EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H27N2O2 |
| Net Charge | +1 |
| Average Mass | 339.459 |
| Monoisotopic Mass | 339.20670 |
| SMILES | [H][C@@]12C[C@H](CC)[C@]3([H])[N@@H+](CCc4c(nc5ccccc45)[C@]3(C(=O)OC)C1)C2 |
| InChI | InChI=1S/C21H26N2O2/c1-3-14-10-13-11-21(20(24)25-2)18-16(8-9-23(12-13)19(14)21)15-6-4-5-7-17(15)22-18/h4-7,13-14,19,22H,3,8-12H2,1-2H3/p+1/t13-,14+,19+,21-/m1/s1 |
| InChIKey | NVVDQMVGALBDGE-PZXGUROGSA-O |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (−)-coronaridine(1+) (CHEBI:146232) is a ammonium ion derivative (CHEBI:35274) |
| (−)-coronaridine(1+) (CHEBI:146232) is conjugate acid of (−)-coronaridine (CHEBI:3887) |
| Incoming Relation(s) |
| (−)-coronaridine (CHEBI:3887) is conjugate base of (−)-coronaridine(1+) (CHEBI:146232) |
| IUPAC Name |
|---|
| 18-(methoxycarbonyl)ibogamin-6-ium |
| UniProt Name | Source |
|---|---|
| (−)-coronaridine | UniProt |
| Citations |
|---|