Physicochemical Properties
| Molecular Formula | C22H32N4O14P2 |
| Molecular Weight | 638.45548 |
| Exact Mass | 638.139 |
| CAS # | 118248-91-2 |
| PubChem CID | 60683 |
| Appearance | Light yellow to yellow solid powder |
| Density | 1.657g/cm3 |
| Boiling Point | 1049.1ºC at 760mmHg |
| Flash Point | 588.3ºC |
| Vapour Pressure | 0mmHg at 25°C |
| Index of Refraction | 1.655 |
| LogP | 0.132 |
| Hydrogen Bond Donor Count | 8 |
| Hydrogen Bond Acceptor Count | 18 |
| Rotatable Bond Count | 17 |
| Heavy Atom Count | 42 |
| Complexity | 907 |
| Defined Atom Stereocenter Count | 0 |
| InChi Key | SQKUFYLUXROIFM-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C22H32N4O14P2/c1-13-21(31)17(15(5-23-13)11-39-41(33,34)35)7-25(9-19(27)28)3-4-26(10-20(29)30)8-18-16(12-40-42(36,37)38)6-24-14(2)22(18)32/h5-6,31-32H,3-4,7-12H2,1-2H3,(H,27,28)(H,29,30)(H2,33,34,35)(H2,36,37,38) |
| Chemical Name | 2-[2-[carboxymethyl-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl]amino]ethyl-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl]amino]acetic 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 Note: Please store this product in a sealed and protected environment (e.g. under nitrogen), avoid exposure to moisture. |
| 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
| ln Vitro | Mangafodipir's active metabolite, fodipir, plays a role in mangafodipir-mediated cytoprotection against cell death caused by 7β-hydroxycholesterol. After 8 hours of therapy, fodipir (Dp-dp; dipyridine diphosphate; 100 μM) demonstrated optimum cytoprotective benefits against 7β-OH-mediated cell death. Additionally, fodipir decreases lysosomal membrane permeabilization (LMP) and ROS generation in cells caused by 7β-OH [1]. |
| References |
[1]. Fodipir and its dephosphorylated derivative dipyridoxyl ethyldiamine are involved in mangafodipir-mediated cytoprotection against 7β-hydroxycholesterol-induced cell death. Pharmacology. 2013;92(3-4):182-6. |
Solubility Data
| Solubility (In Vitro) | H2O : ~18.18 mg/mL (~28.47 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: 33.33 mg/mL (52.20 mM) in PBS (add these co-solvents sequentially from left to right, and one by one), clear solution; with sonication.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 1.5663 mL | 7.8313 mL | 15.6627 mL | |
| 5 mM | 0.3133 mL | 1.5663 mL | 3.1325 mL | |
| 10 mM | 0.1566 mL | 0.7831 mL | 1.5663 mL |