EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H16N2O3S |
| Net Charge | 0 |
| Average Mass | 256.327 |
| Monoisotopic Mass | 256.08816 |
| SMILES | Cc1ccc(N2CCNCC2)c(S(=O)(=O)O)c1 |
| InChI | InChI=1S/C11H16N2O3S/c1-9-2-3-10(11(8-9)17(14,15)16)13-6-4-12-5-7-13/h2-3,8,12H,4-7H2,1H3,(H,14,15,16) |
| InChIKey | DCDFLGVJWQIRGH-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| caldaret (CHEBI:752091) is a piperazines (CHEBI:26144) |
| INN | Source |
|---|---|
| caldaret | WHO MedNet |