Dtxcid003697

Base Information

• Chemical Name: Dtxcid003697
• CAS No.: 10310-32-4
• Molecular Formula: C29H34O6
• Molecular Weight: 478.585
• DSSTox Substance ID: DTXSID7023697
• Metabolomics Workbench ID: 143624
• ChEMBL ID: CHEMBL2360829
• Mol file: 10310-32-4.mol

Synonyms:DTXSID7023697;DTXCID003697;NCGC00016690-01;CAS-10310-32-4;SCHEMBL637602;CHEMBL2360829;Tox21_110564;Tox21_110564_1;NCGC00179274-03;ethyl 3,5,6-tris-O-(phenylmethyl)-beta-D-glucofuranoside

Chemical Property of Dtxcid003697

Chemical Property:

• Vapor Pressure: 3.55E-16mmHg at 25°C
• Refractive Index: 1.59
• Boiling Point: 618.877 °C at 760 mmHg
• PKA: 13.01±0.70(Predicted)
• Flash Point: 328.085 °C
• PSA: 66.38000
• Density: 1.196 g/cm³
• LogP: 4.49630
• Storage Temp.: -20°C
• Solubility.: Practically insoluble in water, very soluble in acetone, in methanol and in methylene chloride.
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 13
• Exact Mass: 478.23553880
• Heavy Atom Count: 35
• Complexity: 555

Purity/Quality:

98%, ^*data from raw suppliers

Ethyl 3,5,6-tri-O-benzyl-D-glucofuranoside ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1C(C(C(O1)C(COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)O
• Isomeric SMILES: CCO[C@H]1[C@@H]([C@H]([C@H](O1)C(COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)O
• Uses: Tribenoside is a vasoprotective drug. It’s used in the treatment of hemorrhoids as it has mild anti-inflammatory and wound healing properties. Sclerosing agent.
• Therapeutic Function: Topical venotonic

Technology Process of Dtxcid003697

There total 1 articles about Dtxcid003697 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:

1,2-O-isopropylidene-α-D-gluco-/β-L-idofuranose (253328-56-2) + benzyl chloride (100-44-7) → tribenoside (10310-32-4)

Guidance literature:

1,2-O-isopropylidene-α-D-gluco-/β-L-idofuranose; In dimethyl sulfoxide; at 30 ℃; for 1h;

benzyl chloride; In dimethyl sulfoxide; at 30 ℃; for 1h; Temperature;

upstream raw materials:

1,2-O-isopropylidene-α-D-gluco-/β-L-idofuranose

benzyl chloride

Refernces