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DL-Homocystine

DL-Homocystine is composed of two molecules of homocysteine, which is believed to play an important role in the pathogenesis and pathophysiology of schizophrenia.
DL-Homocystine
DL-Homocystine Chemical Structure CAS No.: 870-93-9
Product category: New1
This product is for research use only, not for human use. We do not sell to patients.
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Product Description
DL-Homocystine is composed of two molecules of homocysteine, which is believed to play an important role in the pathogenesis and pathophysiology of schizophrenia.
DL-Homocystine is the oxidized dimeric form of homocysteine, composed of two molecules of homocysteine linked by a disulfide bond, with the molecular formula C8H16N2O4S2 and molecular weight 268.35 g/mol.
Biological Activity I Assay Protocols (From Reference)
Targets
DL-Homocystine is a metabolite and a mutagen secreted by Fusobacterium nucleatum; homocysteine, its reduced monomer, is recognized as an important substance in the pathogenesis and pathophysiology of schizophrenia and hyperhomocysteinemia-related disorders.
ln Vitro
In vitro studies demonstrate that DL-Homocystine and homocysteine can induce cellular stress and have been implicated in various pathological conditions; DL-Homocystine is used as a research tool to study homocysteine metabolism and its effects on cellular function.
ln Vivo
In vivo, hyperhomocysteinemia induces tissue-specific accumulation of homocysteine in bone by collagen binding, adversely affecting bone health; DL-Homocystine serves as a model compound for studying homocysteine-related pathologies in animal models.
Enzyme Assay
The in vitro enzyme assay for homocysteine metabolism involves incubating DL-Homocystine with homocysteine-metabolizing enzymes such as methionine synthase or cystathionine β-synthase, measuring the conversion of homocysteine to methionine or cystathionine using HPLC or LC-MS/MS, with kinetic parameters determined from substrate concentration curves.
Cell Assay
In vitro cell culture studies utilize various cell lines (e.g., neuronal cells, endothelial cells, osteoblasts) treated with DL-Homocystine or homocysteine at concentrations relevant to hyperhomocysteinemia (50-500 μM), assessing cell viability, oxidative stress markers (ROS, glutathione), apoptosis, and gene expression changes related to homocysteine metabolism and toxicity.
Animal Protocol
In vivo animal experiments involve dietary or genetic induction of hyperhomocysteinemia in rodents (e.g., methionine-rich diet or cystathionine β-synthase knockout mice), with administration of DL-Homocystine to study its effects on bone density, cognitive function, vascular health, and assessment of tissue homocysteine levels via HPLC.
ADME/Pharmacokinetics
DL-Homocystine is a solid compound with a melting point >300°C, recommended for long-term storage in a cool, dry place below 15°C; it is sparingly soluble in water and more soluble in acidic or basic solutions, with purity typically ≥98% (HPLC).
Toxicity/Toxicokinetics
Toxicological studies indicate that elevated homocysteine levels are associated with increased risk of cardiovascular disease, neurodegeneration, and bone disorders; DL-Homocystine itself is a research compound, and its toxicity is related to the biological effects of homocysteine accumulation.
References

[1]. Homocysteine and schizophrenia: from prenatal to adult life. Prog Neuropsychopharmacol Biol Psychiatry. 2005 Sep;29(7):1175-80.

Additional Infomation
Homocysteine is an organic disulfide obtained by the oxidative dimerization of homocysteine. It is a human metabolic product and also a zwitterion of homocysteine. DL-homocysteine has been reported to exist in Homo sapiens and Trypanosoma brevicornu, and relevant data are available for reference.
DL-Homocystine is a research compound used in studies of homocysteine metabolism, schizophrenia pathophysiology, and hyperhomocysteinemia-related disorders; it serves as a reference standard for analytical chemistry and a tool for investigating the role of homocysteine in disease pathogenesis.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C8H16N2O4S2
Molecular Weight
268.3536
Exact Mass
268.055
CAS #
870-93-9
PubChem CID
10010
Appearance
White to off-white solid powder
Density
1.4±0.1 g/cm3
Boiling Point
507.6±50.0 °C at 760 mmHg
Melting Point
≥300 °C
Flash Point
260.8±30.1 °C
Vapour Pressure
0.0±2.8 mmHg at 25°C
Index of Refraction
1.619
LogP
1.03
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
8
Rotatable Bond Count
9
Heavy Atom Count
16
Complexity
216
Defined Atom Stereocenter Count
0
InChi Key
ZTVZLYBCZNMWCF-UHFFFAOYSA-N
InChi Code
InChI=1S/C8H16N2O4S2/c9-5(7(11)12)1-3-15-16-4-2-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)
Chemical Name
2-amino-4-[(3-amino-3-carboxypropyl)disulfanyl]butanoic 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)
Solubility Data
Solubility (In Vitro)
H2O : ~10 mg/mL (~37.26 mM)
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
(e.g. IP/IV/IM/SC)
Injection Formulation 1: DMSO : Tween 80: Saline = 10 : 5 : 85 (i.e. 100 μL DMSO stock solution 50 μL Tween 80 850 μL Saline)
*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 : PEG300Tween 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).
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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)]
*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.
Injection Formulation 5: 2-Hydroxypropyl-β-cyclodextrin : Saline = 50 : 50 (i.e. 500 μL 2-Hydroxypropyl-β-cyclodextrin 500 μL Saline)
Injection Formulation 6: DMSO : PEG300 : castor oil : Saline = 5 : 10 : 20 : 65 (i.e. 50 μL DMSO 100 μLPEG300 200 μL castor oil 650 μL Saline)
Injection Formulation 7: Ethanol : Cremophor : Saline = 10: 10 : 80 (i.e. 100 μL Ethanol 100 μL Cremophor 800 μL Saline)
Injection Formulation 8: Dissolve in Cremophor/Ethanol (50 : 50), then diluted by Saline
Injection Formulation 9: EtOH : Corn oil = 10 : 90 (i.e. 100 μL EtOH 900 μL Corn oil)
Injection Formulation 10: EtOH : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL EtOH 400 μLPEG300 50 μL Tween 80 450 μL 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).
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Oral Formulation 3: Dissolved in PEG400
Oral Formulation 4: Suspend in 0.2% Carboxymethyl cellulose
Oral Formulation 5: Dissolve in 0.25% Tween 80 and 0.5% Carboxymethyl cellulose
Oral Formulation 6: Mixing with food powders


Note: Please be aware that the above formulations are for reference only. InvivoChem strongly recommends customers to read literature methods/protocols carefully before determining which formulation you should use for in vivo studies, as different compounds have different solubility properties and have to be formulated differently.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 3.7265 mL 18.6324 mL 37.2648 mL
5 mM 0.7453 mL 3.7265 mL 7.4530 mL
10 mM 0.3726 mL 1.8632 mL 3.7265 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.

Calculator

Molarity Calculator allows you to calculate the mass, volume, and/or concentration required for a solution, as detailed below:

  • Calculate the Mass of a compound required to prepare a solution of known volume and concentration
  • Calculate the Volume of solution required to dissolve a compound of known mass to a desired concentration
  • Calculate the Concentration of a solution resulting from a known mass of compound in a specific volume
An example of molarity calculation using the molarity calculator is shown below:
What is the mass of compound required to make a 10 mM stock solution in 5 ml of DMSO given that the molecular weight of the compound is 350.26 g/mol?
  • Enter 350.26 in the Molecular Weight (MW) box
  • Enter 10 in the Concentration box and choose the correct unit (mM)
  • Enter 5 in the Volume box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 17.513 mg appears in the Mass box. In a similar way, you may calculate the volume and concentration.

Dilution Calculator allows you to calculate how to dilute a stock solution of known concentrations. For example, you may Enter C1, C2 & V2 to calculate V1, as detailed below:

What volume of a given 10 mM stock solution is required to make 25 ml of a 25 μM solution?
Using the equation C1V1 = C2V2, where C1=10 mM, C2=25 μM, V2=25 ml and V1 is the unknown:
  • Enter 10 into the Concentration (Start) box and choose the correct unit (mM)
  • Enter 25 into the Concentration (End) box and select the correct unit (mM)
  • Enter 25 into the Volume (End) box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 62.5 μL (0.1 ml) appears in the Volume (Start) box
g/mol

Molecular Weight Calculator allows you to calculate the molar mass and elemental composition of a compound, as detailed below:

Note: Chemical formula is case sensitive: C12H18N3O4  c12h18n3o4
Instructions to calculate molar mass (molecular weight) of a chemical compound:
  • To calculate molar mass of a chemical compound, please enter the chemical/molecular formula and click the “Calculate’ button.
Definitions of molecular mass, molecular weight, molar mass and molar weight:
  • Molecular mass (or molecular weight) is the mass of one molecule of a substance and is expressed in the unified atomic mass units (u). (1 u is equal to 1/12 the mass of one atom of carbon-12)
  • Molar mass (molar weight) is the mass of one mole of a substance and is expressed in g/mol.
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Reconstitution Calculator allows you to calculate the volume of solvent required to reconstitute your vial.

  • Enter the mass of the reagent and the desired reconstitution concentration as well as the correct units
  • Click the “Calculate” button
  • The answer appears in the Volume (to add to vial) box
In vivo Formulation Calculator (Clear solution)
Step 1: Enter information below (Recommended: An additional animal to make allowance for loss during the experiment)
Step 2: Enter in vivo formulation (This is only a calculator, not the exact formulation for a specific product. Please contact us first if there is no in vivo formulation in the solubility section.)
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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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