Chemistry:Merafloxacin

Merafloxacin
Identifiers
	IUPAC name 1-Ethyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6,8-difluoro-4-oxoquinoline-3-carboxylic acid;
CAS Number	91188-00-0 ;
PubChem CID	121833;
ChemSpider	108697;
UNII	G6U51T1K77;
ChEMBL	ChEMBL6209;
Chemical and physical data
Formula	C19H23F2N3O3
Molar mass	379.408 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES CCNCC1CCN(C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)CC)F;
	InChI InChI=1S/C19H23F2N3O3/c1-3-22-8-11-5-6-24(9-11)17-14(20)7-12-16(15(17)21)23(4-2)10-13(18(12)25)19(26)27/h7,10-11,22H,3-6,8-9H2,1-2H3,(H,26,27); Key:BAYYCLWCHFVRLV-UHFFFAOYSA-N;

Short description: Chemical compound

Merafloxacin is a fluoroquinolone antibacterial that inhibits the pseudoknot formation which is necessary for the frameshift in the SARS-CoV-2 genome.^[1] It is a promising drug candidate for SARS-CoV-2.^[2]

References

↑ "Structural basis of ribosomal frameshifting during translation of the SARS-CoV-2 RNA genome". Science 372 (6548): 1306–1313. June 2021. doi:10.1126/science.abf3546. PMID 34029205. Bibcode: 2021Sci...372.1306B.
↑ "Restriction of SARS-CoV-2 Replication by Targeting Programmed -1 Ribosomal Frameshifting In Vitro". bioRxiv. October 2020. doi:10.1101/2020.10.21.349225. PMID 33106809.

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[1] "Structural basis of ribosomal frameshifting during translation of the SARS-CoV-2 RNA genome". Science 372 (6548): 1306–1313. June 2021. doi:10.1126/science.abf3546. PMID 34029205. Bibcode: 2021Sci...372.1306B.

[Sun-2] "Restriction of SARS-CoV-2 Replication by Targeting Programmed -1 Ribosomal Frameshifting In Vitro". bioRxiv. October 2020. doi:10.1101/2020.10.21.349225. PMID 33106809.

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Identifiers

IUPAC name 1-Ethyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6,8-difluoro-4-oxoquinoline-3-carboxylic acid
CAS Number	91188-00-0^Y
PubChem CID	121833
ChemSpider	108697
UNII	G6U51T1K77
ChEMBL	ChEMBL6209
Chemical and physical data
Formula	C₁₉H₂₃F₂N₃O₃
Molar mass	379.408 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES CCNCC1CCN(C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)CC)F
InChI InChI=1S/C19H23F2N3O3/c1-3-22-8-11-5-6-24(9-11)17-14(20)7-12-16(15(17)21)23(4-2)10-13(18(12)25)19(26)27/h7,10-11,22H,3-6,8-9H2,1-2H3,(H,26,27) Key:BAYYCLWCHFVRLV-UHFFFAOYSA-N

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