Karounidiol

Base Information

• Chemical Name: Karounidiol
• CAS No.: 118117-31-0
• Molecular Formula: C₃₀H₄₈O₂
• Molecular Weight: 440.71
• NSC Number: 705536
• Nikkaji Number: J514.544I
• Wikidata: Q27155012
• Metabolomics Workbench ID: 125969
• ChEMBL ID: CHEMBL1983444
• Mol file: 118117-31-0.mol

Synonyms:DC-friedo-oleana-7,9(11)-diene-3alpha,29-diol;isokarounidiol;karounidiol

Chemical Property of Karounidiol

Chemical Property:

• Vapor Pressure: 4.84E-14mmHg at 25°C
• Boiling Point: 542.7°Cat760mmHg
• Flash Point: 222.5°C
• PSA: 40.46000
• Density: 1.07g/cm³
• LogP: 7.06140
• XLogP3: 7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 440.365430770
• Heavy Atom Count: 32
• Complexity: 868

Purity/Quality:

Analysis control,HPLC≥95% ^*data from raw suppliers

Karounidiol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C(CCC2(C1CC=C3C2=CCC4(C3(CCC5(C4CC(CC5)(C)CO)C)C)C)C)O)C
• Isomeric SMILES: C[C@]12CC[C@@](C[C@H]1[C@@]3(CC=C4C(=CC[C@@H]5[C@@]4(CC[C@H](C5(C)C)O)C)[C@]3(CC2)C)C)(C)CO

Technology Process of Karounidiol

There total 1 articles about Karounidiol 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:

(3α,7β)-3,7,29-trihydroxymultiflor-8-ene-3,29-diyl dibenzoate (873001-54-8) → karounidiol (118117-31-0)

Guidance literature:

With potassium hydroxide; In methanol; at 80 ℃; for 2h;

DOI:10.1002/hlca.200590202

upstream raw materials:

(3α,7β)-3,7,29-trihydroxymultiflor-8-ene-3,29-diyl dibenzoate

Refernces