D13-9001

TargetMol
Product Code: TAR-T10944
Supplier: TargetMol
CodeSizePrice
TAR-T10944-5mg5mg£850.00
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Overview

Regulatory Status: RUO
Shipping:
cool pack
Storage:
-20℃

Images

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Further Information

Bioactivity:
The KD values of D13-9001 in Escherichia coli and Pseudomonas aeruginosa were 1.15μM and 3.57μM, respectively. D13-9001 has antibiotic activity. It is an effective AcrB (AcrAB-TolC efflux pump subunit) and MexB (MexAB-OprM efflux pump subunit) inhibitor.
CAS:
957471-96-4
Formula:
C31H39N11O6S
Molecular Weight:
693.78
Purity:
0.98
SMILES:
CC(C)(C)c1csc(NC(=O)c2ccn3c(c2)nc(N2CCC[C@H](C2)OC(=O)NCC[N+](C)(C)CC([O-])=O)c(C=Cc2nnn[nH]2)c3=O)n1

References

1. Opperman TJ, et al. Recent advances toward a molecular mechanism of efflux pump inhibition. Front Microbiol. 2015 May 5; 6:421. 2. Zuo Z, et al. Insights into the Inhibitory Mechanism of D13-9001 to the Multidrug Transporter AcrB through Molecular Dynamics Simulations. J Phys Chem B. 2016 Mar 10;120(9):2145-54. 3. Yoshida K, et al. MexAB-OprM specific efflux pump inhibitors in Pseudomonas aeruginosa. Part 7: highly soluble and in vivo active quaternary ammonium analogue D13-9001, a potential preclinical candidate. Bioorg Med Chem. 2007 Nov 15;15(22):7087-97.