EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C28H34N4O4 |
| Net Charge | 0 |
| Average Mass | 490.604 |
| Monoisotopic Mass | 490.25801 |
| SMILES | C[C@H]1CN([C@@H](C)CO)C(=O)c2cc(NC(=O)Nc3cccc4ccccc34)ccc2O[C@H]1CN(C)C |
| InChI | InChI=1S/C28H34N4O4/c1-18-15-32(19(2)17-33)27(34)23-14-21(12-13-25(23)36-26(18)16-31(3)4)29-28(35)30-24-11-7-9-20-8-5-6-10-22(20)24/h5-14,18-19,26,33H,15-17H2,1-4H3,(H2,29,30,35)/t18-,19-,26-/m0/s1 |
| InChIKey | INADRKJOEXIRSH-DGUDUIIESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[(2R,3S)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(1-naphthalenyl)urea (CHEBI:124145) is a naphthalenes (CHEBI:25477) |
| Manual Xrefs | Databases |
|---|---|
| LSM-35587 | LINCS |