EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H25N3O3 |
| Net Charge | 0 |
| Average Mass | 319.405 |
| Monoisotopic Mass | 319.18959 |
| SMILES | CCCN1[C@@H]2Cn3c(cccc3=O)[C@H]1[C@@H](C(=O)N(C)C)[C@@H]2CO |
| InChI | InChI=1S/C17H25N3O3/c1-4-8-19-13-9-20-12(6-5-7-14(20)22)16(19)15(11(13)10-21)17(23)18(2)3/h5-7,11,13,15-16,21H,4,8-10H2,1-3H3/t11-,13-,15+,16+/m1/s1 |
| InChIKey | OCXQXADZMXZZGR-OYNZBZHQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-13469 (CHEBI:102109) is a pyrrolidinecarboxamide (CHEBI:46770) |
| Manual Xrefs | Databases |
|---|---|
| LSM-13469 | LINCS |