Spinosyn B

Base Information

Chemical Name:Spinosyn B
CAS No.:131929-61-8
Molecular Formula:C40H63 N O10
Molecular Weight:717.93
Hs Code.:
European Community (EC) Number:875-655-6
DSSTox Substance ID:DTXSID50904802
Nikkaji Number:J739.085H
Wikidata:Q27108324
Metabolomics Workbench ID:53445
Mol file:131929-61-8.mol

Synonyms:Spinosyn B;131929-61-8;(2R,3aS,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2R,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-2,3,4-tri-O-methyl-alpha-L-mannopyranoside;CHEBI:9231;SCHEMBL21871121;DTXSID50904802;A83543B;Q27108324;(1S,2R,5S,7R,9R,10S,14R,15S,19S)-19-ethyl-14-methyl-15-[(2R,5S,6R)-6-methyl-5-(methylamino)oxan-2-yl]oxy-7-[(2R,3R,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxy-20-oxatetracyclo[10.10.0.02,10.05,9]docosa-3,11-diene-13,21-dione;1H-as-Indaceno[3,2-d]oxacyclododecin-7,15-dione, 2-[(6-deoxy-2,3,4-tri-O-methyl-.alpha.-L-mannopyranosyl)oxy]-9-ethyl-2,3,3a,5a,5b,6,9,10,11,12,13,14,16a,16b-tetradecahydro-14-methyl-13-[[(2R,5S,6R)-tetrahydro-6-methyl-5-(methylamino)-2H-pyran-2-yl]oxy]-,

Suppliers and Price of Spinosyn B

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 Spinosyn B

Chemical Property:

Boiling Point:800.8±65.0 °C(Predicted)
PKA:9?+-.0.60(Predicted)
PSA：120.01000
Density:1.17±0.1 g/cm3(Predicted)
LogP:5.53610
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:9
Exact Mass:717.44519721
Heavy Atom Count:51
Complexity:1260

Purity/Quality:: 95%+ or 98%+ ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC1CCCC(C(C(=O)C2=CC3C4CC(CC4C=CC3C2CC(=O)O1)OC5C(C(C(C(O5)C)OC)OC)OC)C)OC6CCC(C(O6)C)NC
Isomeric SMILES:CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@H]3[C@@H]4C[C@@H](C[C@H]4C=C[C@H]3[C@@H]2CC(=O)O1)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)NC

Technology Process of Spinosyn B

There total 1 articles about Spinosyn B 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: 81.0%

: 131929-60-7
spinosyn A

: 131929-61-8
N-demethyl-spinosyn A

Guidance literature:: With iodine; sodium acetate; In methanol; water; for 12h; Reflux;
DOI:10.1016/j.bmcl.2020.127047

Reference yield:

: 131929-61-8
N-demethyl-spinosyn A

: C₆₁H₈₃NO₁₀P⁽¹⁺⁾*Br^(1-)

Guidance literature:: Multi-step reaction with 2 steps

1: potassium carbonate / acetonitrile / 24 h / Reflux

2: acetonitrile / 48 h / Reflux

With potassium carbonate; In acetonitrile;
DOI:10.1016/j.bmcl.2020.127047

Reference yield:

: 131929-61-8
N-demethyl-spinosyn A

: C₆₄H₈₉NO₁₀P⁽¹⁺⁾*Br^(1-)

Guidance literature:: Multi-step reaction with 2 steps

1: potassium carbonate / acetonitrile / 24 h / Reflux

2: acetonitrile / 48 h / Reflux

With potassium carbonate; In acetonitrile;
DOI:10.1016/j.bmcl.2020.127047

upstream raw materials:: spinosyn A

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Encyclopedia

Technology Process of Spinosyn B

Spinosyn B

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