Molecule
(1-ethyl-1-methylpiperidin-1-ium-3-yl) 2-hydroxy-2,2-diphenylacetate
Chemical Information
| InChI | InChI=1S/C22H28NO3/c1-3-23(2)16-10-15-20(17-23)26-21(24)22(25,18-11-6-4-7-12-18)19-13-8-5-9-14-19/h4-9,11-14,20,25H,3,10,15-17H2,1-2H3/q+1 |
|---|---|
| SMILES | CC[N+]1(CCCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C |
| InChI Key | WPUKUEMZZRVAKZ-UHFFFAOYSA-N |
| Exact Mass | 354.207 g/mol |
Metadata Information
| Field | Value |
|---|---|
| NFDI4Chem Molecule ID | nfdi4chem-mol74765 |
| Source | |
| Alternate Name |
| Field | Value |
|---|---|
| No additional information available for this Dataset. | |
| Data-Source Molecule ID | Data-Source |
|---|---|
| DB13844 | drugbank |
| CHEBI:95178 | chebi |
| CHEMBL1619528 | chembl |
| 25957021 | surechembl |
| 4832 | pubchem |
| RS3K5YXV34 | fdasrs |
| PD013303 | probes_and_drugs |
| DTXSID9048481 | comptox |
| 2185 | drugcentral |
| The data in this table is sourced from UniChem at EBI. | |