EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C28H33N3O4 |
| Net Charge | 0 |
| Average Mass | 475.589 |
| Monoisotopic Mass | 475.24711 |
| SMILES | O=C(NCc1nc2ccccc2n1)C1=C[C@@H](C2CCCCC2)C[C@@H](OCc2ccc(CO)cc2)O1 |
| InChI | InChI=1S/C28H33N3O4/c32-17-19-10-12-20(13-11-19)18-34-27-15-22(21-6-2-1-3-7-21)14-25(35-27)28(33)29-16-26-30-23-8-4-5-9-24(23)31-26/h4-5,8-14,21-22,27,32H,1-3,6-7,15-18H2,(H,29,33)(H,30,31)/t22-,27+/m1/s1 |
| InChIKey | PSPNTUAIJKUCIA-AMGIVPHBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2S,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-cyclohexyl-2-[[4-(hydroxymethyl)phenyl]methoxy]-3,4-dihydro-2H-pyran-6-carboxamide (CHEBI:112261) is a benzimidazoles (CHEBI:22715) |
| Manual Xrefs | Databases |
|---|---|
| LSM-23673 | LINCS |