EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C30H33F2N5O5 |
| Net Charge | 0 |
| Average Mass | 581.620 |
| Monoisotopic Mass | 581.24498 |
| SMILES | CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)N(C(=O)c2ccccn2)C[C@H]1C |
| InChI | InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19+,27+/m1/s1 |
| InChIKey | BPZWTLHMBRUMNW-RYTUXRKISA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(2,5-difluorophenyl)-3-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-[oxo(2-pyridinyl)methyl]-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea (CHEBI:112069) is a azamacrocycle (CHEBI:52898) |
| 1-(2,5-difluorophenyl)-3-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-[oxo(2-pyridinyl)methyl]-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea (CHEBI:112069) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-23482 | LINCS |