Glabrol

Base Information

• Chemical Name: Glabrol
• CAS No.: 59870-65-4
• Molecular Formula: C25H28O4
• Molecular Weight: 392.495
• UNII: E4XEY076JN
• ChEMBL ID: CHEMBL462721
• Metabolomics Workbench ID: 27206
• Nikkaji Number: J179.706I
• Pharos Ligand ID: KZR5Q6MLD1VK
• Mol file: 59870-65-4.mol

Synonyms:glabrol

Chemical Property of Glabrol

Chemical Property:

• Vapor Pressure: 5.41E-15mmHg at 25°C
• Boiling Point: 600°C at 760 mmHg
• Flash Point: 204.3°C
• PSA: 66.76000
• Density: 1.166g/cm³
• LogP: 5.82170
• XLogP3: 6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 392.19875937
• Heavy Atom Count: 29
• Complexity: 629

Purity/Quality:

HPLC≥98% ^*data from raw suppliers

Glabrol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCC1=C(C=CC(=C1)C2CC(=O)C3=C(O2)C(=C(C=C3)O)CC=C(C)C)O)C
• Isomeric SMILES: CC(=CCC1=C(C=CC(=C1)[C@@H]2CC(=O)C3=C(O2)C(=C(C=C3)O)CC=C(C)C)O)C
• Uses: Glabrol is an extract from licorice root which may provide antibacterial and antiadhesive activity, as well as antioxidative effects.

Technology Process of Glabrol

There total 13 articles about Glabrol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 81.0%

C25H28O4 → Glabrol (59870-65-4)

Guidance literature:

With Eu⁽³⁺⁾*C₁₀H₁₀F₇O₂^(1-); In toluene; at 100 ℃; for 2h; Time; regioselective reaction; Microwave irradiation;

DOI:10.1002/anie.201306500

Reference yield: 47.0%

Acetic acid (S)-2-[4-acetoxy-3-(3-methyl-but-2-enyl)-phenyl]-8-(3-methyl-but-2-enyl)-4-oxo-chroman-7-yl ester → glabrol (59870-65-4)

Guidance literature:

With sodium peroxoborate tetrahydrate; In methanol; at 20 ℃; for 5h;

DOI:10.1002/anie.201306500

Reference yield:

7,4'-Di(methoxymethoxy)-8,3'-di-(C-prenyl)flavanone (89024-13-5) → Glabrol (59870-65-4)

Guidance literature:

With hydrogenchloride; In methanol; for 0.166667h; Heating;

upstream raw materials:

7,4'-dihydroxy-dihydroflavone

7,4'-Di(methoxymethoxy)-8,3'-di-(C-prenyl)flavanone

4-hydroxy-3-C-prenylbenzaldehyde

2,4-Dihydroxy-3-C-prenylacetophenone