EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C23H24N2O3S |
| Net Charge | 0 |
| Average Mass | 408.523 |
| Monoisotopic Mass | 408.15076 |
| SMILES | N#C[C@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@H](CO)N1S(=O)(=O)c1ccccc1 |
| InChI | InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22-,23+/m0/s1 |
| InChIKey | POAXSVANNSAIAV-RJGXRXQPSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2R,3R,4R)-1-(benzenesulfonyl)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile (CHEBI:101150) is a azetidines (CHEBI:38777) |
| (2R,3R,4R)-1-(benzenesulfonyl)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile (CHEBI:101150) is a benzenes (CHEBI:22712) |
| (2R,3R,4R)-1-(benzenesulfonyl)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile (CHEBI:101150) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-12519 | LINCS |