EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H23NO4S |
| Net Charge | 0 |
| Average Mass | 361.463 |
| Monoisotopic Mass | 361.13478 |
| SMILES | CC(C)CCOC(=O)C1[C@H]2C(=O)N(Cc3cccs3)C[C@]23C=C[C@H]1O3 |
| InChI | InChI=1S/C19H23NO4S/c1-12(2)6-8-23-18(22)15-14-5-7-19(24-14)11-20(17(21)16(15)19)10-13-4-3-9-25-13/h3-5,7,9,12,14-16H,6,8,10-11H2,1-2H3/t14-,15?,16+,19-/m1/s1 |
| InChIKey | QSPUODWHQMJTCS-QBKPQXPVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-20631 (CHEBI:109234) is a isoindoles (CHEBI:24897) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20631 | LINCS |