EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C28H37N3O4 |
| Net Charge | 0 |
| Average Mass | 479.621 |
| Monoisotopic Mass | 479.27841 |
| SMILES | O=C(C[C@H]1CC[C@@H](NC(=O)CCN2CCCCC2)[C@H](CO)O1)Nc1ccc(-c2ccccc2)cc1 |
| InChI | InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25-,26+/m1/s1 |
| InChIKey | OVKJLPKMZNQLNH-CYXNTTPDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenylanilino)ethyl]-3-oxanyl]-3-(1-piperidinyl)propanamide (CHEBI:120193) is a biphenyls (CHEBI:22888) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31636 | LINCS |