EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C33H39N3O5S |
| Net Charge | 0 |
| Average Mass | 589.758 |
| Monoisotopic Mass | 589.26104 |
| SMILES | Cc1ccc(S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(n(C)c4ccccc34)C(=O)N([C@@H](C)CO)C[C@H]2C)cc1 |
| InChI | InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30+/m1/s1 |
| InChIKey | GTYKJOKWQTUGAM-QEGDFHJFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-30715 (CHEBI:119266) is a sulfonamide (CHEBI:35358) |
| Manual Xrefs | Databases |
|---|---|
| LSM-30715 | LINCS |