Physicochemical Properties
| Molecular Formula | C6H10O7 |
| Molecular Weight | 194.1394 |
| Exact Mass | 194.042 |
| CAS # | 6556-12-3 |
| Related CAS # | 36655-86-4 |
| PubChem CID | 65041 |
| Appearance | White to off-white solid powder |
| Density | 2.0±0.1 g/cm3 |
| Boiling Point | 495.2±45.0 °C at 760 mmHg |
| Melting Point | 159-161ºC(lit.) |
| Flash Point | 211.1±22.2 °C |
| Vapour Pressure | 0.0±2.9 mmHg at 25°C |
| Index of Refraction | 1.685 |
| LogP | -2.88 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Heavy Atom Count | 13 |
| Complexity | 191 |
| Defined Atom Stereocenter Count | 4 |
| SMILES | O([H])[C@]([H])([C@@]([H])(C(=O)O[H])O[H])[C@@]([H])([C@]([H])(C([H])=O)O[H])O[H] |
| InChi Key | IAJILQKETJEXLJ-QTBDOELSSA-N |
| InChi Code | InChI=1S/C6H10O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h1-5,8-11H,(H,12,13)/t2-,3+,4-,5-/m0/s1 |
| Chemical Name | (2S,3S,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoic 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 |
| 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
| Additional Infomation |
Aldehydo-D-glucuronic acid is a D-glucuronic acid. It is functionally related to an aldehydo-D-glucose. It is a conjugate acid of an aldehydo-D-glucuronate. (2S,3S,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoic acid has been reported in Codonopsis pilosula, Streptomyces, and other organisms with data available. A sugar acid formed by the oxidation of the C-6 carbon of GLUCOSE. In addition to being a key intermediate metabolite of the uronic acid pathway, glucuronic acid also plays a role in the detoxification of certain drugs and toxins by conjugating with them to form GLUCURONIDES. See also: D-Glucuronic Acid (annotation moved to). |
Solubility Data
| Solubility (In Vitro) |
H2O : ~100 mg/mL (~515.09 mM) DMSO : ~33.33 mg/mL (~171.68 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (12.88 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 25.0 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 2: ≥ 2.5 mg/mL (12.88 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. Solubility in Formulation 3: 100 mg/mL (515.09 mM) in PBS (add these co-solvents sequentially from left to right, and one by one), clear solution; with ultrasonication. (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 5.1509 mL | 25.7546 mL | 51.5092 mL | |
| 5 mM | 1.0302 mL | 5.1509 mL | 10.3018 mL | |
| 10 mM | 0.5151 mL | 2.5755 mL | 5.1509 mL |