EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C24H20ClN3O4 |
| Net Charge | 0 |
| Average Mass | 449.894 |
| Monoisotopic Mass | 449.11423 |
| SMILES | [H][C@]12OC[C@@H](Oc3nc4cc(Cl)c(-c5ccc(-c6ccccc6)cc5)nc4n3)[C@@]1([H])OC[C@H]2O |
| InChI | InChI=1S/C24H20ClN3O4/c25-16-10-17-23(28-24(26-17)32-19-12-31-21-18(29)11-30-22(19)21)27-20(16)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-10,18-19,21-22,29H,11-12H2,(H,26,27,28)/t18-,19-,21-,22-/m1/s1 |
| InChIKey | XQMNBTZLYOOAGA-UGESXGAOSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| MK8722 (CHEBI:747625) is a organic molecular entity (CHEBI:50860) |
| Registry Numbers | Sources |
|---|---|
| CAS:1394371-71-1 | CAS |