EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C28H36N4O4 |
| Net Charge | 0 |
| Average Mass | 492.620 |
| Monoisotopic Mass | 492.27366 |
| SMILES | C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2ncc(C3=CCCCC3)cc2C1=O |
| InChI | InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20+,25-/m0/s1 |
| InChIKey | ZECMXSZSTQYLBY-DFIYOIEZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[[(2R,3S)-8-(1-cyclohexenyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-pyridin-4-ylacetamide (CHEBI:103682) is a aromatic ether (CHEBI:35618) |
| Manual Xrefs | Databases |
|---|---|
| LSM-15026 | LINCS |