EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H33N3O4 |
| Net Charge | 0 |
| Average Mass | 427.545 |
| Monoisotopic Mass | 427.24711 |
| SMILES | CC=Cc1ccc2n(c1=O)C[C@H]1[C@H](CO)[C@@H](C(=O)NCC3CCCCC3)[C@@H]2N1C(C)=O |
| InChI | InChI=1S/C24H33N3O4/c1-3-7-17-10-11-19-22-21(23(30)25-12-16-8-5-4-6-9-16)18(14-28)20(27(22)15(2)29)13-26(19)24(17)31/h3,7,10-11,16,18,20-22,28H,4-6,8-9,12-14H2,1-2H3,(H,25,30)/t18-,20-,21+,22+/m0/s1 |
| InChIKey | NJGAJUNFGSSUAO-VXSCBNMQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-14648 (CHEBI:103304) is a pyrrolidinecarboxamide (CHEBI:46770) |
| Manual Xrefs | Databases |
|---|---|
| LSM-14648 | LINCS |