Albireodelphin A

Base Information

Chemical Name:Albireodelphin A
CAS No.:190511-77-4
Molecular Formula:C₄₂H₄₇O₂₅
Molecular Weight:951.82
Hs Code.:
DSSTox Substance ID:DTXSID90172528
Wikidata:Q27149520
Mol file:190511-77-4.mol

Synonyms:3,3'-di-O-glucopyranosyl-5-O-(6-O-caffeoylglucopyranosyl)delphinidin;albireodelphin A

Suppliers and Price of Albireodelphin A

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 1 raw suppliers

Chemical Property of Albireodelphin A

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
PSA：418.50000
Density:g/cm³
LogP:-3.29070
Hydrogen Bond Donor Count:16
Hydrogen Bond Acceptor Count:24
Rotatable Bond Count:14
Exact Mass:951.24064198
Heavy Atom Count:67
Complexity:1610

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=CC(=CC4=[O+]C(=C(C=C34)OC5C(C(C(C(O5)CO)O)O)O)C6=CC(=C(C(=C6)OC7C(C(C(C(O7)CO)O)O)O)O)O)O)O)O)O)O)O
Isomeric SMILES:C1=CC(=C(C=C1/C=C/C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC(=CC4=[O+]C(=C(C=C34)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C6=CC(=C(C(=C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O)O)O)O)O)O)O

Technology Process of Albireodelphin A

There total 3 articles about Albireodelphin 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: 9.4%

: gentiodelphin trifluoroacetate

: bis-deacylgentiodelphin

: 190511-77-4
3,3'-di-O-β-D-glucopyranosyl-5-O-(6-O-caffeoyl-β-D-glucopyranosyl)delphinidin

: 3,5-di-O-β-D-glucopyranosyl-3'-O-(6-O-caffeoyl-β-D-glucopyranosyl)delphinidin

Guidance literature:: With sodium hydroxide; In methanol; at 0 ℃; for 0.5h;
DOI:10.1016/S0031-9422(00)00049-2

Reference yield:

: 1021913-49-4
caffeic acid coenzyme A thiol ester

: bis-deacylgentiodelphin

: 190511-77-4
3,3'-di-O-β-D-glucopyranosyl-5-O-(6-O-caffeoyl-β-D-glucopyranosyl)delphinidin

Guidance literature:: With recombinant aromatic Eg₅AT acyltransferase from Gentiana triflora Pall; In aq. buffer; at 30 ℃; for 0.5h; pH=8; Reagent/catalyst; Enzymatic reaction;
DOI:10.1016/j.phytochem.2021.112727

Reference yield:

: 1021913-49-4
caffeic acid coenzyme A thiol ester

: bis-deacylgentiodelphin

: gentiodelphin

: 190511-77-4
3,3'-di-O-β-D-glucopyranosyl-5-O-(6-O-caffeoyl-β-D-glucopyranosyl)delphinidin

Guidance literature:: With recombinant aromatic Gt5,3′ acyltransferase from Gentiana triflora Pall; In aq. buffer; at 30 ℃; for 0.5h; pH=8; Enzymatic reaction;
DOI:10.1016/j.phytochem.2021.112727