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7-Hydroxymethyl-10,11-MDCPT-d5

Cat No.:V83587 Purity: ≥98%
7-Hydroxymethyl-10,11-MDCPT-d5
7-Hydroxymethyl-10,11-MDCPT-d5 Chemical Structure Product category: Isotope-Labeled Compounds
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
1mg
Other Sizes
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Product Description
7-Hydroxymethyl-10,11-MDCPT-d5 is a deuterated derivative of 7-Hydroxymethyl-10,11-MDCPT and is a useful payload for ADC synthesis.
7-Hydroxymethyl-10,11-MDCPT-d5 is a deuterated camptothecin derivative engineered as a stable isotope-labeled internal standard (SIL-IS) for isotope dilution mass spectrometry. It serves a dual purpose: it retains the cytotoxic activity of the parent molecule, making it a candidate payload for antibody-drug conjugates (ADCs), while its stable isotope labeling enables its primary use as a precise internal standard in quantitative LC-MS/MS bioanalysis. The compound incorporates five deuterium atoms, resulting in a molecular mass shift from 422.39 g/mol to 427.42 g/mol.
Biological Activity I Assay Protocols (From Reference)
Targets
7-Hydroxymethyl-10,11-MDCPT-d5 serves as an analytical internal standard and an ADC payload, and thus does not have a defined pharmacological target in the traditional sense. Its primary function in research is to enable FDA/EMA-compliant bioanalytical method validation for ADC pharmacokinetic studies. It corrects for matrix effects, ion suppression, and sample preparation variability in plasma and tissue homogenates. As a camptothecin derivative, the parent molecule targets topoisomerase I, an enzyme involved in DNA replication and transcription.
ln Vitro
The in vitro activity of 7-Hydroxymethyl-10,11-MDCPT-d5 is defined by its role as a stable isotope-labeled internal standard for LC-MS/MS quantitation. Its +5 Da mass shift supports co-elution and matrix-effect correction. The compound supports metabolic stability assays (microsomal/hepatocyte) for intrinsic clearance determination. As a deuterated analog of a camptothecin derivative, it can be used in ADC payload research for cytotoxicity endpoint review and quantitative payload-release studies.
ln Vivo
The in vivo activity of 7-Hydroxymethyl-10,11-MDCPT-d5 is not directly applicable as a therapeutic agent, as it is primarily an analytical internal standard and research tool. However, its utility in ADC pharmacokinetic studies supports the in vivo quantification of ADC-released payloads. The deuterated internal standard enables accurate quantitation of payload release in plasma and tissue homogenates, which is critical for understanding ADC biodistribution and efficacy in animal models.
Enzyme Assay
The in vitro enzyme/receptor binding assay for 7-Hydroxymethyl-10,11-MDCPT-d5 is not applicable in the traditional sense, as the compound is an analytical internal standard rather than an enzyme inhibitor or receptor ligand. However, it is used in LC-MS/MS bioanalytical method validation where it co-elutes identically with the unlabeled analyte while remaining independently detectable via MS. The assay involves spiking the deuterated internal standard into plasma or tissue homogenate samples, followed by extraction and LC-MS/MS analysis to quantify the unlabeled payload.
Cell Assay
In vitro cell-based assays for 7-Hydroxymethyl-10,11-MDCPT-d5 are not directly applicable, as the compound is primarily an analytical internal standard. However, as a deuterated camptothecin derivative, it may be used in cytotoxicity assays to evaluate ADC payload activity. Cells are treated with the compound or ADC constructs containing this payload, and cell viability is measured using standard assays such as MTT or CellTiter-Glo. The deuterated form can also be used to track payload release and metabolism in cellular uptake studies.
Animal Protocol
In vivo animal studies for 7-Hydroxymethyl-10,11-MDCPT-d5 are conducted in the context of ADC pharmacokinetic studies. Animals are administered ADC constructs containing the unlabeled payload, and the deuterated compound is used as an internal standard for LC-MS/MS quantitation of the released payload in plasma and tissue homogenates. This enables accurate determination of pharmacokinetic parameters such as Cmax, AUC, and half-life. The internal standard corrects for matrix effects and sample preparation variability.
ADME/Pharmacokinetics
Pharmacokinetic properties of 7-Hydroxymethyl-10,11-MDCPT-d5 are characterized by its use as an internal standard for ADC pharmacokinetic studies. It has a molecular weight of 427.42 g/mol and a molecular formula of C22H13D5N2O7. The compound appears as a light yellow to yellow solid with ≥97% purity. Storage recommendations include -20°C, protected from light. The unlabeled CAS number is 428816-69-7. It is supplied for research use only and not for human therapeutic applications.
Toxicity/Toxicokinetics
Toxicity information for 7-Hydroxymethyl-10,11-MDCPT-d5 is limited in the available literature. As a research-use deuterated compound, standard safety precautions for handling should be followed. The compound is designated for research use only and is not for human therapeutic applications. It is a controlled substance and not for sale in certain territories. No detailed acute or chronic toxicity data are available from the search results.
References

[1].Cai JQ, Human anti-human HER3 antibodies and ADCs or drug conjugates for therapy, prevention and diagnosis of cancer or infection. 2023. WO2023143263

[2].Hydrophilic camptothecin analogs that form extremely stable cleavable complexes with DNA and topoisomerase I. Cancer Res. 2004 Sep 15;64(18):6679-83.

Additional Infomation
7-Hydroxymethyl-10,11-MDCPT-d5 is a deuterated camptothecin derivative that serves as a stable isotope-labeled internal standard for LC-MS/MS bioanalysis. It retains the cytotoxic activity of the parent molecule as an ADC payload while its stable isotope labeling enables precise quantitative analysis. The compound supports FDA/EMA-compliant bioanalytical method validation for ADC pharmacokinetic studies. It has a molecular weight of 427.42 g/mol and formula C22H13D5N2O7. It is intended for research use only.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C22H13D5N2O7
Molecular Weight
427.42
Appearance
Light yellow to yellow solid powder
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: This product requires protection from light (avoid light exposure) during transportation and storage.
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)
Typically soluble in DMSO (e.g. 10 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 2.3396 mL 11.6981 mL 23.3962 mL
5 mM 0.4679 mL 2.3396 mL 4.6792 mL
10 mM 0.2340 mL 1.1698 mL 2.3396 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
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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

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Note: Chemical formula is case sensitive: C12H18N3O4  c12h18n3o4
Instructions to calculate molar mass (molecular weight) of a chemical compound:
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Definitions of molecular mass, molecular weight, molar mass and molar weight:
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  • 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
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  • 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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