Compound ID | 2940

Update compound information

MBX-3132

Synonym(s): MBX 3132  |  MBX3132

Class: Drug efflux pump inhibitor

Agent Type: Synthetic; Small molecule; Direct acting; Antibiotic adjuvant;
Spectrum of activity: Gram-negative
Mechanism of action: Efflux pump inhibitor. AcrB inhibitor
Target Pathogen: Active against Escherichia coli
Description: Synthetic compound; reduces MIC of levofloxacin and piperacillin; shows moderate toxicity to HeLa cells ; shows no intrinsic antibacterial activity
Institute where first reported: Microbiotix, Inc., One Innovation Dr., Worcester, MA 01605, USA
Year first mentioned: 2016
Development status: Experimental
Chemical structure(s):
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Molecular weight: 494.65
Iso. SMILES: CC1CN(CC(C)O1)C2=NC(SCCC3=CC=C(NC(=O)C)C=C3)=C(C#N)C=4CC(C)(C)OCC24
InChI Key: CURFTJWFXMRQDQ-UHFFFAOYSA-N
Can. SMILES: CC1CN(CC(C)O1)C2=NC(=C(C#N)C3=C2COC(C)(C)C3)SCCC4=CC=C(C=C4)NC(=O)C
InChI: InChI=1S/C27H34N4O3S/c1-17-14-31(15-18(2)34-17)25-24-16-33-27(4,5)12-22(24)23(13-28)26(30-25)35-11-10-20-6-8-21(9-7-20)29-19(3)32/h6-9,17-18H,10-12,14-16H2,1-5H3,(H,29,32)
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/substance/355288332
Citations:
  • https://www.sciencedirect.com/science/article/pii/S0968089615001832?via%3Dihub
  • https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9854755/#B65-antibiotics-12-00180

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