EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H33N3O5S |
| Net Charge | 0 |
| Average Mass | 487.622 |
| Monoisotopic Mass | 487.21409 |
| SMILES | CC=Cc1ccc2c(c1)O[C@@H](CN(C)C(=O)Cc1cccnc1)[C@H](C)CN([C@@H](C)CO)S2(=O)=O |
| InChI | InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/t18-,19+,23+/m1/s1 |
| InChIKey | JSQMQZOUAVKGAV-MSYCTHLASA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-7625 (CHEBI:96246) is a styrenes (CHEBI:26799) |
| Manual Xrefs | Databases |
|---|---|
| LSM-7625 | LINCS |