Appearance
Colorless to light yellow liquid
Density
0.9±0.1 g/cm3
Boiling Point
342.2±0.0 °C at 760 mmHg
Flash Point
149.0±7.5 °C
Vapour Pressure
0.0±0.7 mmHg at 25°C
Index of Refraction
1.443
LogP
8.15
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
16
Heavy Atom Count
20
Complexity
202
Defined Atom Stereocenter Count
0
SMILES
CCCCCCCCCCCCCCCC(=O)OCC
InChi Key
XIRNKXNNONJFQO-FNWSWSEFSA-N
InChi Code
InChI=1S/C18H36O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-4-2/h3-17H2,1-2H3/i1D3,3D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2
Chemical Name
ethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-hentriacontadeuteriohexadecanoate
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: Please store this product in a sealed and protected environment (e.g. under nitrogen), avoid exposure to moisture and light.
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 : ~100 mg/mL (~316.79 mM)
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 2.5 mg/mL (7.92 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 3.5152 mL 17.5759 mL 35.1519 mL
5 mM 0.7030 mL 3.5152 mL 7.0304 mL
10 mM 0.3515 mL 1.7576 mL 3.5152 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

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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?
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  • 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:
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  • 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
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Definitions of molecular mass, molecular weight, molar mass and molar weight:
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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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