PBP2 | G-quadruplex Inducer

MedKoo Cat#: 564601 | Name: PBP2

Description:

WARNING: This product is for research use only, not for human or veterinary use.

PBP2 is a selective inducer of G-quadruplex structures from the unstructured single-stranded DNA conformations. PBP2 downregulates BCL-2 gene expression in cancer cells.

Chemical Structure

PBP2

CAS#NONE

Theoretical Analysis

MedKoo Cat#: 564601

Name: PBP2

CAS#: NONE

Chemical Formula: C40H48N14O5

Exact Mass: 804.3932

Molecular Weight: 804.92

Elemental Analysis: C, 59.69; H, 6.01; N, 24.36; O, 9.94

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.

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Related CAS #

No Data

Synonym

PBP-2; PBP 2; PBP2

IUPAC/Chemical Name

4-(3-(Dimethylamino)propoxy)-N2,N6-bis((1-(3-((S)-pyrrolidine-2-carboxamido)phenyl)-1H-1,2,3-triazol-4-yl)methyl)pyridine-2,6-dicarboxamide

InChi Key

NYJFNUFXVSTIQP-HEVIKAOCSA-N

InChi Code

InChI=1S/C40H48N14O5/c1-52(2)16-7-17-59-32-20-35(37(55)43-22-28-24-53(50-48-28)30-10-3-8-26(18-30)45-39(57)33-12-5-14-41-33)47-36(21-32)38(56)44-23-29-25-54(51-49-29)31-11-4-9-27(19-31)46-40(58)34-13-6-15-42-34/h3-4,8-11,18-21,24-25,33-34,41-42H,5-7,12-17,22-23H2,1-2H3,(H,43,55)(H,44,56)(H,45,57)(H,46,58)/t33-,34-/m0/s1

SMILES Code

O=C(C1=NC(C(NCC2=CN(C3=CC=CC(NC([C@H]4NCCC4)=O)=C3)N=N2)=O)=CC(OCCCN(C)C)=C1)NCC5=CN(C6=CC=CC(NC([C@H]7NCCC7)=O)=C6)N=N5

Appearance

Solid powder

Purity

>98% (or refer to the Certificate of Analysis)

Shipping Condition

Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition

Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility

Soluble in DMSO

Shelf Life

>3 years if stored properly

Drug Formulation

This drug may be formulated in DMSO

Stock Solution Storage

0 - 4 C for short term (days to weeks), or -20 C for long term (months).

HS Tariff Code

2934.99.03.00

More Info

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 804.92 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Concentration / Solvent Volume / Mass	1 mg	5 mg	10 mg
1 mM	1.15 mL	5.76 mL	11.51 mL
5 mM	0.23 mL	1.15 mL	2.3 mL
10 mM	0.12 mL	0.58 mL	1.15 mL
50 mM	0.02 mL	0.12 mL	0.23 mL

1: Lange F, Pfennigwerth N, Höfken LM, Gatermann SG, Kaase M. Characterization of mutations in Escherichia coli PBP2 leading to increased carbapenem MICs. J Antimicrob Chemother. 2018 Nov 27. doi: 10.1093/jac/dky476. [Epub ahead of print] PubMed PMID: 30496417. 2: Rohs PDA, Buss J, Sim SI, Squyres GR, Srisuknimit V, Smith M, Cho H, Sjodt M, Kruse AC, Garner EC, Walker S, Kahne DE, Bernhardt TG. A central role for PBP2 in the activation of peptidoglycan polymerization by the bacterial cell elongation machinery. PLoS Genet. 2018 Oct 18;14(10):e1007726. doi: 10.1371/journal.pgen.1007726. eCollection 2018 Oct. PubMed PMID: 30335755; PubMed Central PMCID: PMC6207328. 3: Thakur SD, Levett PN, Horsman GB, Dillon JR. Association of Neisseria gonorrhoeae genogroups and specific PBP2/MtrR/PorB mutation patterns with susceptibility to penicillin in a susceptible gonococcal population. J Antimicrob Chemother. 2018 Oct 1;73(10):2682-2686. doi: 10.1093/jac/dky233. PubMed PMID: 29992304. 4: Ábrók M, Lázár A, Szécsényi M, Deák J, Urbán E. Combination of MALDI-TOF MS and PBP2' latex agglutination assay for rapid MRSA detection. J Microbiol Methods. 2018 Jan;144:122-124. doi: 10.1016/j.mimet.2017.11.021. Epub 2017 Nov 24. PubMed PMID: 29180272. 5: Contreras-Martel C, Martins A, Ecobichon C, Trindade DM, Matteï PJ, Hicham S, Hardouin P, Ghachi ME, Boneca IG, Dessen A. Molecular architecture of the PBP2-MreC core bacterial cell wall synthesis complex. Nat Commun. 2017 Oct 3;8(1):776. doi: 10.1038/s41467-017-00783-2. PubMed PMID: 28974686; PubMed Central PMCID: PMC5626683. 6: Ferrer-González E, Kaul M, Parhi AK, LaVoie EJ, Pilch DS. β-Lactam Antibiotics with a High Affinity for PBP2 Act Synergistically with the FtsZ-Targeting Agent TXA707 against Methicillin-Resistant Staphylococcus aureus. Antimicrob Agents Chemother. 2017 Aug 24;61(9). pii: e00863-17. doi: 10.1128/AAC.00863-17. Print 2017 Sep. PubMed PMID: 28630190; PubMed Central PMCID: PMC5571351. 7: Moya B, Barcelo IM, Bhagwat S, Patel M, Bou G, Papp-Wallace KM, Bonomo RA, Oliver A. WCK 5107 (Zidebactam) and WCK 5153 Are Novel Inhibitors of PBP2 Showing Potent "β-Lactam Enhancer" Activity against Pseudomonas aeruginosa, Including Multidrug-Resistant Metallo-β-Lactamase-Producing High-Risk Clones. Antimicrob Agents Chemother. 2017 May 24;61(6). pii: e02529-16. doi: 10.1128/AAC.02529-16. Print 2017 Jun. PubMed PMID: 28289035; PubMed Central PMCID: PMC5444176. 8: Doumith M, Mushtaq S, Livermore DM, Woodford N. New insights into the regulatory pathways associated with the activation of the stringent response in bacterial resistance to the PBP2-targeted antibiotics, mecillinam and OP0595/RG6080. J Antimicrob Chemother. 2016 Oct;71(10):2810-4. doi: 10.1093/jac/dkw230. Epub 2016 Jun 20. PubMed PMID: 27330062. 9: Aissa N, Mayer N, Bert F, Labia R, Lozniewski A, Nicolas-Chanoine MH. A new mechanism to render clinical isolates of Escherichia coli non-susceptible to imipenem: substitutions in the PBP2 penicillin-binding domain. J Antimicrob Chemother. 2016 Jan;71(1):76-9. doi: 10.1093/jac/dkv318. Epub 2015 Oct 12. PubMed PMID: 26462991. 10: Ladwig N, Franz-Wachtel M, Hezel F, Soufi B, Macek B, Wohlleben W, Muth G. Control of Morphological Differentiation of Streptomyces coelicolor A3(2) by Phosphorylation of MreC and PBP2. PLoS One. 2015 Apr 30;10(4):e0125425. doi: 10.1371/journal.pone.0125425. eCollection 2015. PubMed PMID: 25927987; PubMed Central PMCID: PMC4416010.