EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C31H36F2N4O4 |
| Net Charge | 0 |
| Average Mass | 566.649 |
| Monoisotopic Mass | 566.27046 |
| SMILES | CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(Cc2ccccc2F)C[C@H]1C |
| InChI | InChI=1S/C31H36F2N4O4/c1-20-16-37(17-22-9-5-6-10-25(22)32)21(2)19-41-28-14-13-23(15-24(28)30(38)36(3)18-29(20)40-4)34-31(39)35-27-12-8-7-11-26(27)33/h5-15,20-21,29H,16-19H2,1-4H3,(H2,34,35,39)/t20-,21-,29-/m1/s1 |
| InChIKey | HKYYWNCRFDPCOS-GVNDJSPXSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(2-fluorophenyl)-3-[(4R,7R,8S)-5-[(2-fluorophenyl)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea (CHEBI:115180) is a azamacrocycle (CHEBI:52898) |
| 1-(2-fluorophenyl)-3-[(4R,7R,8S)-5-[(2-fluorophenyl)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea (CHEBI:115180) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-26640 | LINCS |