齐墩果醇酸

Also 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

一种天然五环三萜物质

In the Vinony graph

Vinony's link graph records 322 inbound references to 齐墩果醇酸, and connects out to terpene, terpenoids and Olea europaea.

It sits within the topics Chemical articles with multiple compound IDs, ECHA InfoCard ID from Wikidata and Hydroxycarboxylic acids.

Vinony links it to 15 Wikipedia language editions.

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 Å²
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

Sources (4)

via Wikidata · CC0