Rodiasine

Base Information

Chemical Name:Rodiasine
CAS No.:6391-64-6
Molecular Formula:C₃₈H₄₂N₂O₆
Molecular Weight:622.761
Hs Code.:
DSSTox Substance ID:DTXSID20331803
Nikkaji Number:J37.157B
Wikipedia:Rodiasine
Wikidata:Q7356764
Metabolomics Workbench ID:53412
ChEMBL ID:CHEMBL1170881
Mol file:6391-64-6.mol

Synonyms:Rodiasine;6391-64-6;CHEBI:8886;(1R,14S)-9,20,21,25-tetramethoxy-15,30-dimethyl-23-oxa-15,30-diazaheptacyclo[22.6.2.13,7.18,12.114,18.027,31.022,33]pentatriaconta-3(35),4,6,8,10,12(34),18,20,22(33),24,26,31-dodecaen-6-ol;1S,1'R-Rodiasine;C09624;CHEMBL1170881;DTXSID20331803;Q7356764

Suppliers and Price of Rodiasine

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 3 raw suppliers

Chemical Property of Rodiasine

Chemical Property:

Vapor Pressure:5.6E-23mmHg at 25°C
Melting Point:195 °C(Solv: ethanol (64-17-5))
Boiling Point:745.4°Cat760mmHg
PKA:9.86±0.20(Predicted)
Flash Point:404.6°C
PSA：72.86000
Density:1.195g/cm³
LogP:6.61850
XLogP3:6.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:622.30428706
Heavy Atom Count:46
Complexity:1000

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCC2=CC(=C3C=C2C1CC4=CC(=C(C=C4)O)C5=C(C=CC(=C5)CC6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)OC)OC
Isomeric SMILES:CN1CCC2=CC(=C3C=C2[C@H]1CC4=CC(=C(C=C4)O)C5=C(C=CC(=C5)C[C@H]6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)OC)OC
Description This bisbenzylisoquinoline alkaloid from Ocotea rodiaei was originally considered to have the formulae C36H4006N2 or C36H4406N2. When crystallized from EtOH it yields cubic crystals but from MeOH it forms slender needles. It has [α]18D + 134° (c 0.63, CHCI3) or + 157° (c 1.0, CHCI3). The ultraviolet spectrum in EtOH has absorption maxima at 233 and 285 ITlJ.1 with a shoulder at 292 mJ.1. The monohydrochloride forms cubic crystals from EtOH, m.p. 255-9°C (dec.); [α]D + 74° (c 1.0, H20); the dimethiodide, m.p. 321°C (dec.); [α]20D+ 68° (c 0.147, H20); the dimethochloride, m.p. 286°C (dec.); [α]D + 81.5° (c 0.98, H20) and the dimethopicrate, existing in two crystal forms, m.p. 180°C and 253°C respectively. Four methoxyl groups and one phenolic hydroxyl group are present, the alkaloid furnishing the O-methyl derivative, m.p. 172-3°C; [α]D + 85° (c 0.57, CHCI 3) which also yields crystalline salts, e.g. the hydrochloride, m.p. 232-6°C (dec.) and the dimethiodide, m.p. 294-8°C (dec.); [α]D + 47° (H20).

Technology Process of Rodiasine

There total 1 articles about Rodiasine 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: