Compound ID | 2302

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NL2

Class: Small molecule antibacterial agent

Spectrum of activity: Gram-positive  &  Gram-negative
Details of activity: Active against Staphylococcus aureus and Pseudomonas aeruginosa; inhibits bacterial cystathionine γ-lyase that generates H2S (protects bacteria from oxidative stress)
Description: Synthetic compound discovered from structure-based virtual screening; small molecule with furan carboxylate central indole moiety
Year first mentioned: 2021
Development status: Experimental
Chemical structure(s):
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Molecular weight: 334.16
Iso. SMILES: BrC1=CC=C2C=CN(CC3=CC(C(O)=O)=C(C)O3)C2=C1
InChI Key: XCOVJISMCVGULK-UHFFFAOYSA-N
Can. SMILES: CC1=C(C=C(CN2C=CC3=C2C=C(C=C3)Br)O1)C(=O)O
InChI: InChI=1S/C15H12BrNO3/c1-9-13(15(18)19)7-12(20-9)8-17-5-4-10-2-3-11(16)6-14(10)17/h2-7H,8H2,1H3,(H,18,19)
External links:
Citation: https://www.science.org/doi/10.1126/science.abd8377

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