EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C31H35F3N4O5 |
| Net Charge | 0 |
| Average Mass | 600.638 |
| Monoisotopic Mass | 600.25595 |
| SMILES | C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O |
| InChI | InChI=1S/C31H35F3N4O5/c1-19-16-38(20(2)18-39)29(41)24-15-22(35-28(40)13-14-31(32,33)34)11-12-26(24)43-27(19)17-37(3)30(42)36-25-10-6-8-21-7-4-5-9-23(21)25/h4-12,15,19-20,27,39H,13-14,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20+,27+/m0/s1 |
| InChIKey | DGKJENNUCKEZTA-ASHZAFPQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4,4,4-trifluoro-N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide (CHEBI:124385) is a naphthalenes (CHEBI:25477) |
| Manual Xrefs | Databases |
|---|---|
| LSM-35827 | LINCS |