Structure via PubChem · Public domain (PubChem)
corosolic acid
Sign in to saveAlso known as 2α-hydroxyursolic acid, urs-12-en-28-oic acid, 2,3-dihydroxy-, (2alpha,3beta)-, colosic acid, glucosol
chemical compound
Chemical data
- Formula
- C30H48O4
- Molecular weight
- 472.7 g/mol
- IUPAC name
- (1S,2R,4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-10,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
- SMILES
- C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(C[C@H]([C@@H](C5(C)C)O)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O
- InChIKey
- HFGSQOYIOKBQOW-ZSDYHTTISA-N
- XLogP
- 6.4
- Polar surface area
- 77.8 Ų
- H-bond donors
- 3
- H-bond acceptors
- 4
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Mass
- 472.35526
Show 4 more facts
- found in taxon
- Lamiaceae
- chemical formula
- C₃₀H₄₈O₄
- canonical SMILES
- CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O
- isomeric SMILES
- C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(C[C@H]([C@@H](C5(C)C)O)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O
Sources (2)
via Wikidata · CC0