EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H27F3N4O4 |
| Net Charge | 0 |
| Average Mass | 492.498 |
| Monoisotopic Mass | 492.19844 |
| SMILES | CN(C)C(=O)c1cccc(-c2ccc3n(c2=O)C[C@H]2[C@H](CO)[C@@H](C(=O)NCC(F)(F)F)[C@@H]3N2C)c1 |
| InChI | InChI=1S/C24H27F3N4O4/c1-29(2)22(34)14-6-4-5-13(9-14)15-7-8-17-20-19(21(33)28-12-24(25,26)27)16(11-32)18(30(20)3)10-31(17)23(15)35/h4-9,16,18-20,32H,10-12H2,1-3H3,(H,28,33)/t16-,18-,19+,20+/m0/s1 |
| InChIKey | KOJKRQVKKNDDMT-IJXRJRJASA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-11739 (CHEBI:100364) is a phenylpyridine (CHEBI:38193) |
| Manual Xrefs | Databases |
|---|---|
| LSM-11739 | LINCS |