Mal-PEG4-VA-PBD - CAS 2259318-50-6

Mal-PEG4-VA-PBD - CAS 2259318-50-6 Catalog number: BADC-00670

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Mal-PEG4-VA-PBD is a drug-linker conjugate for ADC by using the antitumor antibiotic, Pyrrolobenzodiazepine (PBD), linked via Mal-PEG4-VA.

Category
ADCs Cytotoxin
Product Name
Mal-PEG4-VA-PBD
CAS
2259318-50-6
Catalog Number
BADC-00670
Molecular Formula
C70H83N9O17
Molecular Weight
1322.46
Mal-PEG4-VA-PBD

Ordering Information

Catalog Number Size Price Quantity
BADC-00670 -- $-- Inquiry
Description
Mal-PEG4-VA-PBD is a drug-linker conjugate for ADC by using the antitumor antibiotic, Pyrrolobenzodiazepine (PBD), linked via Mal-PEG4-VA.
IUPAC Name
(2S)-N-[(2S)-1-[4-[(6aS)-3-[3-[[(6aS)-2-methoxy-8-(4-methoxyphenyl)-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]anilino]-1-oxopropan-2-yl]-2-[3-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-3-methylbutanamide
Canonical SMILES
C[C@@]12N(C(C3=CC(OC)=C(OCCCOC4=C(C=C5C(N=C[C@]6(C)N(C=C(C7=CC=C(OC)C=C7)C6)C5=O)=C4)OC)C=C3N=C2)=O)C=C(C8=CC=C(NC([C@H](C)NC([C@H](C(C)C)NC(CCOCCOCCOCCOCCNC(CCN9C(C=CC9=O)=O)=O)=O)=O)=O)C=C8)C1
InChI
InChI=1S/C68H79N9O17/c1-42(2)64(74-61(79)19-24-89-26-28-91-30-31-92-29-27-90-25-20-69-60(78)18-21-75-62(80)16-17-63(75)81)66(83)72-43(3)65(82)73-48-12-8-44(9-13-48)46-32-49-38-70-54-36-58(56(87-5)34-52(54)67(84)76(49)40-46)93-22-7-23-94-59-37-55-53(35-57(59)88-6)68(85)77-41-47(33-50(77)39-71-55)45-10-14-51(86-4)15-11-45/h8-17,34-43,49-50,64H,7,18-33H2,1-6H3,(H,69,78)(H,72,83)(H,73,82)(H,74,79)/t43-,49-,50-,64-/m0/s1
Shipping
Room temperature

Mal-PEG4-VA-PBD is a versatile bioconjugation reagent used primarily in targeted drug delivery and antibody-drug conjugates (ADCs) development. The compound features a maleimide (Mal) group for conjugation with thiol-containing molecules, such as peptides, antibodies, or proteins, a polyethylene glycol (PEG4) spacer to enhance solubility and pharmacokinetics, and a VA-PBD (valine-alanine-p-bromobenzyl) linker. This linker provides a cleavable bond that facilitates the controlled release of therapeutic agents under specific conditions, making it ideal for precise targeting in cancer therapy and other targeted treatments.

One of the key applications of Mal-PEG4-VA-PBD is in the creation of antibody-drug conjugates (ADCs) for cancer therapy. The maleimide group allows for the selective attachment of cytotoxic drugs to monoclonal antibodies that target specific tumor antigens, ensuring the precise delivery of the drug to the tumor site. The PEG4 spacer improves solubility and circulation time, while the VA-PBD linker enables the selective release of the drug once the conjugate is internalized into the target cells. The VA-PBD bond is cleaved by intracellular enzymes, allowing for the controlled release of the therapeutic agent, minimizing systemic toxicity, and enhancing the therapeutic efficacy of the ADC.

Mal-PEG4-VA-PBD is also useful in the design of targeted drug delivery systems for other therapeutic agents, such as small molecules, nucleic acids, or gene therapies. The PEG4 spacer enhances the solubility, stability, and pharmacokinetics of the conjugate, which is critical for ensuring effective delivery to target tissues. The VA-PBD linker provides a mechanism for controlled release in response to specific enzymatic activity, which is beneficial for precision medicine applications. This feature ensures that therapeutic agents are delivered precisely to diseased tissues, such as tumors or infected areas, while reducing off-target effects and enhancing treatment specificity.

In addition to drug delivery, Mal-PEG4-VA-PBD has applications in biomolecule conjugation and labeling for research and diagnostic purposes. The maleimide group enables the covalent attachment of peptides or proteins to other biomolecules, while the PEG4 spacer ensures the conjugated molecules remain soluble and stable. The VA-PBD linker also allows for bioorthogonal reactions, making it suitable for applications in proteomics, molecular imaging, and biomarker studies. By providing controlled release and precise targeting, Mal-PEG4-VA-PBD is an invaluable tool for studying protein interactions, cellular processes, and disease mechanisms in various biomedical research fields.

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

Historical Records: Mal-PEG4-VA-PBD
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