EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H31N3O4 |
| Net Charge | 0 |
| Average Mass | 437.540 |
| Monoisotopic Mass | 437.23146 |
| SMILES | COc1ccc(-c2ccc3c(c2)[C@H]2[C@H](CCN2C(=O)CN2CCOCC2)[C@H](CO)N3)cc1 |
| InChI | InChI=1S/C25H31N3O4/c1-31-19-5-2-17(3-6-19)18-4-7-22-21(14-18)25-20(23(16-29)26-22)8-9-28(25)24(30)15-27-10-12-32-13-11-27/h2-7,14,20,23,25-26,29H,8-13,15-16H2,1H3/t20-,23+,25-/m1/s1 |
| InChIKey | VBHFXKMGVUKTSE-JHMXWDHMSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[(3aR,4R,9bR)-4-(hydroxymethyl)-8-(4-methoxyphenyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-2-(4-morpholinyl)ethanone (CHEBI:128518) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-40072 | LINCS |