Physicochemical Properties
| Molecular Formula | C13H19N5O5 |
| Molecular Weight | 325.32 |
| Exact Mass | 325.139 |
| Elemental Analysis | C, 48.00; H, 5.89; N, 21.53; O, 24.59 |
| CAS # | 168427-74-5 |
| PubChem CID | 11393191 |
| Appearance | White to off-white solid powder |
| Density | 1.701g/cm3 |
| Boiling Point | 638.954ºC at 760 mmHg |
| Flash Point | 340.227ºC |
| Vapour Pressure | 0mmHg at 25°C |
| Index of Refraction | 1.72 |
| LogP | -0.7 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 6 |
| Heavy Atom Count | 23 |
| Complexity | 392 |
| Defined Atom Stereocenter Count | 4 |
| SMILES | COCCO[C@@H]1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=CN=C32)N)CO)O |
| InChi Key | PUDXUJRJLRLJIU-QYVSTXNMSA-N |
| InChi Code | InChI=1S/C13H19N5O5/c1-21-2-3-22-10-9(20)7(4-19)23-13(10)18-6-17-8-11(14)15-5-16-12(8)18/h5-7,9-10,13,19-20H,2-4H2,1H3,(H2,14,15,16)/t7-,9-,10-,13-/m1/s1 |
| Chemical Name | (2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-(2-methoxyethoxy)oxolan-3-ol |
| Synonyms | 2'-O-(2-Methoxyethyl)adenosine; 2'-O-(2-Methoxyethyl)-adenosine; Adenosine, 2'-O-(2-methoxyethyl)-; 2'-MOE-Adenosine |
| 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: This product requires protection from light (avoid light exposure) during transportation and storage. |
| 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]. Chemo-enzymatic synthesis of 2'-O-methoxyethyl ribonucleosides using a phosphodiesterase from Serratia marcescens. Appl Microbiol Biotechnol. 2005;66(5):512-519./a > |
Solubility Data
| Solubility (In Vitro) | DMSO : ~250 mg/mL (~768.5 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.08 mg/mL (6.39 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 20.8 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: 2.08 mg/mL (6.39 mM) in 10% DMSO + 90% (20% SBE-β-CD in Saline) (add these co-solvents sequentially from left to right, and one by one), suspension solution; with ultrasonication. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 20.8 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: ≥ 2.08 mg/mL (6.39 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 20.8 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 | 3.0739 mL | 15.3695 mL | 30.7390 mL | |
| 5 mM | 0.6148 mL | 3.0739 mL | 6.1478 mL | |
| 10 mM | 0.3074 mL | 1.5369 mL | 3.0739 mL |