ChemicalBook--->CAS DataBase List--->1350636-82-6

1350636-82-6

1350636-82-6 Structure

1350636-82-6 Structure
IdentificationBack Directory
[Name]

WSMXIQXWHPSVDE-WHAUHWDVSA-N
[CAS]

1350636-82-6
[Synonyms]

BC-3781 ACETATE
Lefamulin acetate
BC-3781;BC 3781;BC3781
WSMXIQXWHPSVDE-WHAUHWDVSA-N
Lefamulin acetate (BC-3781 acetate)
WSMXIQXWHPSVDE-WHAUHWDVSA-N USP/EP/BP
[EINECS(EC#)]

208-388-5
[Molecular Formula]

C30H49NO7S
[MDL Number]

MFCD28963990
[MOL File]

1350636-82-6.mol
[Molecular Weight]

567.78
Chemical PropertiesBack Directory
[storage temp. ]

Store at -20°C
[solubility ]

DMSO:100.0(Max Conc. mg/mL);176.12(Max Conc. mM)
[form ]

Solid
[color ]

White to off-white
[InChIKey]

WSMXIQXWHPSVDE-IHBHSJRLNA-N
[SMILES]

C(=O)(O)C.C[C@H]1[C@@H]([C@](C[C@@H](OC(=O)CS[C@@H]2CC[C@@H](N)C[C@H]2O)C2([C@H](C)CCC31CCC(=O)[C@]32[H])C)(C)C=C)O |&1:5,6,7,9,15,18,21,24,33,r|
Safety DataBack Directory
[Symbol(GHS) ]


GHS07,GHS05,GHS06
[Signal word ]

Danger
[Hazard statements ]

H315-H318-H317-H302-H330
[Precautionary statements ]

P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501-P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501
Hazard InformationBack Directory
[Chemical Properties]

Lefamulin acetate is a white to off-white solid. It is a stable compound (requiring no special storage conditions) which is highly soluble in water and 0.9% sodium chloride solution (>300mg/ml). The hydration level of lefamulin acetate at ambient conditions is typically below 1% w/w.
[Uses]

Lefamulin (BC-3781) acetate is an orally active antibiotic. Lefamulin acetate inhibits protein synthesis by binding to the peptidyl transferase center of the 50S bacterial ribosome. Lefamulin acetate has anti-inflammatory activity. Lefamulin acetate can be used in the research of bacterial infections, such as bacterial pneumonia.
[Definition]

Lefamulin acetate is a single stereoisomer semi-synthetically derived from pleuromutilin, a homochiral, natural fermentation product of known absolute stereochemistry. Lefamulin acetate is a diastereomer with R-configuration at carbons of the cyclohexane moiety. The absolute configuration of the active substance has been confirmed by single-crystal structure determination.
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