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CHEBI:757792 - rovafovir etalafenamide citrate
| Formula | C21H24FN6O6P.C6H8O7 |
| Net Charge | 0 |
| Average Mass | 698.554 |
| Monoisotopic Mass | 698.17490 |
| SMILES | CCOC(=O)[C@H](C)N[P@](=O)(CO[C@@H]1C=C(F)[C@H](n2cnc3c(N)ncnc32)O1)Oc1ccccc1.O=C(O)CC(O)(CC(=O)O)C(=O)O |
| InChI | InChI=1S/C21H24FN6O6P.C6H8O7/c1-3-31-21(29)13(2)27-35(30,34-14-7-5-4-6-8-14)12-32-16-9-15(22)20(33-16)28-11-26-17-18(23)24-10-25-19(17)28;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-11,13,16,20H,3,12H2,1-2H3,(H,27,30)(H2,23,24,25);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t13-,16-,20+,35-;/m0./s1 |
| InChIKey | UQNIBOGIUNYYCZ-PDIMESFMSA-N |
| Roles Classification |
|---|
| Biological Role: | anti-HIV agent An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| rovafovir etalafenamide citrate (CHEBI:757792) has functional parent tetracarboxylic acid (CHEBI:35742) |
| rovafovir etalafenamide citrate (CHEBI:757792) has role anti-HIV agent (CHEBI:64946) |
| rovafovir etalafenamide citrate (CHEBI:757792) is a organooxygen compound (CHEBI:36963) |
| Synonyms | Source |
|---|---|
| GS-9131 citrate | ChEMBL |
| GS9131 CITRATE | ChEMBL |
| Rovafovir etalafenamide citrate | ChEMBL |