Physicochemical Properties
Molecular Formula | C19H34NNAO5 |
Molecular Weight | 379.47 |
Exact Mass | 379.233 |
CAS # | 38517-37-2 |
PubChem CID | 23682081 |
Appearance | Typically exists as solid at room temperature |
LogP | 3.177 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 17 |
Heavy Atom Count | 26 |
Complexity | 390 |
Defined Atom Stereocenter Count | 1 |
SMILES | [Na+].CCCCCCCCCCCCCC(N[C@H](C([O-])=O)CCC(=O)O)=O |
InChi Key | ZNYIJXQYUNSKDX-NTISSMGPSA-M |
InChi Code | InChI=1S/C19H35NO5.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(21)20-16(19(24)25)14-15-18(22)23;/h16H,2-15H2,1H3,(H,20,21)(H,22,23)(H,24,25);/q;+1/p-1/t16-;/m0./s1 |
Chemical Name | sodium;(2S)-5-hydroxy-5-oxo-2-(tetradecanoylamino)pentanoate |
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) |
Biological Activity
References |
[1]. Face cream cleansers. |
Solubility Data
Solubility (In Vitro) |
DMSO : 2.5 mg/mL (6.59 mM) DMF : < 1 mg/mL |
Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 0.25 mg/mL (0.66 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 2.5 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: ≥ 0.25 mg/mL (0.66 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 2.5 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. Solubility in Formulation 3: ≥ 0.25 mg/mL (0.66 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 2.5 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 | 2.6353 mL | 13.1763 mL | 26.3525 mL | |
5 mM | 0.5271 mL | 2.6353 mL | 5.2705 mL | |
10 mM | 0.2635 mL | 1.3176 mL | 2.6353 mL |