EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H28N2O4 |
| Net Charge | 0 |
| Average Mass | 324.421 |
| Monoisotopic Mass | 324.20491 |
| SMILES | O=C(C[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1)NCC1CC1 |
| InChI | InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14-,15-/m1/s1 |
| InChIKey | MSNHHRRUCLPTHC-RBSFLKMASA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3R,6R)-6-[2-(cyclopropylmethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]cyclobutanecarboxamide (CHEBI:100910) is a C-glycosyl compound (CHEBI:20857) |
| N-[(2S,3R,6R)-6-[2-(cyclopropylmethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]cyclobutanecarboxamide (CHEBI:100910) is a cyclobutanes (CHEBI:156473) |
| Manual Xrefs | Databases |
|---|---|
| LSM-12284 | LINCS |