Calotropin

Base Information

Chemical Name:Calotropin
CAS No.:1986-70-5
Molecular Formula:C₂₉H₄₀O₉
Molecular Weight:532.631
Hs Code.:
UNII:3XK21U1BZS
DSSTox Substance ID:DTXSID10173613
Nikkaji Number:J7.843C
Wikipedia:Calotropin
Wikidata:Q27106025
Pharos Ligand ID:MMWQH15P8HKA
ChEMBL ID:CHEMBL495949
Mol file:1986-70-5.mol

Synonyms:calotropin;Pecilocerin A;Pekilocerin A

Suppliers and Price of Calotropin

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 20 raw suppliers

Chemical Property of Calotropin

Chemical Property:

Vapor Pressure:7.8E-25mmHg at 25°C
Melting Point:223° (dec)
Boiling Point:733.5°Cat760mmHg
Flash Point:241.5°C
PSA：131.75000
Density:1.403g/cm³
LogP:2.00070
XLogP3:0.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:2
Exact Mass:532.26723285
Heavy Atom Count:38
Complexity:1060

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Chemical Classes:Biological Agents -> Plant Toxins
Canonical SMILES:CC1CC(C2(C(O1)OC3CC4CCC5C(C4(CC3O2)C=O)CCC6(C5(CCC6C7=CC(=O)OC7)O)C)O)O
Isomeric SMILES:C[C@@H]1C[C@@H]([C@]2([C@@H](O1)O[C@@H]3C[C@@H]4CC[C@@H]5[C@@H]([C@]4(C[C@H]3O2)C=O)CC[C@]6([C@@]5(CC[C@@H]6C7=CC(=O)OC7)O)C)O)O

Technology Process of Calotropin

There total 1 articles about Calotropin 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: