EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C27H35F2N3O5 |
| Net Charge | 0 |
| Average Mass | 519.589 |
| Monoisotopic Mass | 519.25448 |
| SMILES | COCC(=O)Nc1ccc2c(c1)C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc1cc(F)ccc1F)[C@@H](C)CO2 |
| InChI | InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18+,25-/m1/s1 |
| InChIKey | ZVOSTPFCAQQCID-FUMQJTLXSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(4S,7R,8S)-5-[(2,5-difluorophenyl)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]-2-methoxyacetamide (CHEBI:103568) is a azamacrocycle (CHEBI:52898) |
| N-[(4S,7R,8S)-5-[(2,5-difluorophenyl)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]-2-methoxyacetamide (CHEBI:103568) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-14912 | LINCS |