Hellebrigenin glucoside

Base Information

Chemical Name:Hellebrigenin glucoside
CAS No.:72947-90-1
Deprecated CAS:100991-82-0,101053-42-3
Molecular Formula:C30H42O11
Molecular Weight:578.6479
Hs Code.:
DSSTox Substance ID:DTXSID30905872
Nikkaji Number:J1.883.451K
Wikidata:Q76155410
Metabolomics Workbench ID:134354
ChEMBL ID:CHEMBL446052

Synonyms:Hellebrigenin glucoside;Hellebrigenin-D-glucose;72947-90-1;BRN 0073262;(3S,5S,8R,9S,10S,13R,14S,17R)-5,14-dihydroxy-13-methyl-17-(6-oxopyran-3-yl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde;4-18-00-03182 (Beilstein Handbook Reference);3-beta-((D-Glucopyranosyl)oxy)-5,14-dihydroxy-19-oxo-5-beta-bufa-20,22-dienolide;5-beta-Bufa-20,22-dienolide, 3-beta-((D-glucopyranosyl)oxy)-5,14-dihydroxy-19-oxo-;Hellebrigenin-3-O-?-glucoside;C30H42O11;C30-H42-O11;CHEMBL446052;DTXSID30905872;CHEBI:182734;AKOS040738771;LS-45301;Hellebrigenin-3-O-??-glucoside, >=95% (LC/MS-ELSD);3-(Hexopyranosyloxy)-5,14-dihydroxy-19-oxobufa-20,22-dienolide;3beta-(beta-D-Glucopyranosyloxy)-5,14-dihydroxy-19-oxo-5beta-bufa-20,22-dienolide;100991-82-0;NCGC00347381-02!(3S,5S,8R,9S,10S,13R,14S,17R)-5,14-dihydroxy-13-methyl-17-(6-oxopyran-3-yl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde

Suppliers and Price of Hellebrigenin glucoside

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of Hellebrigenin glucoside

Chemical Property:

Vapor Pressure:7.59E-30mmHg at 25°C
Boiling Point:803.2°Cat760mmHg
Flash Point:260.6°C
PSA：187.12000
Density:1.46g/cm³
LogP:0.36000
XLogP3:-0.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:5
Exact Mass:578.27271215
Heavy Atom Count:41
Complexity:1120

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC12CCC3C(C1(CCC2C4=COC(=O)C=C4)O)CCC5(C3(CCC(C5)OC6C(C(C(C(O6)CO)O)O)O)C=O)O
Isomeric SMILES:C[C@]12CC[C@H]3[C@H]([C@]1(CC[C@@H]2C4=COC(=O)C=C4)O)CC[C@]5([C@@]3(CC[C@@H](C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C=O)O

Technology Process of Hellebrigenin glucoside

There total 1 articles about Hellebrigenin glucoside 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:

: 572-09-8
2,3,4,6-tetra-O-acetyl-α-D-glucopyranosyl bromide

: 72947-90-1,101053-42-3
hellebrigenin-3-O-β-glucoside

Guidance literature:: With 1,4-dioxane; tetrachloromethane; silver carbonate; Reagens 4: Benzol; Behandeln des Reaktionsprodukts mit Kaliumhydrogencarbonat in wss. Methanol;
DOI:10.1002/hlca.19590420341