EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H37FN4O4 |
| Net Charge | 0 |
| Average Mass | 500.615 |
| Monoisotopic Mass | 500.27988 |
| SMILES | CCCN1C[C@@H](C)[C@@H](OC)CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C |
| InChI | InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25+/m1/s1 |
| InChIKey | ACQKEKFFNOLIKU-RRQZXNHTSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(3-fluorophenyl)-3-[(4R,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-propyl-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea (CHEBI:104493) is a azamacrocycle (CHEBI:52898) |
| 1-(3-fluorophenyl)-3-[(4R,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-propyl-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea (CHEBI:104493) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-15857 | LINCS |