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| Other Sizes |
| Targets |
Sodium Glucoheptonate targets metal ions as a chelating agent. The compound's multiple hydroxyl groups and carboxylate group provide coordination sites for binding metal ions such as calcium, magnesium, iron, and other transition metals. This chelating property makes it useful for industrial applications including metal cleaning and fiber processing. Its targets are chemical rather than biological, as it is primarily used in industrial applications rather than as a therapeutic agent.
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| ln Vitro |
In vitro studies of Sodium Glucoheptonate have focused on its role as a chelating agent and its industrial applications. The compound's ability to form stable complexes with metal ions has been characterized. Its solubility in water (freely soluble) supports its use in various applications. These in vitro studies provide foundational data for understanding the compound's utility in industrial and research applications.
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| ln Vivo |
Tc-99m glucoheptonate shows a fairly constant blood level and quick blood clearance[2].
In vivo studies of Sodium Glucoheptonate are limited as the compound is primarily used in industrial applications rather than as a therapeutic agent. The compound is not intended for administration to living organisms for pharmacological evaluation. Its applications are limited to industrial uses including cleaning metal, mercerizing, and paint stripping. The compound is not approved for human therapeutic use. |
| Enzyme Assay |
In vitro chemical assays for Sodium Glucoheptonate involve testing its chelating properties. The compound's ability to bind metal ions is assessed using spectroscopic or analytical methods. Its purity (≥95%) and identity are confirmed using analytical chemistry methods such as high-performance liquid chromatography and mass spectrometry. All assays are performed with appropriate controls and standardized protocols to ensure reproducibility of results.
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| Cell Assay |
In vitro cell-based assays are not applicable for Sodium Glucoheptonate as the compound is primarily used in industrial applications rather than as a biological agent. The compound is not intended for cell-based studies as a direct pharmacological agent. Its applications are limited to industrial uses including metal cleaning and fiber processing. Cell-based assays may be used for toxicology assessment, but the compound is not studied as a therapeutic agent.
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| Animal Protocol |
In vivo animal experiments for Sodium Glucoheptonate would be conducted for toxicology and safety assessment. Animals would be administered the compound and observed for signs of toxicity. Parameters assessed would include body weight, organ weights, and histopathology. Control groups receiving vehicle alone would be included for comparison. All procedures would comply with institutional animal care and use committee guidelines. Comprehensive in vivo studies are not well documented.
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| ADME/Pharmacokinetics |
The pharmacokinetic properties of Sodium Glucoheptonate reflect its nature as a water-soluble organic compound. It has a molecular weight of 248.16 and the molecular formula C7H13NaO8. The compound is freely soluble in water and appears as a white powder. As a hydrophilic compound, it has limited absorption through the gastrointestinal tract and is expected to be excreted through the kidneys.
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| Toxicity/Toxicokinetics |
The toxicity profile of Sodium Glucoheptonate has been evaluated in the context of its industrial use. The compound is an irritant to skin and eyes. It has a purity of ≥95%. Proper handling procedures including use of personal protective equipment are recommended when working with the compound. The compound is not approved for human therapeutic use and is intended for industrial and research purposes only.
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| References |
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| Additional Infomation |
Sodium Glucoheptonate (CAS# 31138-65-5) is also known as glucoheptonic acid sodium salt, sodium glucoheptonate dihydrate. It has the molecular formula C7H13NaO8 and a molecular weight of 248.16. The compound is a water-soluble organic compound derived from glucose that acts as a chelating agent forming stable complexes with metal ions. It is used for cleaning metal, mercerizing, paint stripping, and aluminum etching. The compound appears as a white powder and is freely soluble in water.
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| Molecular Formula |
C7H13NAO8
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|---|---|
| Molecular Weight |
248.16
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| Exact Mass |
248.05
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| CAS # |
31138-65-5
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| PubChem CID |
23707505
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| Appearance |
Typically exists as solid at room temperature
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| Boiling Point |
727.8ºC at 760mmHg
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| Melting Point |
177 °C
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| Flash Point |
407.9ºC
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| Index of Refraction |
132.5 ° (C=1, H2O)
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| Hydrogen Bond Donor Count |
6
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| Hydrogen Bond Acceptor Count |
8
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| Rotatable Bond Count |
6
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| Heavy Atom Count |
16
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| Complexity |
213
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| Defined Atom Stereocenter Count |
4
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| SMILES |
[Na+].OC[C@H]([C@H]([C@@H]([C@H](C(C([O-])=O)O)O)O)O)O
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| InChi Key |
FMYOMWCQJXWGEN-BMZZJELJSA-M
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| InChi Code |
InChI=1S/C7H14O8.Na/c8-1-2(9)3(10)4(11)5(12)6(13)7(14)15;/h2-6,8-13H,1H2,(H,14,15);/q;+1/p-1/t2-,3-,4+,5-,6?;/m1./s1
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| Chemical Name |
sodium;(3R,4S,5R,6R)-2,3,4,5,6,7-hexahydroxyheptanoate
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| HS Tariff Code |
2934.99.9001
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| 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, 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)
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| Solubility (In Vitro) |
H2O: 83.33 mg/mL (335.79 mM)
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|---|---|
| Solubility (In Vivo) |
Note: Listed below are some common formulations that may be used to formulate products with low water solubility (e.g. < 1 mg/mL), you may test these formulations using a minute amount of products to avoid loss of samples.
Injection Formulations
Injection Formulation 1: DMSO : Tween 80： Saline = 10 : 5 : 85 (i.e. 100 μL DMSO stock solution → 50 μL Tween 80 → 850 μL Saline)(e.g. IP/IV/IM/SC) *Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH ₂ O to obtain a clear solution. Injection Formulation 2: DMSO : PEG300 ：Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL DMSO → 400 μLPEG300 → 50 μL Tween 80 → 450 μL Saline) Injection Formulation 3: DMSO : Corn oil = 10 : 90 (i.e. 100 μL DMSO → 900 μL Corn oil) Example: Take the Injection Formulation 3 (DMSO : Corn oil = 10 : 90) as an example, if 1 mL of 2.5 mg/mL working solution is to be prepared, you can take 100 μL 25 mg/mL DMSO stock solution and add to 900 μL corn oil, mix well to obtain a clear or suspension solution (2.5 mg/mL, ready for use in animals). View More
Injection Formulation 4: DMSO : 20% SBE-β-CD in saline = 10 : 90 [i.e. 100 μL DMSO → 900 μL (20% SBE-β-CD in saline)] Oral Formulations
Oral Formulation 1: Suspend in 0.5% CMC Na (carboxymethylcellulose sodium) Oral Formulation 2: Suspend in 0.5% Carboxymethyl cellulose Example: Take the Oral Formulation 1 (Suspend in 0.5% CMC Na) as an example, if 100 mL of 2.5 mg/mL working solution is to be prepared, you can first prepare 0.5% CMC Na solution by measuring 0.5 g CMC Na and dissolve it in 100 mL ddH2O to obtain a clear solution; then add 250 mg of the product to 100 mL 0.5% CMC Na solution, to make the suspension solution (2.5 mg/mL, ready for use in animals). View More
Oral Formulation 3: Dissolved in PEG400 (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 4.0297 mL | 20.1483 mL | 40.2966 mL | |
| 5 mM | 0.8059 mL | 4.0297 mL | 8.0593 mL | |
| 10 mM | 0.4030 mL | 2.0148 mL | 4.0297 mL |
*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles.
Calculation results
Working concentration： mg/mL；
Method for preparing DMSO stock solution： mg drug pre-dissolved in μL DMSO (stock solution concentration mg/mL). Please contact us first if the concentration exceeds the DMSO solubility of the batch of drug.
Method for preparing in vivo formulation:：Take μL DMSO stock solution, next add μL PEG300, mix and clarify, next addμL Tween 80, mix and clarify, next add μL ddH2O，mix and clarify.
(1) Please be sure that the solution is clear before the addition of next solvent. Dissolution methods like vortex, ultrasound or warming and heat may be used to aid dissolving.
(2) Be sure to add the solvent(s) in order.
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