EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C32H39N3O5 |
| Net Charge | 0 |
| Average Mass | 545.680 |
| Monoisotopic Mass | 545.28897 |
| SMILES | COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N([C@H](C)CO)C[C@@H]2C)cc1 |
| InChI | InChI=1S/C32H39N3O5/c1-22-18-35(23(2)21-36)32(38)28-17-26(33-31(37)16-24-8-6-5-7-9-24)12-15-29(28)40-30(22)20-34(3)19-25-10-13-27(39-4)14-11-25/h5-15,17,22-23,30,36H,16,18-21H2,1-4H3,(H,33,37)/t22-,23+,30-/m0/s1 |
| InChIKey | RZTDCHBKGWJHSA-BURCIIJTSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide (CHEBI:125885) is a acetamides (CHEBI:22160) |
| Manual Xrefs | Databases |
|---|---|
| LSM-37452 | LINCS |