EMBL-EBI | Chemical Biology Resources | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H17NO2 |
| Net Charge | 0 |
| Average Mass | 219.284 |
| Monoisotopic Mass | 219.12593 |
| SMILES | C[NH+]1CCC(C(=O)[O-])(c2ccccc2)CC1 |
| InChI | InChI=1S/C13H17NO2/c1-14-9-7-13(8-10-14,12(15)16)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H,15,16) |
| InChIKey | KHUPPYUUMRDAAX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| pethidinic acid zwitterion (CHEBI:760933) is a monocarboxylic acid anion (CHEBI:35757) |
| pethidinic acid zwitterion (CHEBI:760933) is a piperidinium ion (CHEBI:48633) |
| pethidinic acid zwitterion (CHEBI:760933) is a zwitterion (CHEBI:27369) |
| Synonym | Source |
|---|---|
| pethidinate | SUBMITTER |
| UniProt Name | Source |
|---|---|
| meperidinate | UniProt |