EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C32H41N5O4 |
| Net Charge | 0 |
| Average Mass | 559.711 |
| Monoisotopic Mass | 559.31585 |
| SMILES | C[C@@H]1CN([C@@H](C)CO)C(=O)c2cccc(N(C)C)c2O[C@H]1CN(C)Cc1ccc(C(=O)Nc2ccccc2N)cc1 |
| InChI | InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,29+/m1/s1 |
| InChIKey | SREUWAAPQJIJAQ-BXOOBUKZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2-aminophenyl)-4-[[[(2R,3R)-10-(dimethylamino)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzamide (CHEBI:108862) is a benzamides (CHEBI:22702) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20261 | LINCS |