Ouabain

Base Information Edit

Chemical Name:Ouabain
CAS No.:630-60-4
Deprecated CAS:36-06-6
Molecular Formula:C29H44O12
Molecular Weight:584.661
Hs Code.:
European Community (EC) Number:211-139-3
UN Number:1544,1851
UNII:5ACL011P69
DSSTox Substance ID:DTXSID0043765
Nikkaji Number:J6.892F
Wikipedia:Ouabain
Wikidata:Q285911
Pharos Ligand ID:YAYQ3SCXGTYP
Metabolomics Workbench ID:43324
ChEMBL ID:CHEMBL222863
Mol file:630-60-4.mol

Synonyms:Acocantherin;Acolongifloroside K;G Strophanthin;G-Strophanthin;Ouabain

Suppliers and Price of Ouabain

Supply Marketing:Edit

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

Usbiological
Ouabain
100mg
$ 425.00

Usbiological
Ouabain
100mg
$ 310.00

TRC
Ouabain
50mg
$ 130.00

TRC
Ouabain
1mg
$ 45.00

Tocris
Ouabain ≥95%(HPLC)
100
$ 85.00

Sigma-Aldrich
Ouabain Pharmaceutical Secondary Standard; Certified Reference Material
300 mg
$ 129.00

Sigma-Aldrich
Ouabain European Pharmacopoeia (EP) Reference Standard
$ 190.00

Biosynth Carbosynth
Ouabain - anhydrous
2 g
$ 1100.00

Biosynth Carbosynth
Ouabain - anhydrous
1 g
$ 600.00

Biosynth Carbosynth
Ouabain - anhydrous
500 mg
$ 375.00

Total 24 raw suppliers

Chemical Property of Ouabain Edit

Chemical Property:

Appearance/Colour:Odorless, white crystals or crystalline powder as an octahydrate
Vapor Pressure:7.63E-08mmHg at 25°C
Melting Point:200°C
Refractive Index:-32 ° (C=1, H2O)
Boiling Point:838.219 °C at 760 mmHg
PKA:13.04±0.70(Predicted)
Flash Point:272.893 °C
PSA：206.60000
Density:1.52 g/cm³
LogP:-1.51500
Storage Temp.:Desiccate at -20°C
Solubility.:H2O: 10 mg/mL cold
Water Solubility.:13g/L(25 oC)
XLogP3:-1.7
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:4
Exact Mass:584.28327683
Heavy Atom Count:41
Complexity:1080
Transport DOT Label:Poison

Purity/Quality:

98% ^*data from raw suppliers

Ouabain ^*data from reagent suppliers

Safty Information:

Pictogram(s): T
Hazard Codes:T
Statements: 23/25-33
Safety Statements: 45

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1C(C(C(C(O1)OC2CC(C3(C4C(CCC3(C2)O)C5(CCC(C5(CC4O)C)C6=CC(=O)OC6)O)CO)O)O)O)O
Isomeric SMILES:C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2C[C@H]([C@@]3([C@@H]4[C@@H](CC[C@@]3(C2)O)[C@]5(CC[C@@H]([C@]5(C[C@H]4O)C)C6=CC(=O)OC6)O)CO)O)O)O)O
Description One of several cardiac glycosides that have been used clinically as cardiotonic agents and diuretics. Ouabain is obtained from the seeds of Strophanthus gratus, Acokanthera ouabaio, and related species. It was formerly prescribed under the name strophanthuis as the purified seed extract.

Technology Process of Ouabain

There total 1 articles about Ouabain 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: 88.0%