EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C28H19FN4O8 |
| Net Charge | 0 |
| Average Mass | 558.478 |
| Monoisotopic Mass | 558.11869 |
| SMILES | CCOCn1cc(F)c(=O)n(C(=O)c2cccc(C(=O)Oc3nc(OC(=O)c4ccccc4)ccc3C#N)c2)c1=O |
| InChI | InChI=1S/C28H19FN4O8/c1-2-39-16-32-15-21(29)25(35)33(28(32)38)24(34)18-9-6-10-19(13-18)27(37)41-23-20(14-30)11-12-22(31-23)40-26(36)17-7-4-3-5-8-17/h3-13,15H,2,16H2,1H3 |
| InChIKey | WTSKMKRYHATLLL-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| emitefur (CHEBI:750926) is a benzoate ester (CHEBI:36054) |
| INN | Source |
|---|---|
| emitefur | WHO MedNet |
| Synonym | Source |
|---|---|
| BOF-A2 | ChEMBL |