API reference
Nirmatrelvir
- CAS number
- 2628280-40-8
- Molecular formula
- C23H32F3N5O4
- Molecular weight
- 499.5 g/mol
About this molecule
Nirmatrelvir is an orally bioavailable, peptidomimetic inhibitor of the severe acute respiratory syndrome coronavirus-2 (SARS-CoV-2) main protease (Mpro; 3C-like protease; 3CL protease; 3CLpro; nsp5 protease), with potential antiviral activity against SARS-CoV-2 and other coronaviruses. Upon oral administration, nirmatrelvir selectively targets, binds to, and inhibits the activity of SARS-CoV-2 Mpro. This inhibits the proteolytic cleavage of viral polyproteins, thereby inhibiting the formation of viral proteins including helicase, single-stranded-RNA-binding protein, RNA-dependent RNA polymerase, 20-O-ribose methyltransferase, endoribonuclease and exoribonuclease. This prevents viral transcription and replication.
Source: NCI Thesaurus (NCIt), via PubChem.
Identifiers
- IUPAC name
- (1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-[(2S)-3,3-dimethyl-2-[(2,2,2-trifluoroacetyl)amino]butanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
- InChIKey
- LIENCHBZNNMNKG-OJFNHCPVSA-N
- SMILES
- CC1([C@@H]2[C@H]1[C@H](N(C2)C(=O)[C@H](C(C)(C)C)NC(=O)C(F)(F)F)C(=O)N[C@@H](C[C@@H]3CCNC3=O)C#N)C
- PubChem CID
- 155903259
Also known as
Nirmatrelvir · Paxlovid · PAXLOVID COMPONENT NIRMATRELVIR · NIRMATRELVIR COMPONENT OF PAXLOVID · 881-018-3 · Paxlovid-d9 · ZGW · Boceprevir Impurity 5
Chemical data on this page is drawn from PubChem (National Library of Medicine) and is provided for identification only. Hanpars does not hold stock of every substance listed; availability, grade, documentation and regulatory status are confirmed per enquiry.
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