EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H30FN3O4 |
| Net Charge | 0 |
| Average Mass | 443.519 |
| Monoisotopic Mass | 443.22203 |
| SMILES | CCCN1[C@@H]2c3ccc(-c4ccc(F)cc4)c(=O)n3C[C@H]1[C@H](CO)[C@H]2C(=O)NCCOC |
| InChI | InChI=1S/C24H30FN3O4/c1-3-11-27-20-13-28-19(9-8-17(24(28)31)15-4-6-16(25)7-5-15)22(27)21(18(20)14-29)23(30)26-10-12-32-2/h4-9,18,20-22,29H,3,10-14H2,1-2H3,(H,26,30)/t18-,20-,21+,22+/m0/s1 |
| InChIKey | IYRJHNQZTHMZFV-VXSCBNMQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-11161 (CHEBI:99782) is a phenylpyridine (CHEBI:38193) |
| Manual Xrefs | Databases |
|---|---|
| LSM-11161 | LINCS |