Isotachioside

Base Information

Chemical Name:Isotachioside
CAS No.:31427-08-4
Molecular Formula:C13H18 O8
Molecular Weight:302.281
Hs Code.:
DSSTox Substance ID:DTXSID401317741
Nikkaji Number:J418.354A
Wikidata:Q27136834
Mol file:31427-08-4.mol

Synonyms:Isotachioside;31427-08-4;4-hydroxy-2-methoxyphenyl beta-D-glucopyranoside;(2S,3R,4S,5S,6R)-2-(4-hydroxy-2-methoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol;4-hydroxy-2-methoxyphenyl 1-O-beta-D-glucopyranoside;CHEBI:68337;DTXSID401317741;HY-N3455;AKOS032948220;FS-9745;CS-0024281;2-methoxy-4-hydroxyphenol-1-O-beta-d-glucopyranoside;Q27136834;(2S,3R,4S,5S,6R)-2-(4-hydroxy-2-methoxy-phenoxy)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol;Glucopyranoside, 4-hydroxy-2-methoxyphenyl, -D- (8CI);4-Hydroxy-2-methoxyphenyl -D-glucopyranoside

Suppliers and Price of Isotachioside

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

Arctom
Isotachioside ≥98%
5mg
$ 463.00

Total 10 raw suppliers

Chemical Property of Isotachioside

Chemical Property:

Boiling Point:579.9±50.0 °C(Predicted)
PKA:9.76±0.20(Predicted)
PSA：128.84000
Density:1.519±0.06 g/cm3(Predicted)
LogP:-1.42050
XLogP3:-1.4
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:302.10016753
Heavy Atom Count:21
Complexity:327

Purity/Quality:

99% ^*data from raw suppliers

Isotachioside ≥98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C=CC(=C1)O)OC2C(C(C(C(O2)CO)O)O)O
Isomeric SMILES:COC1=C(C=CC(=C1)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O

Technology Process of Isotachioside

There total 8 articles about Isotachioside 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: 85.0%

: 2-methoxy-4-(tert-butyldimethylsiloxy)phenyl-β-D-glucoside

: 31427-08-4
tachioside

Guidance literature:: With hydrogenchloride; In tetrahydrofuran; water; at 0 - 20 ℃; for 18h;
DOI:10.1016/j.carres.2018.06.004

Reference yield:

: 824-46-4
methoxyhydroquinone

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

: 109194-60-7
tachioside

: 31427-08-4
tachioside

Guidance literature:: methoxyhydroquinone; 2,3,4,6-tetra-O-acetyl-α-D-glucopyranosyl bromide; With sodium hydroxide; In water; acetone; at 20 ℃; for 24h; Darkness;

In methanol; water; for 0.0833333h;
DOI:10.1021/acs.jafc.7b05674

Reference yield:

: 251921-28-5
2,4-dihydroxyphenyl-tetra-O-acetyl-β-D-glucopyranoside

: 31427-08-4
tachioside

Guidance literature:: Multi-step reaction with 4 steps

1: N-ethyl-N,N-diisopropylamine / dichloromethane / 24 h / 0 - 20 °C / Inert atmosphere

2: sodium methylate; methanol / 4 h / 0 - 20 °C

3: potassium carbonate / N,N-dimethyl-formamide / 24 h / 20 °C

4: hydrogenchloride / tetrahydrofuran; water / 18 h / 0 - 20 °C

With hydrogenchloride; methanol; sodium methylate; potassium carbonate; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; dichloromethane; water; N,N-dimethyl-formamide;
DOI:10.1016/j.carres.2018.06.004