EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H20Cl2N2O3 |
| Net Charge | 0 |
| Average Mass | 467.352 |
| Monoisotopic Mass | 466.08510 |
| SMILES | COc1ccc([C@H]2c3nc4ccc(Cl)cc4c3CCN2C(=O)Oc2ccc(Cl)cc2)cc1 |
| InChI | InChI=1S/C25H20Cl2N2O3/c1-31-18-7-2-15(3-8-18)24-23-20(21-14-17(27)6-11-22(21)28-23)12-13-29(24)25(30)32-19-9-4-16(26)5-10-19/h2-11,14,24,28H,12-13H2,1H3/t24-/m0/s1 |
| InChIKey | SRSHBZRURUNOSM-DEOSSOPVSA-N |
| Roles Classification |
|---|
| Biological Roles: | anticoronaviral agent Any antiviral agent which inhibits the activity of coronaviruses. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| Application: | antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| emvododstat (CHEBI:758234) has role anticoronaviral agent (CHEBI:149553) |
| emvododstat (CHEBI:758234) has role antineoplastic agent (CHEBI:35610) |
| emvododstat (CHEBI:758234) is a harmala alkaloid (CHEBI:61379) |
| INN | Source |
|---|---|
| emvododstat | WHO MedNet |
| Synonyms | Source |
|---|---|
| Ptc-299 | ChEMBL |
| PTC299 | ChEMBL |
| Citations |
|---|