EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H32N2O4S |
| Net Charge | 0 |
| Average Mass | 456.608 |
| Monoisotopic Mass | 456.20828 |
| SMILES | O=S(=O)(Cc1ccccc1)N1CC2(C1)[C@H](c1ccccc1)[C@@H](CO)N2CC1CCOCC1 |
| InChI | InChI=1S/C25H32N2O4S/c28-16-23-24(22-9-5-2-6-10-22)25(27(23)15-20-11-13-31-14-12-20)18-26(19-25)32(29,30)17-21-7-3-1-4-8-21/h1-10,20,23-24,28H,11-19H2/t23-,24-/m1/s1 |
| InChIKey | SHHCTENLFGNNGC-DNQXCXABSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [(2S,3R)-1-(4-oxanylmethyl)-3-phenyl-6-(phenylmethyl)sulfonyl-1,6-diazaspiro[3.3]heptan-2-yl]methanol (CHEBI:127072) is a azetidines (CHEBI:38777) |
| [(2S,3R)-1-(4-oxanylmethyl)-3-phenyl-6-(phenylmethyl)sulfonyl-1,6-diazaspiro[3.3]heptan-2-yl]methanol (CHEBI:127072) is a benzenes (CHEBI:22712) |
| [(2S,3R)-1-(4-oxanylmethyl)-3-phenyl-6-(phenylmethyl)sulfonyl-1,6-diazaspiro[3.3]heptan-2-yl]methanol (CHEBI:127072) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-38635 | LINCS |