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Home  > Inhibitors/Agonists  > Anti-infection  > Antibacterial  > (4R,5S,6S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid trihydrate

AA24247

119478-56-7 | (4R,5S,6S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid trihydrate

Packsize Purity Availability Price Discounted Price    Quantity
1mg 95% in stock $11.00 $8.00 -   +
50mg 95% in stock $13.00 $9.00 -   +
100mg 95% in stock $16.00 $11.00 -   +
250mg 95% in stock $19.00 $14.00 -   +
1g 95% in stock $39.00 $27.00 -   +
5g 95% in stock $90.00 $63.00 -   +
10g 95% in stock $171.00 $120.00 -   +
25g 95% in stock $202.00 $141.00 -   +

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*All prices are in USD.

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Description
Catalog Number: AA24247
Chemical Name: (4R,5S,6S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid trihydrate
CAS Number: 119478-56-7
Molecular Formula: C17H31N3O8S
Molecular Weight: 437.5083
MDL Number: MFCD27953031
SMILES: C[C@H]([C@H]1C(=O)N2[C@@H]1[C@@H](C)C(=C2C(=O)O)S[C@@H]1CN[C@@H](C1)C(=O)N(C)C)O.O.O.O

 

Computed Properties
Complexity: 679  
Covalently-Bonded Unit Count: 4  
Defined Atom Stereocenter Count: 6  
Heavy Atom Count: 29  
Hydrogen Bond Acceptor Count: 10  
Hydrogen Bond Donor Count: 6  
Rotatable Bond Count: 5  

 

 

Upstream Synthesis Route 
  • (4R,5S,6S)-3-[[(3S,5S)-5-(Dimethylcarbamoyl)pyrrolidin-3-yl]thio]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid trihydrate can be used as a key reagent in chemical synthesis processes. This compound's unique structure and functional groups make it valuable in various synthetic pathways, particularly in the production of complex organic molecules. Its specific stereochemistry and reactive moieties enable it to serve as a versatile building block for creating novel compounds with potential pharmaceutical, agrichemical, or material science applications. By incorporating this trihydrate compound into synthetic routes, chemists can efficiently access diverse chemical space and facilitate the development of innovative molecular structures for targeted applications.
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