Cantleyine

Base Information

Chemical Name:Cantleyine
CAS No.:30333-81-4
Molecular Formula:C₁₁H₁₃NO₃
Molecular Weight:207.229
Hs Code.:
DSSTox Substance ID:DTXSID50331856
Nikkaji Number:J442.110H
Wikidata:Q27106047
Metabolomics Workbench ID:69347
ChEMBL ID:CHEMBL4749645
Mol file:30333-81-4.mol

Synonyms:cantleyine

Suppliers and Price of Cantleyine

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 2 raw suppliers

Chemical Property of Cantleyine

Chemical Property:

Vapor Pressure:2.95E-05mmHg at 25°C
Boiling Point:342.1°C at 760 mmHg
Flash Point:160.7°C
PSA：59.42000
Density:1.243g/cm³
LogP:0.88870
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:207.08954328
Heavy Atom Count:15
Complexity:256

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1C(CC2=C(C=NC=C12)C(=O)OC)O
Isomeric SMILES:C[C@H]1[C@H](CC2=C(C=NC=C12)C(=O)OC)O
Description This alkaloid has been isolated by Russian workers from Dipsacus azureus Schrenk, who give it the empirical formula CllH13N0 3 and the structure shown above.

Technology Process of Cantleyine

There total 3 articles about Cantleyine 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:

: 67596-51-4
loganoside

: 23838-00-8,30333-81-4,143564-04-9
cantleyine

Guidance literature:: Multi-step reaction with 2 steps

1: 260 mg / H2O / 2 h / 37 °C / β-glucosidase, pH = 6

2: 1) NH₃; 2) HCl / 1) MeOH; 2) MeOH

With hydrogenchloride; ammonia; In water;
DOI:10.1002/hlca.19850680622

Reference yield:

: 29748-10-5
methyl-(1R,6S,7R)-1,6-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate

: 23838-00-8,30333-81-4,143564-04-9
cantleyine

: 60022-24-4
tetrahydrocantleyine

Guidance literature:: With hydrogenchloride; ammonia; Yield given. Multistep reaction. Yields of byproduct given; 1) MeOH; 2) MeOH;
DOI:10.1002/hlca.19850680622