Thiobinupharidine

Base Information

Chemical Name:Thiobinupharidine
CAS No.:30343-72-7
Molecular Formula:C₃₀H₄₂N₂O₂S
Molecular Weight:494.742
Hs Code.:
DSSTox Substance ID:DTXSID50331876
Nikkaji Number:J34.260B
Wikidata:Q27108434
ChEMBL ID:CHEMBL423545
Mol file:30343-72-7.mol

Synonyms:Thiobinupharidine;30343-72-7;CHEBI:9548;Neothiobinupharidine, (7S,13S)-;Thionuphlutine A;C09990;CHEMBL423545;SCHEMBL3129706;DTXSID50331876;Q27108434

Suppliers and Price of Thiobinupharidine

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 0 raw suppliers

Chemical Property of Thiobinupharidine

Chemical Property:

Boiling Point:601.1°Cat760mmHg
Flash Point:317.4°C
PSA：58.06000
Density:1.2g/cm³
LogP:7.18150
XLogP3:5.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:494.29669976
Heavy Atom Count:35
Complexity:782

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CCC(N2C1CCC3(C2)CC4(CCC5C(CCC(N5C4)C6=COC=C6)C)SC3)C7=COC=C7
Isomeric SMILES:C[C@@H]1CC[C@H](N2[C@H]1CC[C@@]3(C2)C[C@]4(CC[C@H]5[C@@H](CC[C@H](N5C4)C6=COC=C6)C)SC3)C7=COC=C7
Description A second sulphur-containing alkaloid present in the rhizomes of Nuphar luteum (L.) Sm. The alkaloid yields prismatic needles which melt at 129-130°C. The perchlorate has m.p. 282-4°C; [α]D + 49.8° (H20) and gives an ultraviolet spectrum consisting of a single absorption maximum at 298 rnp..

Technology Process of Thiobinupharidine

There total 41 articles about Thiobinupharidine 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: 61.0%

: (+)-6,6'-dihydroxythiobinupharidine

: 30343-72-7
thiobinupharidine

: (+)-6-hydroxythiobinupharidine

Guidance literature:: With sodium tetrahydroborate; In methanol; at -20 - -5 ℃; for 4h; chemoselective reaction;
DOI:10.1002/anie.201503934

Reference yield: 38.0%

: piperidine

: 30343-72-7
thiobinupharidine

: (+)-6-hydroxythiobinupharidine

Guidance literature:: With diisobutylaluminium hydride; In hexane; dichloromethane; at -89 ℃; for 1h; Overall yield = 44 %; Inert atmosphere;
DOI:10.1021/jacs.7b07685

Reference yield: 23.8%

: 1418134-80-1
C₁₅H₂₀NO⁽¹⁺⁾*C₂F₃O₂^(1-)

: 67314-63-0
(-)-neothiobinupharidine

: 30343-74-9
thionuphlutine B

: 30343-72-7
thiobinupharidine

: 4850-09-3
(-)-neothiobinupharidine

Guidance literature:: C₁₅H₂₀NO⁽¹⁺⁾*C₂F₃O₂^(1-); With disodium tetrasulfide; In dimethyl sulfoxide; for 6h; Inert atmosphere;

With sodium tetrahydroborate; In methanol; for 0.5h; Solvent; Concentration; Inert atmosphere;
DOI:10.1021/ja310778t