Compound ID | 3071

Update compound information

SM-5

Class: Cell wall synthesis inhibitor

Spectrum of activity: Gram-positive
Details of activity: Active against methicillin-resistant Staphylococcus aureus; binds to lipoteichoic acid synthase, PBP2A (highest affinity), and PBP4
Description: Synthetic compound; chlorophenyl pyrrolo benzodiazepine; cytotoxicity towards L929 cell line at IC50 250 ug/ml vs MIC at 7.81 ug/ml
Institute where first reported: Department of Bioscience and Biotechnology, Indian Institute of Technology Kharagpur, Kharagpur, 721302, WB, India
Year first mentioned: 2024
Development status: Experimental
Chemical structure(s):
Click here for structure editor
Molecular weight: 513.03
Iso. SMILES: [H]C1(C2=CC=C(Cl)C=C2)C3=C4C(=C(CC(OCC)=O)N3CC5=C(C=CC=C5)N1)C6=C(CC4)C(=CC=C6)OC
InChI Key: NJEKTBZSRRBDHM-UHFFFAOYSA-N
Can. SMILES: CCOC(=O)CC1=C2C3=C(CCC2=C4C([H])(C5=CC=C(C=C5)Cl)NC6=C(C=CC=C6)CN14)C(=CC=C3)OC
InChI: InChI=1S/C31H29ClN2O3/c1-3-37-28(35)17-26-29-23-8-6-10-27(36-2)22(23)15-16-24(29)31-30(19-11-13-21(32)14-12-19)33-25-9-5-4-7-20(25)18-34(26)31/h4-14,30,33H,3,15-18H2,1-2H3
External links:
Citation: https://www.nature.com/articles/s41429-024-00747-x

AntibioticDB is supported by GARDP.

If you have feedback, experience problems, or are interested in a collaboration, please contact us. | Terms and conditions

The content of this site is intended for educational and scientific research purposes only and not as a source of medical advice or consultation.