EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C24H32F3N5O6S |
| Net Charge | 0 |
| Average Mass | 575.610 |
| Monoisotopic Mass | 575.20254 |
| SMILES | CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)CC(F)(F)F)cc2OC[C@@H](C)N(S(=O)(=O)c2cn(C)cn2)C[C@@H]1C |
| InChI | InChI=1S/C24H32F3N5O6S/c1-15-10-32(39(35,36)22-12-30(3)14-28-22)16(2)13-38-19-8-17(29-21(33)9-24(25,26)27)6-7-18(19)23(34)31(4)11-20(15)37-5/h6-8,12,14-16,20H,9-11,13H2,1-5H3,(H,29,33)/t15-,16+,20+/m0/s1 |
| InChIKey | ZYJJQNOXPHIYRR-RZQQEMMASA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3,3,3-trifluoro-N-[(5S,6S,9R)-5-methoxy-3,6,9-trimethyl-8-(1-methylimidazol-4-yl)sulfonyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]propanamide (CHEBI:98222) is a azamacrocycle (CHEBI:52898) |
| 3,3,3-trifluoro-N-[(5S,6S,9R)-5-methoxy-3,6,9-trimethyl-8-(1-methylimidazol-4-yl)sulfonyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]propanamide (CHEBI:98222) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-9601 | LINCS |