EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C30H33N3O5S |
| Net Charge | 0 |
| Average Mass | 547.677 |
| Monoisotopic Mass | 547.21409 |
| SMILES | C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C#N)c2)OCc2ccccc2-c2ccccc2C1=O |
| InChI | InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29-/m0/s1 |
| InChIKey | RWOMJVAVZPFCIF-KERYWQKISA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-14919 (CHEBI:103575) is a sulfonamide (CHEBI:35358) |
| Manual Xrefs | Databases |
|---|---|
| LSM-14919 | LINCS |