EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H35FN4O6 |
| Net Charge | 0 |
| Average Mass | 530.597 |
| Monoisotopic Mass | 530.25406 |
| SMILES | COCC(=O)N1C[C@H](C)[C@H](OC)CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C |
| InChI | InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m0/s1 |
| InChIKey | ZQFWKBSGTDYKBN-LLJLJFOGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(3-fluorophenyl)-3-[(4S,7S,8S)-8-methoxy-5-(2-methoxyacetyl)-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea (CHEBI:97261) is a azamacrocycle (CHEBI:52898) |
| 1-(3-fluorophenyl)-3-[(4S,7S,8S)-8-methoxy-5-(2-methoxyacetyl)-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea (CHEBI:97261) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-8640 | LINCS |