EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C28H35F2N3O4 |
| Net Charge | 0 |
| Average Mass | 515.601 |
| Monoisotopic Mass | 515.25956 |
| SMILES | CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C |
| InChI | InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18+,26-/m0/s1 |
| InChIKey | MHGGQJRIOQBKBK-DFXHWTJYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(5R,6S,9R)-8-[(2,5-difluorophenyl)methyl]-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]cyclopropanecarboxamide (CHEBI:101925) is a azamacrocycle (CHEBI:52898) |
| N-[(5R,6S,9R)-8-[(2,5-difluorophenyl)methyl]-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]cyclopropanecarboxamide (CHEBI:101925) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-13286 | LINCS |