EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H33ClN4O4 |
| Net Charge | 0 |
| Average Mass | 489.016 |
| Monoisotopic Mass | 488.21903 |
| SMILES | CCOC(=O)N1CCC(NC(=O)C2CCCN(Cc3nc(-c4cccc(Cl)c4)oc3C)C2)CC1 |
| InChI | InChI=1S/C25H33ClN4O4/c1-3-33-25(32)30-12-9-21(10-13-30)27-23(31)19-7-5-11-29(15-19)16-22-17(2)34-24(28-22)18-6-4-8-20(26)14-18/h4,6,8,14,19,21H,3,5,7,9-13,15-16H2,1-2H3,(H,27,31) |
| InChIKey | AUGUBBXUTRDLNA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[[[1-[[2-(3-chlorophenyl)-5-methyl-4-oxazolyl]methyl]-3-piperidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester (CHEBI:109773) is a 1,3-oxazoles (CHEBI:46812) |
| Manual Xrefs | Databases |
|---|---|
| LSM-21201 | LINCS |