EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C26H26FN3O3 |
| Net Charge | 0 |
| Average Mass | 447.510 |
| Monoisotopic Mass | 447.19582 |
| SMILES | COc1ccc(CN2[C@H](CO)[C@@H]3c4ccccc4N(C(=O)Nc4ccc(F)cc4)C[C@@H]32)cc1 |
| InChI | InChI=1S/C26H26FN3O3/c1-33-20-12-6-17(7-13-20)14-29-23-15-30(26(32)28-19-10-8-18(27)9-11-19)22-5-3-2-4-21(22)25(23)24(29)16-31/h2-13,23-25,31H,14-16H2,1H3,(H,28,32)/t23-,24+,25+/m0/s1 |
| InChIKey | FQKXBUVFPMCKHZ-ISJGIBHGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (1S,2aR,8bR)-N-(4-fluorophenyl)-1-(hydroxymethyl)-2-[(4-methoxyphenyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide (CHEBI:128107) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-39663 | LINCS |