EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H32N2O5S |
| Net Charge | 0 |
| Average Mass | 472.607 |
| Monoisotopic Mass | 472.20319 |
| SMILES | CC=Cc1ccc2c(c1)O[C@H](CN(C)C(=O)c1ccccc1)[C@H](C)CN([C@H](C)CO)S2(=O)=O |
| InChI | InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/t18-,19-,23-/m1/s1 |
| InChIKey | BEUJQTDXAJTLJD-DNVFCKCGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-31055 (CHEBI:119609) is a benzamides (CHEBI:22702) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31055 | LINCS |