Metildigoxin

Base Information

Chemical Name:Metildigoxin
CAS No.:30685-43-9
Deprecated CAS:25896-11-1
Molecular Formula:C42H66 O14
Molecular Weight:794.978
Hs Code.:
European Community (EC) Number:250-292-0
UNII:I7GG1YUC5V
DSSTox Substance ID:DTXSID0023294
Nikkaji Number:J4.091F
Wikipedia:Metildigoxin
Wikidata:Q550017
NCI Thesaurus Code:C170170
Metabolomics Workbench ID:144291
ChEMBL ID:CHEMBL1697843
Mol file:30685-43-9.mol

Synonyms:4''' O Methyldigoxin;4'''-O-Methyldigoxin;Bemecor;beta Methyldigoxin;beta-Methyldigoxin;Lanirapid;Lanitop;Medigoxin;Medixin;Methyldigoxin;Metildigoxin

Suppliers and Price of Metildigoxin

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

TRC
β-MethylDigoxin
25mg
$ 855.00

Total 1 raw suppliers

Chemical Property of Metildigoxin

Chemical Property:

Melting Point:200-202°C (dec.)
Refractive Index:1.6130 (estimate)
Boiling Point:914.1°Cat760mmHg
PKA:13.50±0.70(Predicted)
Flash Point:270.5°C
PSA：192.06000
Density:1.33g/cm³
LogP:2.87220
Storage Temp.:Hygroscopic, Refrigerator, Under Inert Atmosphere
XLogP3:1.8
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:8
Exact Mass:794.44525677
Heavy Atom Count:56
Complexity:1460

Purity/Quality:: β-MethylDigoxin ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3O)OC4CCC5(C(C4)CCC6C5CC(C7(C6(CCC7C8=CC(=O)OC8)O)C)O)C)C)C)O)OC
Isomeric SMILES:C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5C[C@H]([C@]7([C@@]6(CC[C@@H]7C8=CC(=O)OC8)O)C)O)C)C)C)O)OC
Uses Cardiotonic. Obtained by the O-methylation of Digoxin.
Therapeutic Function Cardiotonic

Technology Process of Metildigoxin

There total 1 articles about Metildigoxin 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: 74.63%

: 30685-43-9
methyldigoxin

Guidance literature:

Reference yield:

: 30685-43-9
methyldigoxin

: 528869-22-9
MDx₃ 12-hemisuccinate p-nitrophenyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 13.6 percent / dicyclohexylcarbodiimide / pyridine / 73 h / 60 °C

2: 48.1 percent / dicyclohexylcarbodiimide / dioxane / 7 h / 20 °C

With dicyclohexyl-carbodiimide; In 1,4-dioxane; pyridine;
DOI:10.1248/bpb.25.1251