9-Dihydroclarithromycin

Base Information

Chemical Name:9-Dihydroclarithromycin
CAS No.:131791-18-9
Molecular Formula:C₃₈H₇₁NO₁₃
Molecular Weight:749.981
Hs Code.:
DSSTox Substance ID:DTXSID40157209
Nikkaji Number:J1.114.515I
Wikidata:Q83025362
Mol file:131791-18-9.mol

Synonyms:9-dihydroclarithromycin

Suppliers and Price of 9-Dihydroclarithromycin

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 9-Dihydroclarithromycin

Chemical Property:

Vapor Pressure:4.2E-30mmHg at 25°C
Boiling Point:806.5°Cat760mmHg
Flash Point:441.6°C
PSA：186.07000
Density:1.18g/cm³
LogP:2.23150
XLogP3:3.3
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:8
Exact Mass:749.49254132
Heavy Atom Count:52
Complexity:1150

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC1C(C(C(C(C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)OC)C)O)C)O)(C)O
Isomeric SMILES:CC[C@@H]1[C@@]([C@@H]([C@H]([C@H]([C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)OC)C)O)C)O)(C)O

Technology Process of 9-Dihydroclarithromycin

There total 2 articles about 9-Dihydroclarithromycin 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: 52.0%

: 81103-11-9
clarithromycin

: 131791-18-9
9(S)-hydroxy-6-O-methylerythromycin A

Guidance literature:: With sodium tetrahydroborate; In tetrahydrofuran; methanol; at 0 - 20 ℃; for 25h; Inert atmosphere;
DOI:10.1016/j.ejmech.2019.07.022

Reference yield: 50.0%

: 131791-18-9
9(S)-hydroxy-6-O-methylerythromycin A

Guidance literature:

Reference yield:

: 131791-18-9
9(S)-hydroxy-6-O-methylerythromycin A

: 12(S)-{[1-(4-(p-methylphenyl)-1H-1,2,3-triazol-1-yl)]methyl-1-yl}-9(S)-hydroxyclarithromycin

Guidance literature:: Multi-step reaction with 7 steps

1.1: 1H-imidazole / N,N-dimethyl-formamide / 18 h / 0 - 20 °C / Inert atmosphere

2.1: lead(IV) tetraacetate / chloroform / 0.5 h / 0 °C / Inert atmosphere

3.1: sodium tris(acetoxy)borohydride / chloroform / 4 h / 0 - 20 °C / Inert atmosphere

4.1: sodium tris(acetoxy)borohydride / chloroform; water / 4 h / 20 °C / Inert atmosphere

5.1: lithium hydroxide; water / tetrahydrofuran; ethanol / 6 h / 20 °C

6.1: 2,4,6-trichlorobenzoyl chloride; triethylamine / tetrahydrofuran / 4 h / 20 °C / Inert atmosphere

6.2: 0.5 h / Inert atmosphere; Reflux

7.1: pyridine hydrogenfluoride / tetrahydrofuran / 18 h / 20 °C

With 1H-imidazole; 2,4,6-trichlorobenzoyl chloride; water; lead(IV) tetraacetate; sodium tris(acetoxy)borohydride; pyridine hydrogenfluoride; triethylamine; lithium hydroxide; In tetrahydrofuran; ethanol; chloroform; water; N,N-dimethyl-formamide;
DOI:10.1016/j.bioorg.2021.104992