Molecule Details
| InChIKey | OBZHEBDUNPOCJG-WBXJDKIVSA-N |
|---|---|
| Compound Name | Carbenoxolone |
| Canonical SMILES | CC1(C)[C@@H](OC(=O)CCC(=O)O)CC[C@]2(C)[C@H]3C(=O)C=C4[C@@H]5C[C@@](C)(C(=O)O)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@H]12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.62 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB02329 |
|---|---|
| Drug Name | Carbenoxolone |
| CAS Number | 5697-56-3 |
| Groups | experimental |
| ATC Codes | A02BX01 A02BX71 A02BX51 |
| Description | An agent derived from licorice root. It is used for the treatment of digestive tract ulcers, especially in the stomach. Antidiuretic side effects are frequent, but otherwise the drug is low in toxicity. [PubChem] |
Categories: Alimentary Tract and Metabolism Anti-Ulcer Agents Drugs for Acid Related Disorders Drugs for Peptic Ulcer and Gastro-Oesophageal Reflux Disease (Gord) Gastrointestinal Agents Pentacyclic Triterpenes Terpenes Triterpenes
Cross-references: BindingDB: 50247012 CHEMBL499915 ChemSpider: 552190 PDB: CBO PubChem:636403 PubChem:46508820 RxCUI: 2017 Therapeutic Targets Database: DNC000388 Wikipedia: Carbenoxolone ZINC: ZINC000003977823