Xanthomegnin

Base Information

• Chemical Name: Xanthomegnin
• CAS No.: 1685-91-2
• Molecular Formula: C30H22 O12
• Molecular Weight: 574.497
• NSC Number: 264720
• DSSTox Substance ID: DTXSID60937500
• Wikidata: Q72516638
• Mol file: 1685-91-2.mol

Synonyms:3,3'-bis(2-methoxy-5-hydroxy-7-(2-hydroxypropyl)-8- carboxyl-1,4-naphthoquinone lactone);xanthomegnin

Chemical Property of Xanthomegnin

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 943.7°Cat760mmHg
• Flash Point: 315.7°C
• PSA: 179.80000
• Density: 1.63g/cm³
• LogP: 2.55980
• XLogP3: 4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 3
• Exact Mass: 574.11112613
• Heavy Atom Count: 42
• Complexity: 1260

Purity/Quality:

98% ^*data from raw suppliers

Xanthomegnin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC2=CC3=C(C(=C2C(=O)O1)O)C(=O)C(=C(C3=O)OC)C4=C(C(=O)C5=C(C4=O)C(=C6C(=C5)CC(OC6=O)C)O)OC
• Uses: Xanthomegnin is a napthoquinone mycotoxin and its presence in the epidermis is used in the diagnosis of a Trichophyton rubrum infections.

Technology Process of Xanthomegnin

There total 1 articles about Xanthomegnin 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:

→ xanthomegnin (1685-91-2)

Guidance literature:

7-Desmethylxanthomegnin (16a), CH2N2;

DOI:10.1002/cber.19791120319

Reference yield:

xanthomegnin (1685-91-2) → (R)-3-hydroxybutyric acid (625-72-9,26063-00-3,29435-48-1)

Guidance literature:

Multistep reaction;

DOI:10.1139/v69-197

Downstream raw materials:

(R)-3-hydroxybutyric acid

Refernces