Structure via PubChem · Public domain (PubChem)
オレアノリン酸
Sign in to saveAlso known as Giganteumgenin C, Virgaureagenin B, Caryophyllin, Astrantiagenin C, Oleanic acid, Olean-12-en-28-oic acid, 3-hydroxy-, (3-beta)-, 3beta-Hydroxyolean-12-en-28-oic acid, 3-beta-Hydroxyolean-12-en-28-oate
chemical compound
Chemical data
- Formula
- C30H48O3
- Molecular weight
- 456.7 g/mol
- 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
- SMILES
- C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O
- InChIKey
- MIJYXULNPSFWEK-GTOFXWBISA-N
- XLogP
- 7.5
- Polar surface area
- 57.5 Ų
- H-bond donors
- 2
- H-bond acceptors
- 3
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Research
6,806 papers- Oleanolic acid.Phytochemistry · 2012
- Oleanolic Acid: Extraction, Characterization and Biological Activity.Nutrients · 2022
- Oleanolic acid derivatives for pharmaceutical use: a patent review.Expert opinion on therapeutic patents · 2016
- Oleanolic acid and ursolic acid: therapeutic potential in neurodegenerative diseases, neuropsychiatric diseases and other brain disorders.Nutritional neuroscience · 2023
- Development and Evaluation of Oleanolic Acid Dosage Forms and Its Derivatives.BioMed research international · 2020
via PubMed
Wikidata facts
- Mass
- 456.360345
Show 5 more facts
- found in taxon
- Aspergillus
- chemical formula
- C₃₀H₄₈O₃
- canonical SMILES
- CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
- isomeric SMILES
- C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O
- Commons category
- Oleanolic acid
via Wikidata · CC0