Diosmetin 7-O-beta-D-glucopyranoside

Base Information

• Chemical Name: Diosmetin 7-O-beta-D-glucopyranoside
• CAS No.: 20126-59-4
• Deprecated CAS: 30370-81-1,58798-56-4
• Molecular Formula: C22H22 O11
• Molecular Weight: 462.41
• UNII: X641V68UOZ
• DSSTox Substance ID: DTXSID401310783
• Nikkaji Number: J146.445K
• Wikidata: Q23055362
• Metabolomics Workbench ID: 138659
• ChEMBL ID: CHEMBL488001
• Mol file: 20126-59-4.mol

Synonyms:20126-59-4;diosmetin-7-o-beta-d-glucopyranoside;Eridictiol;Diosmetol 7-glucoside;Diosmetin 7-O-beta-D-glucopyranoside;Diosmetin 7-O-glucoside;Diosmetin-7-O-|A-D-glucopyranoside;CHEMBL488001;X641V68UOZ;Flavone, 3',5,7-trihydroxy-4'-methoxy-, 7-.beta.-D-glucopyranoside;7-.beta.-D-Glucopyranosyldiosmetol;5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one;Diosmetin 7-O-.beta.-D-glucopyranoside;4H-1-Benzopyran-4-one, 7-(.beta.-D-glucopyranosyloxy)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-;Flavone, 3',5,7-trihydroxy-4'-methoxy-, 7-beta-D-glucopyranoside;5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one;diosmetin-7-glucoside;UNII-X641V68UOZ;DIOSMETIN 7-GLUCOSIDE;Diosmetin 7-O-beta-D-glucoside;CHEBI:188752;Diosmetin-7-o--D-glucopyranoside;WKUHPOMCLBLCOV-MIUGBVLSSA-N;DTXSID401310783;HY-N0713;BDBM50503753;MFCD20526611;ZB1879;AKOS030530342;DIOSMETIN 7-O-.BETA.-GLUCOSIDE;AC-34873;DIOSMETIN 7-O-.BETA.-D-GLUCOSIDE;MS-28493;CS-0009731;DIOSMETIN, 7-.BETA.-D-GLUCOPYRANOSIDE;DIOSMETIN-7-O-| cent-D-GLUCOPYRANOSIDE;7-O-(.BETA.-D-GLUCOPYRANOSYL)DIOSMETINE;GLUCOPYRANOSIDE, DIOSMETIN-7, .BETA.-D-;A934559;Q23055362;3',5-Dihydroxy-7-(beta-D-glucopyranosyloxy)-4'-methoxyflavone;7-O-.BETA.-D-GLUCOPYRANOSYL-3',5-DIHYDROXY-4'-METHOXYFLAVONE;5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-yl hexopyranoside #;7-(.BETA.-D-GLUCOPYRANOSYLOXY)-5-HYDROXY-2-(3-HYDROXY-4-METHOXYPHENYL)-4H-1-BENZOPYRAN-4-ONE;7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one

Chemical Property of Diosmetin 7-O-beta-D-glucopyranoside

Chemical Property:

• Melting Point: 253-255 oC
• Boiling Point: 803.6±65.0 °C(Predicted)
• PKA: 6.10±0.40(Predicted)
• PSA: 179.28000
• Density: 1.609
• LogP: 0.05850
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 5
• Exact Mass: 462.11621151
• Heavy Atom Count: 33
• Complexity: 729

Purity/Quality:

HPLC>98.0% ^*data from raw suppliers

Diosmetin-7-O-b-D-glucopyranoside ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O
• Isomeric SMILES: COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O
• Uses: Diosmetin-?7-?o-?β-?D-?glucopyranoside is a metabolite of Diosmetin (D485000) a metabolite of Apigenin. Antibacterial.

Technology Process of Diosmetin 7-O-beta-D-glucopyranoside

There total 2 articles about Diosmetin 7-O-beta-D-glucopyranoside 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:

→ 3′,5-dihydroxy-7-(β-D-glucopyranosyloxy)-4′-methoxyflavone (20126-59-4)

Guidance literature:

7-<β-D-2,3,4,6-Tetraacetyl-glucopyranosyl>-diosmetin, Verseifung mit 3percent NaOH in sd. A.;

Reference yield:

→ Diosmetin-7-O-β-D-glucopyranosid (20126-59-4)

Guidance literature:

Palustrosid (I), schrittweise Hydrolyse;

DOI:10.1007/BF00595064

Reference yield: 100.0%

3′,5-dihydroxy-7-(β-D-glucopyranosyloxy)-4′-methoxyflavone (20126-59-4) → diosmetin (520-34-3)

Guidance literature:

With hydrogenchloride; methanol; for 2h; Heating;

DOI:10.1248/cpb.50.788

Downstream raw materials:

diosmetin