EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H32N2O7S |
| Net Charge | 0 |
| Average Mass | 492.594 |
| Monoisotopic Mass | 492.19302 |
| SMILES | CO[C@H](CN(C)C(=O)c1ccc2c(c1)OCO2)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1 |
| InChI | InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23+/m0/s1 |
| InChIKey | ADONDIFMYIEKMI-IUKKYPGJSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3S)-4-[benzenesulfonyl-[(2S)-1-hydroxypropan-2-yl]amino]-2-methoxy-3-methylbutyl]-N-methyl-1,3-benzodioxole-5-carboxamide (CHEBI:97342) is a sulfonamide (CHEBI:35358) |
| Manual Xrefs | Databases |
|---|---|
| LSM-8721 | LINCS |