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CHEBI:31536 - emtricitabine
| Formula | C8H10FN3O3S |
| Net Charge | 0 |
| Average Mass | 247.251 |
| Monoisotopic Mass | 247.04269 |
| SMILES | Nc1nc(=O)n([C@@H]2CS[C@H](CO)O2)cc1F |
| InChI | InChI=1S/C8H10FN3O3S/c9-4-1-12(8(14)11-7(4)10)5-3-16-6(2-13)15-5/h1,5-6,13H,2-3H2,(H2,10,11,14)/t5-,6+/m0/s1 |
| InChIKey | XQSPYNMVSIKCOC-NTSWFWBYSA-N |
| Wikipedia |
|---|
| Roles Classification |
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| Biological Roles: | antiviral agent A substance that destroys or inhibits replication of viruses. antiviral drug A substance used in the prophylaxis or therapy of virus diseases. anti-HBV agent An antiviral agent that destroys or inhibits the replication of the hepatitis B virus. insulin-sensitizing drug An agent which overcomes insulin resistance by activation of the peroxisome proliferator activated receptor gamma (PPAR-gamma). antitubercular agent A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis. HIV-1 reverse transcriptase inhibitor An entity which inhibits the activity of HIV-1 reverse transcriptase. immunosuppressive agent An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response. anti-HIV agent An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus. |
| Applications: | antiviral drug A substance used in the prophylaxis or therapy of virus diseases. antiinfective agent A substance used in the prophylaxis or therapy of infectious diseases. insulin-sensitizing drug An agent which overcomes insulin resistance by activation of the peroxisome proliferator activated receptor gamma (PPAR-gamma). antitubercular agent A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis. immunosuppressive agent An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| emtricitabine (CHEBI:31536) has role anti-HBV agent (CHEBI:64951) |
| emtricitabine (CHEBI:31536) has role anti-HIV agent (CHEBI:64946) |
| emtricitabine (CHEBI:31536) has role antiinfective agent (CHEBI:35441) |
| emtricitabine (CHEBI:31536) has role antitubercular agent (CHEBI:33231) |
| emtricitabine (CHEBI:31536) has role antiviral agent (CHEBI:22587) |
| emtricitabine (CHEBI:31536) has role antiviral drug (CHEBI:36044) |
| emtricitabine (CHEBI:31536) has role HIV-1 reverse transcriptase inhibitor (CHEBI:53756) |
| emtricitabine (CHEBI:31536) has role immunosuppressive agent (CHEBI:35705) |
| emtricitabine (CHEBI:31536) has role insulin-sensitizing drug (CHEBI:50864) |
| emtricitabine (CHEBI:31536) is a monothioacetal (CHEBI:59793) |
| emtricitabine (CHEBI:31536) is a nucleoside analogue (CHEBI:60783) |
| emtricitabine (CHEBI:31536) is a organofluorine compound (CHEBI:37143) |
| emtricitabine (CHEBI:31536) is a pyrimidone (CHEBI:38337) |
| Incoming Relation(s) |
| Descovy (CHEBI:133007) has part emtricitabine (CHEBI:31536) |
| Genvoya (CHEBI:90922) has part emtricitabine (CHEBI:31536) |
| Odefsey (CHEBI:133010) has part emtricitabine (CHEBI:31536) |
| IUPAC Name |
|---|
| 4-amino-5-fluoro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2(1H)-one |
| INN | Source |
|---|---|
| emtricitabina | WHO MedNet |
| Synonyms | Source |
|---|---|
| (−)-2'-deoxy-5-fluoro-3'-thiacytidine | ChemIDplus |
| (−)-(2R,5S)-5-fluoro-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]cytosine | ChEBI |
| (2R-cis)-4-amino-5-fluoro-1-(2-(hydroxymethyl)-1,3-oxathiolan-5-yl)-2(1H)-pyrimidinone | ChemIDplus |
| 4-Amino-5-fluoro-1-((2R,5S)-2-hydroxymethyl-[1,3]oxathiolan-5-yl)-1H-pyrimidin-2-one | ChEMBL |
| 4-amino-5-fluoro-1-((2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl)pyrimidin-2(1H)-one | ChEMBL |
| 524-W-91 | ChEMBL |
| Brand Names | Source |
|---|---|
| Emtricitabine component of atripla | ChEMBL |
| Emtricitabine component of biktarvy | ChEMBL |
| Emtricitabine component of complera | ChEMBL |
| Emtricitabine component of descovy | ChEMBL |
| Emtricitabine component of eviplera | ChEMBL |
| Emtricitabine component of genvoya | ChEMBL |
| Registry Numbers | Sources |
|---|---|
| Beilstein:5908714 | Beilstein |
| CAS:143491-57-0 | KEGG COMPOUND |
| CAS:143491-57-0 | ChemIDplus |
| Citations |
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