Bovosidol A

Base Information

• Chemical Name: Bovosidol A
• CAS No.: 468-13-3
• Molecular Formula: C31H46O9
• Molecular Weight: 562.6915
• DSSTox Substance ID: DTXSID30963659

Synonyms:Bovosidol A;BRN 0071268;468-13-3;DTXSID30963659;Bufa-20,22-dienolide, 3-(6-deoxy-3-O-methyl-D-glucopyranosyl)oxy-14,19-dihydroxy-;3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14,19-dihydroxybufa-20,22-dienolide

Chemical Property of Bovosidol A

Chemical Property:

• Vapor Pressure: 1.33E-25mmHg at 25°C
• Boiling Point: 744.8°Cat760mmHg
• Flash Point: 238.5°C
• Density: 1.32g/cm³
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 562.31418304
• Heavy Atom Count: 40
• Complexity: 1040

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=COC(=O)C=C6)O)C)CO)O)OC)O
• Isomeric SMILES: CC1[C@H](C(C([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CCC4C3CC[C@]5([C@@]4(CC[C@@H]5C6=COC(=O)C=C6)O)C)CO)O)OC)O

Technology Process of Bovosidol A

There total 1 articles about Bovosidol A 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:

14-hydroxy-3β-(O3-methyl-6-deoxy-α-L-glucopyranosyloxy)-19-oxo-5α,14β-bufa-20,22-dienolide (110098-43-6) → 14,19-dihydroxy-3β-(O3-methyl-6-deoxy-α-L-glucopyranosyloxy)-5α,14β-bufa-20,22-dienolide (468-13-3)

Guidance literature:

With 1,4-dioxane; sodium borate;

DOI:10.1002/hlca.19530360627

upstream raw materials:

14-hydroxy-3β-(O³-methyl-6-deoxy-α-L-glucopyranosyloxy)-19-oxo-5α,14β-bufa-20,22-dienolide

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