EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H30N2O4S |
| Net Charge | 0 |
| Average Mass | 382.526 |
| Monoisotopic Mass | 382.19263 |
| SMILES | CC=Cc1ccc2c(c1)O[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)S2(=O)=O |
| InChI | InChI=1S/C19H30N2O4S/c1-6-7-16-8-9-19-17(10-16)25-18(12-20(4)5)14(2)11-21(15(3)13-22)26(19,23)24/h6-10,14-15,18,22H,11-13H2,1-5H3/t14-,15+,18+/m0/s1 |
| InChIKey | KDXLDHVMUOGHJB-HDMKZQKVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-41763 (CHEBI:130214) is a styrenes (CHEBI:26799) |
| Manual Xrefs | Databases |
|---|---|
| LSM-41763 | LINCS |