EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:228460 - 3-hydroxyquinuclidine-3-carbonitrile hydrochloride
| Formula | C8H12N2O.HCl |
| Net Charge | 0 |
| Average Mass | 188.658 |
| Monoisotopic Mass | 188.07164 |
| SMILES | Cl.N#CC1(O)CN2CCC1CC2 |
| InChI | InChI=1S/C8H12N2O.ClH/c9-5-8(11)6-10-3-1-7(8)2-4-10;/h7,11H,1-4,6H2;1H |
| InChIKey | BAWCCOIFJYOGEB-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | urine (BTO:0001419) | MetaboLights (MTBLS8662) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-hydroxyquinuclidine-3-carbonitrile hydrochloride (CHEBI:228460) is a quinuclidines (CHEBI:26518) |
| IUPAC Name |
|---|
| 3-hydroxy-1-azabicyclo[2.2.2]octane-3-carbonitrile;hydrochloride |
| Manual Xrefs | Databases |
|---|---|
| 2102671 | ChemSpider |