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](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(C(=O)Nc3ccccc3N)cc2)Oc2ccc(N(C)C)cc2C1=O |
| InChI | InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,30+/m0/s1 |
| InChIKey | QVMJLFZOFFUGMH-IABYTQIASA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2-aminophenyl)-4-[[[(2S,3S)-8-(dimethylamino)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl-methylamino]methyl]benzamide (CHEBI:129004) is a benzamides (CHEBI:22702) |
| Manual Xrefs | Databases |
|---|---|
| LSM-40556 | LINCS |