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CHEBI:129358 - 4-[4-[(2S,3R)-1-acetyl-6-[cyclopropyl(oxo)methyl]-2-(hydroxymethyl)-1,6-diazaspiro[3.3]heptan-3-yl]phenyl]benzonitrile
| Formula | C25H25N3O3 |
| Net Charge | 0 |
| Average Mass | 415.493 |
| Monoisotopic Mass | 415.18959 |
| SMILES | CC(=O)N1[C@H](CO)[C@@H](c2ccc(-c3ccc(C#N)cc3)cc2)C12CN(C(=O)C1CC1)C2 |
| InChI | InChI=1S/C25H25N3O3/c1-16(30)28-22(13-29)23(25(28)14-27(15-25)24(31)21-10-11-21)20-8-6-19(7-9-20)18-4-2-17(12-26)3-5-18/h2-9,21-23,29H,10-11,13-15H2,1H3/t22-,23-/m1/s1 |
| InChIKey | QRUIMFSAEGDYOH-DHIUTWEWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[4-[(2S,3R)-1-acetyl-6-[cyclopropyl(oxo)methyl]-2-(hydroxymethyl)-1,6-diazaspiro[3.3]heptan-3-yl]phenyl]benzonitrile (CHEBI:129358) is a biphenyls (CHEBI:22888) |
| 4-[4-[(2S,3R)-1-acetyl-6-[cyclopropyl(oxo)methyl]-2-(hydroxymethyl)-1,6-diazaspiro[3.3]heptan-3-yl]phenyl]benzonitrile (CHEBI:129358) is a nitrile (CHEBI:18379) |
| Manual Xrefs | Databases |
|---|---|
| LSM-40909 | LINCS |