Trospectomycin

Base Information

Chemical Name:Trospectomycin
CAS No.:88669-04-9
Molecular Formula:C₁₇H₃₀N₂O₇
Molecular Weight:374.434
Hs Code.:
UNII:5S94MC2FRG
DSSTox Substance ID:DTXSID20869010
Nikkaji Number:J33.160K
Wikidata:Q27262806
NCI Thesaurus Code:C152769
Metabolomics Workbench ID:144474
ChEMBL ID:CHEMBL1614655
Mol file:88669-04-9.mol

Synonyms:trospectomycin;trospectomycin sulfate;trospectomycin sulphate;U 63366;U 63366f;U-63366

Suppliers and Price of Trospectomycin

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
TROSPECTOMYCIN 95.00%
5MG
$ 495.58

Total 3 raw suppliers

Chemical Property of Trospectomycin

Chemical Property:

Vapor Pressure:7.31E-17mmHg at 25°C
Boiling Point:599.3°C at 760 mmHg
Flash Point:316.3°C
PSA：129.51000
Density:1.33g/cm³
LogP:-0.97350
XLogP3:-1.7
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:374.20530130
Heavy Atom Count:26
Complexity:521

Purity/Quality:

99% ^*data from raw suppliers

TROSPECTOMYCIN 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC1CC(=O)C2(C(O1)OC3C(C(C(C(C3O2)NC)O)NC)O)O
Isomeric SMILES:CCCC[C@@H]1CC(=O)[C@]2([C@@H](O1)O[C@@H]3[C@H]([C@@H]([C@@H]([C@@H]([C@H]3O2)NC)O)NC)O)O
Uses Antibacterial.

Technology Process of Trospectomycin

There total 9 articles about Trospectomycin 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: 59.0%

: 103198-47-6
[(4aR,5S,6S,7R,8S,8aR,9aR,10aR)-5-(Benzyloxycarbonyl-methyl-amino)-2-((E)-but-1-enyl)-4a,6,8-trihydroxy-4-oxo-4a,5,6,7,8,8a,9a,10a-octahydro-4H-1,9,10-trioxa-anthracen-7-yl]-methyl-carbamic acid benzyl ester

: 88669-04-9
Trospectomycin

Guidance literature:: With pyridine; hydrogen; Pd-BaSO₄; In isopropyl alcohol; for 2.3h; under 760 Torr;
DOI:10.1016/S0040-4039(00)99493-0

Reference yield:

: 88625-83-6
Formic acid (2R,4aR,5S,6R,7R,8S,8aS,9aS,10aR)-5,7-bis-(benzyloxycarbonyl-methyl-amino)-6-formyloxy-4a-hydroxy-2-methyl-4-oxo-decahydro-1,9,10-trioxa-anthracen-8-yl ester

: 88669-04-9
Trospectomycin

Guidance literature:: Multi-step reaction with 7 steps

1: 77 percent / pyridine, dimethylaminopyridine / ethyl acetate / 10 h / 55 °C

2: 1,3-dibromo-5,5-dimethyl hydantoin / CCl₄ / 0.33 h / Ambient temperature; Irradiation

3: dimethylformamide / 8 h / 55 °C

4: hexamethyldisilazane / 2.5 h / 55 °C

5: 0 - 25 °C

6: 48percent aqueous HF / acetonitrile / 5 h / 0 °C

7: 59 percent / H₂, pyridine / Pd/BaSO₄ / propan-2-ol / 2.3 h / 760 Torr

With pyridine; dmap; 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione; hydrogen fluoride; hydrogen; 1,1,1,3,3,3-hexamethyl-disilazane; Pd-BaSO₄; In tetrachloromethane; ethyl acetate; N,N-dimethyl-formamide; isopropyl alcohol; acetonitrile;
DOI:10.1016/S0040-4039(00)99493-0

Reference yield:

: [(4aR,5R,6S,7S,8S,8aR,9aR,10aR)-5-(Benzyloxycarbonyl-methyl-amino)-2-((E)-but-1-enyl)-4a,8-dihydroxy-4-oxo-6-trimethylsilanyloxy-4a,5,6,7,8,8a,9a,10a-octahydro-4H-1,9,10-trioxa-anthracen-7-yl]-methyl-carbamic acid benzyl ester

: 88669-04-9
Trospectomycin

Guidance literature:: Multi-step reaction with 2 steps

1: 48percent aqueous HF / acetonitrile / 5 h / 0 °C

2: 59 percent / H₂, pyridine / Pd/BaSO₄ / propan-2-ol / 2.3 h / 760 Torr

With pyridine; hydrogen fluoride; hydrogen; Pd-BaSO₄; In isopropyl alcohol; acetonitrile;
DOI:10.1016/S0040-4039(00)99493-0