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CHEBI:35854 - valacyclovir
| Formula | C13H20N6O4 |
| Net Charge | 0 |
| Average Mass | 324.341 |
| Monoisotopic Mass | 324.15460 |
| SMILES | CC(C)[C@H](N)C(=O)OCCOCn1cnc2c(=O)nc(N)nc21 |
| InChI | InChI=1S/C13H20N6O4/c1-7(2)8(14)12(21)23-4-3-22-6-19-5-16-9-10(19)17-13(15)18-11(9)20/h5,7-8H,3-4,6,14H2,1-2H3,(H3,15,17,18,20)/t8-/m0/s1 |
| InChIKey | HDOVUKNUBWVHOX-QMMMGPOBSA-N |
| Wikipedia |
|---|
| Roles Classification |
|---|
| Biological Roles: | antiviral agent A substance that destroys or inhibits replication of viruses. antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria. anti-HIV agent An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus. antiviral drug A substance used in the prophylaxis or therapy of virus diseases. anti-HSV agent An antiviral agent that destroys or inhibits the replication of the herpes simplex virus (also known as the human herpes virus). anticoronaviral agent Any antiviral agent which inhibits the activity of coronaviruses. |
| Applications: | antipsychotic agent Antipsychotic drugs are agents that control agitated psychotic behaviour, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect. antiviral drug A substance used in the prophylaxis or therapy of virus diseases. antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| valacyclovir (CHEBI:35854) has functional parent guanine (CHEBI:16235) |
| valacyclovir (CHEBI:35854) has role anti-HIV agent (CHEBI:64946) |
| valacyclovir (CHEBI:35854) has role anti-HSV agent (CHEBI:64952) |
| valacyclovir (CHEBI:35854) has role antibacterial agent (CHEBI:33282) |
| valacyclovir (CHEBI:35854) has role anticoronaviral agent (CHEBI:149553) |
| valacyclovir (CHEBI:35854) has role antineoplastic agent (CHEBI:35610) |
| valacyclovir (CHEBI:35854) has role antipsychotic agent (CHEBI:35476) |
| valacyclovir (CHEBI:35854) has role antiviral agent (CHEBI:22587) |
| valacyclovir (CHEBI:35854) has role antiviral drug (CHEBI:36044) |
| valacyclovir (CHEBI:35854) is a L-valyl ester (CHEBI:35855) |
| valacyclovir (CHEBI:35854) is conjugate base of valacyclovir(1+) (CHEBI:233453) |
| Incoming Relation(s) |
| valacyclovir(1+) (CHEBI:233453) is conjugate acid of valacyclovir (CHEBI:35854) |
| IUPAC Name |
|---|
| 2-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methoxy]ethyl L-valinate |
| Synonyms | Source |
|---|---|
| L-Valine, 2-((2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy)ethyl ester | ChemIDplus |
| L-Valine ester with 9-((2-hydroxyethoxy)methyl)guanine | ChemIDplus |
| Valaciclovir | ChEMBL |
| Valacv | ChEMBL |
| Manual Xrefs | Databases |
|---|---|
| 2798 | DrugCentral |
| LSM-5571 | LINCS |
| Valacyclovir | Wikipedia |
| Registry Numbers | Sources |
|---|---|
| Beilstein:8160931 | Beilstein |
| CAS:124832-26-4 | ChemIDplus |
| Citations |
|---|