Pentaacetyl geniposide

Base Information

Chemical Name:Pentaacetyl geniposide
CAS No.:49776-64-9
Molecular Formula:C27H34O15
Molecular Weight:598.5499
Hs Code.:
DSSTox Substance ID:DTXSID30198040
Nikkaji Number:J2.121.727A
Wikidata:Q27106710
Mol file:49776-64-9.mol

Synonyms:(Ac)5-geniposide;1-(beta-D-2',3',4',6'-tetraacetylglucopyranosyloxyl)-1,4a,5,7a-tetrahydro-7-(acetomethyl)cyclopentapyran-4-carboxylic acid methyl ester;genipin glycoside;pentaacetyl geniposide

Suppliers and Price of Pentaacetyl geniposide

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 0 raw suppliers

Chemical Property of Pentaacetyl geniposide

Chemical Property:

Vapor Pressure:2.84E-16mmHg at 25°C
Boiling Point:640°Cat760mmHg
Flash Point:267.5°C
PSA：185.49000
Density:1.35g/cm³
LogP:0.62490
XLogP3:0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:16
Exact Mass:598.18977037
Heavy Atom Count:42
Complexity:1140

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)OCC1C(C(C(C(O1)OC2C3C(CC=C3COC(=O)C)C(=CO2)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C
Isomeric SMILES:CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@H]2[C@H]3[C@H](CC=C3COC(=O)C)C(=CO2)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C

Technology Process of Pentaacetyl geniposide

There total 7 articles about Pentaacetyl geniposide 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:

: 54621-23-7
10-dehydrogeniposide tetraacetate

: 49776-64-9
geniposide penta-acetate

Guidance literature:: Multi-step reaction with 2 steps

1: 45 mg / NaBH₄ / methanol / 0.25 h / 0 °C

2: 51 mg / pyridine

With sodium tetrahydroborate; In pyridine; methanol;
DOI:10.1248/cpb.30.3942

Reference yield:

: 73528-65-1
ixoside monomethyl ester tetraacetate

: 49776-64-9
geniposide penta-acetate

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) ClCOOEt, Et₃N; 2.) NaBH₄, H₂O / 1.) THF, -20 deg C, 2 h; 2.) THF, -20 deg C, 30 min

2: 51 mg / pyridine

With sodium tetrahydroborate; water; chloroformic acid ethyl ester; triethylamine; In pyridine;
DOI:10.1248/cpb.30.3942