EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H27F2N3O5 |
| Net Charge | 0 |
| Average Mass | 487.503 |
| Monoisotopic Mass | 487.19188 |
| SMILES | CCC(=O)Nc1ccc2c(c1)C(=O)N(C)[C@H]1CC[C@H](CC(=O)Nc3c(F)cccc3F)O[C@@H]1CO2 |
| InChI | InChI=1S/C25H27F2N3O5/c1-3-22(31)28-14-7-10-20-16(11-14)25(33)30(2)19-9-8-15(35-21(19)13-34-20)12-23(32)29-24-17(26)5-4-6-18(24)27/h4-7,10-11,15,19,21H,3,8-9,12-13H2,1-2H3,(H,28,31)(H,29,32)/t15-,19+,21-/m1/s1 |
| InChIKey | HLFXQWPRBSRVAN-MFMILTCTSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2R,4aS,12aS)-2-[2-(2,6-difluoroanilino)-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]propanamide (CHEBI:100405) is a anilide (CHEBI:13248) |
| Manual Xrefs | Databases |
|---|---|
| LSM-11780 | LINCS |