EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C4H6O6.C11H16N2O |
| Net Charge | 0 |
| Average Mass | 342.348 |
| Monoisotopic Mass | 342.14270 |
| SMILES | Cc1ncccc1OC[C@@H]1CCCN1.O=C(O)C(O)C(O)C(=O)O |
| InChI | InChI=1S/C11H16N2O.C4H6O6/c1-9-11(5-3-6-12-9)14-8-10-4-2-7-13-10;5-1(3(7)8)2(6)4(9)10/h3,5-6,10,13H,2,4,7-8H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t10-;/m0./s1 |
| InChIKey | WOYZAVAGHHPUIK-PPHPATTJSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| pozanicline tartrate (CHEBI:751550) is a chloropyridine (CHEBI:39173) |
| Synonyms | Source |
|---|---|
| A-87089.74 | ChEMBL |
| Pozanicline tartrate | ChEMBL |