Compound ID | 2437

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6-Halopyridylmethylidene bromopyridyl 2

Class: Beta-lactamase inhibitor

Spectrum of activity: Gram-negative
Details of activity: Active against Pseudomonas aeruginosa expressing AmpC
Description: Synthetic compound; restores activity of cephalosporins and carbapenems against MDR pathogens; analogues reported
Institute where first reported: Servicio de Microbiología do Complejo Hospitalario Universitario da Coruña (CHUAC), Instituto de Investigación Biomédica da Coruña (CICA-INIBIC), Xubias de Arriba, 84, A Coruña 15006, Spain
Year first mentioned: 2021
Development status: Experimental
Chemical structure(s):
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Molecular weight: 567.36
Iso. SMILES: C[C@@]1([C@@H](N2[C@H](S1(=O)=O)/C(=C\C3=NC=CC(=C3)Br)/C2=O)C(=O)O)COC(=O)CC4=CC(=C(C=C4)O)O
InChI Key: NUTDSXJOEFQYGG-WVMBVAROSA-N
Can. SMILES: C[C@]1(COC(=O)CC2=CC=C(C(=C2)O)O)[C@H](C(=O)O)N3C(=O)/C(=C/C4=CC(=CC=N4)Br)/[C@H]3S1(=O)=O
InChI: InChI=1S/C22H19BrN2O9S/c1-22(10-34-17(28)7-11-2-3-15(26)16(27)6-11)18(21(30)31)25-19(29)14(20(25)35(22,32)33)9-13-8-12(23)4-5-24-13/h2-6,8-9,18,20,26-27H,7,10H2,1H3,(H,30,31)/b14-9-/t18-,20+,22-/m0/s1
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/155538314
Citation: https://pubs.acs.org/doi/10.1021/acs.jmedchem.1c00369

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