EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H30O3S |
| Net Charge | 0 |
| Average Mass | 374.546 |
| Monoisotopic Mass | 374.19157 |
| SMILES | CC12CCC(=O)C=C1CC(S)C1C2CCC2(C)C1CCC21CCC(=O)O1 |
| InChI | InChI=1S/C22H30O3S/c1-20-7-3-14(23)11-13(20)12-17(26)19-15(20)4-8-21(2)16(19)5-9-22(21)10-6-18(24)25-22/h11,15-17,19,26H,3-10,12H2,1-2H3 |
| InChIKey | NZCDWYJROUPYPT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7 -thiospironolactone (CHEBI:143449) is a steroid lactone (CHEBI:26766) |