EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C30H34FN3O4S |
| Net Charge | 0 |
| Average Mass | 551.684 |
| Monoisotopic Mass | 551.22541 |
| SMILES | CC(C)(C)[S@@](=O)N1Cc2cc(C(=O)N3CCOCC3)nc(-c3cccc(-c4ccccc4F)c3)c2[C@H]1CCO |
| InChI | InChI=1S/C30H34FN3O4S/c1-30(2,3)39(37)34-19-22-18-25(29(36)33-12-15-38-16-13-33)32-28(27(22)26(34)11-14-35)21-8-6-7-20(17-21)23-9-4-5-10-24(23)31/h4-10,17-18,26,35H,11-16,19H2,1-3H3/t26-,39-/m1/s1 |
| InChIKey | WDBGCMALGZQRLR-FMARWTIOSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [(3R)-2-[(R)-tert-butylsulfinyl]-4-[3-(2-fluorophenyl)phenyl]-3-(2-hydroxyethyl)-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl]-morpholin-4-ylmethanone (CHEBI:97932) is a biphenyls (CHEBI:22888) |
| Manual Xrefs | Databases |
|---|---|
| LSM-9311 | LINCS |