Physicochemical Properties
| Molecular Formula | C49H37CL2F10N2O10PS2 |
| Molecular Weight | 1169.82 |
| Exact Mass | 2339.169 |
| CAS # | 1786411-19-5 |
| Related CAS # | HKSOX-1m (5/6-mixture) (hydrobromide) |
| PubChem CID | 162642064 |
| Appearance | Typically exists as solid at room temperature |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 44 |
| Rotatable Bond Count | 26 |
| Heavy Atom Count | 152 |
| Complexity | 4150 |
| Defined Atom Stereocenter Count | 0 |
| InChi Key | GSKUONHKIPASJJ-UHFFFAOYSA-L |
| InChi Code | InChI=1S/2C49H36F10N2O10PS2.4ClH/c50-37-27-35-41(39(52)43(37)70-73(64,65)48(54,55)56)68-42-36(28-38(51)44(40(42)53)71-74(66,67)49(57,58)59)47(35)34-19-18-29(26-33(34)46(63)69-47)45(62)61-23-21-60(22-24-61)20-10-11-25-72(30-12-4-1-5-13-30,31-14-6-2-7-15-31)32-16-8-3-9-17-32;50-37-27-35-41(39(52)43(37)70-73(64,65)48(54,55)56)68-42-36(28-38(51)44(40(42)53)71-74(66,67)49(57,58)59)47(35)34-26-29(18-19-33(34)46(63)69-47)45(62)61-23-21-60(22-24-61)20-10-11-25-72(30-12-4-1-5-13-30,31-14-6-2-7-15-31)32-16-8-3-9-17-32;;;;/h2*1-9,12-19,26-28H,10-11,20-25H2;4*1H/q2*+1;;;;/p-2 |
| Chemical Name | triphenyl-[4-[4-[2',4',5',7'-tetrafluoro-1-oxo-3',6'-bis(trifluoromethylsulfonyloxy)spiro[2-benzofuran-3,9'-xanthene]-5-carbonyl]piperazin-1-yl]butyl]phosphanium;triphenyl-[4-[4-[2',4',5',7'-tetrafluoro-3-oxo-3',6'-bis(trifluoromethylsulfonyloxy)spiro[2-benzofuran-1,9'-xanthene]-5-carbonyl]piperazin-1-yl]butyl]phosphanium;dichloride;dihydrochloride |
| 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) |
Biological Activity
| ln Vitro | At very low laser power output conditions, HKSOX-1m (5/6-mixture) (10 μM) sensitively captures basal signals in differentiated human THP-1 cells and mitochondria stimulated by Antimycin A (1 μM). The signal of O2 (with an intensity of 514 nm excitation wavelength of Zeiss LSM 510 Meta being 1%), is captured. |
| References |
[1]. Fluorescent Probe HKSOX-1 for Imaging and Detection of Endogenous Superoxide in Live Cells and In Vivo. J Am Chem Soc . 2015 Jun 3;137(21):6837-43. |
Solubility Data
| Solubility (In Vitro) | DMSO: 55 mg/mL (47.02 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: 2.75 mg/mL (2.35 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 sonication. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 27.5 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.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 0.8548 mL | 4.2742 mL | 8.5483 mL | |
| 5 mM | 0.1710 mL | 0.8548 mL | 1.7097 mL | |
| 10 mM | 0.0855 mL | 0.4274 mL | 0.8548 mL |