Thalsimine

Base Information

Chemical Name:Thalsimine
CAS No.:5525-36-0
Molecular Formula:C38H40N2O7
Molecular Weight:636.7334
Hs Code.:
NSC Number:626651
DSSTox Substance ID:DTXSID70970584
Nikkaji Number:J2.771.075A
Wikidata:Q27108422
Metabolomics Workbench ID:68477
Mol file:5525-36-0.mol

Synonyms:Thalsimine;Thalcimine;NSC626651;5525-36-0;AC1L7KX8;AC1Q58EX;5,6,6',7,12-Pentamethoxy-2-methyl-1',2'-didehydroberbaman;CHEBI:9515;DTXSID70970584;NSC-626651;C09661;Q27108422;(14S)-9,19,20,21,25-pentamethoxy-15-methyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-1(30),3(36),4,6(35),8,10,12(34),18(33),19,21,24,26,31-tridecaene

Suppliers and Price of Thalsimine

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

American Custom Chemicals Corporation
THALSIMIDINE ME ETHER 95.00%
5MG
$ 496.35

Total 3 raw suppliers

Chemical Property of Thalsimine

Chemical Property:

Melting Point:140-2°C
Boiling Point:750.9°Cat760mmHg
Flash Point:407.9°C
PSA：0.00000
Density:1.27g/cm³
LogP:5.92320
XLogP3:5.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:636.28355162
Heavy Atom Count:47
Complexity:1050

Purity/Quality:: THALSIMIDINE ME ETHER 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCC2=C3C1CC4=CC(=C(C=C4)OC)OC5=CC=C(CC6=NCCC7=CC(=C(C=C76)OC3=C(C(=C2OC)OC)OC)OC)C=C5
Isomeric SMILES:CN1CCC2=C3[C@@H]1CC4=CC(=C(C=C4)OC)OC5=CC=C(CC6=NCCC7=CC(=C(C=C76)OC3=C(C(=C2OC)OC)OC)OC)C=C5
Description A further bisbenzylisoquinoline alkaloid from the above ground parts of Thalictrum simplex, this base is separated from the accompanying thalsimidine by thin layer chromatography. It is also dextrorotatory having [o:ll,0 + 27.45° (c 6.72, CHCI 3 ). The crystalline hydrochloride decomposes at 233-5°C and thepicrate, light yellow needles, also decomposes before melting, at 209-21 1°C. The original structure has subsequently been revised to that given above.

Technology Process of Thalsimine

There total 1 articles about Thalsimine 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: