EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C31H37N3O4S |
| Net Charge | 0 |
| Average Mass | 547.721 |
| Monoisotopic Mass | 547.25048 |
| SMILES | CC=Cc1cccc(-c2nc(C(=O)NCc3ccc(OC)cc3)cc3c2[C@H](CCO)N([S@@](=O)C(C)(C)C)C3)c1 |
| InChI | InChI=1S/C31H37N3O4S/c1-6-8-21-9-7-10-23(17-21)29-28-24(20-34(27(28)15-16-35)39(37)31(2,3)4)18-26(33-29)30(36)32-19-22-11-13-25(38-5)14-12-22/h6-14,17-18,27,35H,15-16,19-20H2,1-5H3,(H,32,36)/t27-,39-/m0/s1 |
| InChIKey | CHUUKIFYUQSEQP-XGFTYPEHSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-8776 (CHEBI:97397) is a phenylpyridine (CHEBI:38193) |
| Manual Xrefs | Databases |
|---|---|
| LSM-8776 | LINCS |