ChemicalBook--->CAS DataBase List--->22431-45-4

22431-45-4

22431-45-4 Structure

22431-45-4 Structure
IdentificationBack Directory
[Name]

Methyl 7-chloro-6,7,8-trideoxy-6-[[[(2S,4R)-4β-propyl-2α-pyrrolidinyl]carbonyl]amino]-1-thio-L-threo-α-D-galacto-octopyranoside
[CAS]

22431-45-4
[Synonyms]

U-26727A
N-Demethylclindamycin
1'-Demethylclindamycin
N-Desmethyl Clindamycin
Clindamycin Impurity 33
Clindamycin Impurity 5 (N-Demethylclindamycin)
Methyl 7-chloro-6,7,8-trideoxy-6-[[[(2S,4R)-4β-propyl-2α-pyrrolidinyl]carbonyl]amino]-1-thio-L-threo-α-D-galacto-octopyranoside
[Molecular Formula]

C17H31ClN2O5S
[MOL File]

22431-45-4.mol
[Molecular Weight]

410.95
Chemical PropertiesBack Directory
[Melting point ]

>131°C (dec.)
[Boiling point ]

642.0±55.0 °C(Predicted)
[density ]

1.31±0.1 g/cm3(Predicted)
[storage temp. ]

Amber Vial, Hygroscopic, -20°C Freezer, Under inert atmosphere
[solubility ]

Aqueous Acid (Slightly, Heated), Methanol (Slightly), Water (Slightly, Heated)
[form ]

Solid
[pka]

12.87±0.70(Predicted)
[color ]

White to Pale Yellow
[Stability:]

Hygroscopic, Light Sensitive
[InChIKey]

HDBHHHCDEYATPY-AXFSLLSYNA-N
[SMILES]

[C@]([H])([C@@]1([H])O[C@H](SC)[C@H](O)[C@@H](O)[C@H]1O)([C@@H](Cl)C)NC([C@H]1NC[C@H](CCC)C1)=O |&1:0,2,5,8,10,12,14,19,22,r|
Hazard InformationBack Directory
[Uses]

N-Demethylclindamycin is an impurity of Clindamycin ( Hydrochloride salt) which is a semi-synthetic antibiotic prepared from Lincomycin.;Impurity in commercial preparations of Clindamycin
[Uses]

N-Demethylclindamycin is an impurity of Clindamycin (C580000, HCl salt) which is a semi-synthetic antibiotic prepared from Lincomycin.
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