Ursolic Acid

• CAS: 77-52-1
• Catalog Number: ACM77521
• Category: Material of Cosmetics
• Molecular Weight: 456.7
• Molecular Formula: C30H48O3
• Description: 1, antioxidant, anti-microbial, anti-aging, anti-inflammatory effects 2, skin whitening
• Synonyms: 3β-Hydroxy-12-ursen-28-ic acid
• IUPAC Name: (1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-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
• Canonical SMILES: C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O
• InChI: InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1
• InChI Key: WCGUUGGRBIKTOS-GPOJBZKASA-N
• Boiling Point: 502.79 °C
• Melting Point: 292 °C
• Flash Point: 304.6°C
• Density: 1.026 g/ml
• Appearance: White powder
• Assay: 0.9999
• Packaging: 1 kg
• pKa: 4.68±0.70
• Solubility In Water: Insoluble
• Storage Conditions: 2-8°C

Custom Q&A

What is the molecular formula of ursolic acid?

The molecular formula of ursolic acid is C30H48O3.

What is the molecular weight of ursolic acid?

The molecular weight of ursolic acid is 456.7 g/mol.

What is the IUPAC name of ursolic acid?

The IUPAC name of ursolic acid is (1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-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.

What is the InChI of ursolic acid?

The InChI of ursolic acid is InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1.

What is the InChIKey of ursolic acid?

The InChIKey of ursolic acid is WCGUUGGRBIKTOS-GPOJBZKASA-N.

What is the canonical SMILES of ursolic acid?

The canonical SMILES of ursolic acid is CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O.

What are the synonyms of ursolic acid?

The synonyms of ursolic acid include Prunol, Malol, and Urson.

Where is ursolic acid found in nature?

Ursolic acid is found in Gladiolus italicus, Freziera, and other organisms.

What are the potential pharmacologic activities of ursolic acid?

Ursolic acid has a variety of potential pharmacologic activities, including anti-inflammatory, antioxidative, antiviral, serum lipid-lowering, and antineoplastic activities. It may promote apoptosis and inhibit cancer cell proliferation.

What is the ChEBI identifier for ursolic acid?

The ChEBI identifier for ursolic acid is CHEBI:9825.