Ligand Id: 3306
Ligand name oleanolic acid

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 57.53
Molecular weight 456.36
XLogP 9.05
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Natural product or derivative
IUPAC Name
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Database Links
CAS Registry No. 508-02-1 (source: Scifinder)
ChEBI CHEBI:37659
Human Metabolome Database HMDB02364
Search on ChemSpider MIJYXULNPSFWEK-GTOFXWBISA-N
Wikipedia Oleanolic_acid
ZINC ZINC38140516

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org