Exact Mass: 547.2278168
Exact Mass Matches: 547.2278168
Found 95 metabolites which its exact mass value is equals to given mass value 547.2278168
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Darunavir
C27H37N3O7S (547.2352092000001)
Darunavir is only found in individuals that have used or taken this drug. It is a protease inhibitor used to treat HIV. It acts on the HIV aspartyl protease which the virus needs to cleave the HIV polyprotein into its functional fragments.Darunavir is a HIV protease inhibitor which prevents HIV replication by binding to the enzymes active site, thereby preventing the dimerization and the catalytic activity of the HIV-1 protease. Darunavir selectively inhibits the cleavage of HIV encoded Gag-Pol polyproteins in virus-infected cells, which prevents the formation of mature infectious virus particles. Structual analyses suggests that the close contact that darunavir has with the main chains of the protease active site amino acids (Asp-29 and Asp-30) is an important contributing factor to its potency and wide spectrum of activity against multi-protease inhibitor resistant HIV-1 variants. Darunavir can also adapt to the changing shape of a protease enzyme because of its molecular flexibility. Darunavir is known to bind to two distinct sites on the enzyme: the active site cavity and the surface of one of the flexible flaps in the protease dimer. J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AE - Protease inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D000084762 - Viral Protease Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents COVID info from DrugBank, clinicaltrial, clinicaltrials, clinical trial, clinical trials C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C97366 - HIV Protease Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent > C1660 - Anti-HIV Agent D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Darunavir
C27H37N3O7S (547.2352092000001)
J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AE - Protease inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D000084762 - Viral Protease Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents COVID info from DrugBank, clinicaltrial, clinicaltrials, clinical trial, clinical trials C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C97366 - HIV Protease Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent > C1660 - Anti-HIV Agent D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS CONFIDENCE standard compound; INTERNAL_ID 2179 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3016
Asp Asp Ile Trp
Asp Asp Leu Trp
Asp Asp Trp Ile
Asp Asp Trp Leu
Asp Glu Glu Arg
C20H33N7O11 (547.2237948000001)
Asp Glu Arg Glu
C20H33N7O11 (547.2237948000001)
Asp Glu Val Trp
Asp Glu Trp Val
Asp Ile Asp Trp
Asp Ile Trp Asp
Asp Leu Asp Trp
Asp Leu Trp Asp
Asp Arg Glu Glu
C20H33N7O11 (547.2237948000001)
Asp Val Glu Trp
Asp Val Trp Glu
Asp Trp Asp Ile
Asp Trp Asp Leu
Asp Trp Glu Val
Asp Trp Ile Asp
Asp Trp Leu Asp
Asp Trp Val Glu
Glu Asp Glu Arg
C20H33N7O11 (547.2237948000001)
Glu Asp Arg Glu
C20H33N7O11 (547.2237948000001)
Glu Asp Val Trp
Glu Asp Trp Val
Glu Glu Asp Arg
C20H33N7O11 (547.2237948000001)
Glu Glu Arg Asp
C20H33N7O11 (547.2237948000001)
Glu Arg Asp Glu
C20H33N7O11 (547.2237948000001)
Glu Arg Glu Asp
C20H33N7O11 (547.2237948000001)
Glu Val Asp Trp
Glu Val Trp Asp
Glu Trp Asp Val
Glu Trp Val Asp
Phe His Met Asn
Phe His Asn Met
Phe Met His Asn
Phe Met Asn His
Phe Asn His Met
Phe Asn Met His
His Phe Met Asn
His Phe Asn Met
His Met Phe Asn
His Met Asn Phe
His Asn Phe Met
His Asn Met Phe
Ile Asp Asp Trp
Ile Asp Trp Asp
Ile Trp Asp Asp
Leu Asp Asp Trp
Leu Asp Trp Asp
Leu Trp Asp Asp
Met Phe His Asn
Met Phe Asn His
Met His Phe Asn
Met His Asn Phe
Met Asn Phe His
Met Asn His Phe
Asn Phe His Met
Asn Phe Met His
Asn His Phe Met
Asn His Met Phe
Asn Met Phe His
Asn Met His Phe
Arg Asp Glu Glu
C20H33N7O11 (547.2237948000001)
Arg Glu Asp Glu
C20H33N7O11 (547.2237948000001)
Arg Glu Glu Asp
C20H33N7O11 (547.2237948000001)