EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C28H38N4O4 |
| Net Charge | 0 |
| Average Mass | 494.636 |
| Monoisotopic Mass | 494.28931 |
| SMILES | CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc2ccncc2)C[C@@H]1C |
| InChI | InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20-,26+/m0/s1 |
| InChIKey | SPHXOOCVMGXZSD-CUVVAGTFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(4S,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(pyridin-4-ylmethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]cyclobutanecarboxamide (CHEBI:115185) is a azamacrocycle (CHEBI:52898) |
| N-[(4S,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(pyridin-4-ylmethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]cyclobutanecarboxamide (CHEBI:115185) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-26645 | LINCS |