Virosecurinin

Base Information

Chemical Name:Virosecurinin
CAS No.:6704-68-3
Molecular Formula:C₁₃H₁₅NO₂
Molecular Weight:217.268
Hs Code.:
UNII:D05X6H4208
DSSTox Substance ID:DTXSID901316136
Nikkaji Number:J16.311B
Wikidata:Q104399057
Metabolomics Workbench ID:123552
ChEMBL ID:CHEMBL1495075
Mol file:6704-68-3.mol

Synonyms:viro-securinine;viroallosecurinine;virosecurinine

Suppliers and Price of Virosecurinin

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
VIROSECURININE 95.00%
5MG
$ 497.23

Total 3 raw suppliers

Chemical Property of Virosecurinin

Chemical Property:

Vapor Pressure:1.32E-08mmHg at 25°C
Boiling Point:459°C at 760 mmHg
Flash Point:197°C
PSA：29.54000
Density:1.3g/cm³
LogP:1.34290
XLogP3:1.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:0
Exact Mass:217.110278721
Heavy Atom Count:16
Complexity:426

Purity/Quality:

99% ^*data from raw suppliers

VIROSECURININE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCN2C(C1)C34CC2C=CC3=CC(=O)O4
Isomeric SMILES:C1CCN2[C@@H](C1)[C@@]34C[C@@H]2C=CC3=CC(=O)O4
Description Obtained from Securinega virosa Pax et Hoffm., this tetracyclic alkaloid forms light yellow crystals from EtOH and is strongly dextrorotatory with[α]D + 1148° (c 0.4, CHCL3). The salts are well crystalline and include the hydrochloride, m.p. 211-3°C; [α]D + 388° (c 0.3, EtOH); nitrate, m.p. 211-3°C (dec.); [α]D + 330° (c 0.3, EtOH) and the methiodide, m.p. 239-241°C (dec).

Technology Process of Virosecurinin

There total 30 articles about Virosecurinin 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: 87.0%

: 651738-07-7
1(S)-[1'-tert-butoxycarbonyl-2'(R)-piperidinyl]-3-bromo-9-oxa-8-oxobicyclo[4.3.0]nona-4,6-diene

: 884-68-4,1857-30-3,5588-52-3,5610-40-2,6704-68-3
(-)-securinine

Guidance literature:: 1(S)-[1'-tert-butoxycarbonyl-2'(R)-piperidinyl]-3-bromo-9-oxa-8-oxobicyclo[4.3.0]nona-4,6-diene; With trifluoroacetic acid; at 20 ℃; for 0.25h;

With potassium carbonate; In tetrahydrofuran; at 20 ℃; for 12h;
DOI:10.1021/ol0361251

Reference yield: 87.0%

: (+)-(5S,10aS,10bR,12S)-virosine B

: 6704-68-3
virosecurinine

Guidance literature:: With di-isopropyl azodicarboxylate; triphenylphosphine; In tetrahydrofuran; at 0 - 20 ℃; for 1h; Inert atmosphere;
DOI:10.1002/chem.201903122

Reference yield: 82.0%

: 1126784-60-8
(1'S,3'S,8a'R)-3'-((Z)-2-iodovinyl)-3',5',6',7',8',8a'-hexahydro-2'H,5H-spiro[furan-2,1'-indolizin]-5-one

: 884-68-4,1857-30-3,5588-52-3,5610-40-2,6704-68-3
(-)-securinine

Guidance literature:: With trans-di(μ-acetato)bis[o-(di-o-tolylphosphino)benzyl]dipalladium(II); tetrabutylammomium bromide; sodium acetate; In N,N-dimethyl acetamide; at 100 ℃; for 12h;
DOI:10.1039/b816576a