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AB47858

104987-12-4 | Ascomycin

Packsize Purity Availability Price Discounted Price    Quantity
10mg 90% in stock $50.00 $35.00 -   +
100mg 90% in stock $73.00 $51.00 -   +
250mg 90% in stock $88.00 $62.00 -   +
1g 90% in stock $219.00 $153.00 -   +
5g 90% in stock $655.00 $459.00 -   +
10g 90% in stock $1,131.00 $792.00 -   +
25g 90% in stock $2,002.00 $1,402.00 -   +

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*All prices are in USD.

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Description
Catalog Number: AB47858
Chemical Name: Ascomycin
CAS Number: 104987-12-4
Molecular Formula: C43H69NO12
Molecular Weight: 792.0075
MDL Number: MFCD06198665
SMILES: CC[C@@H]1C=C(C)C[C@H](C)C[C@H](OC)[C@H]2O[C@](O)([C@@H](C[C@@H]2OC)C)C(=O)C(=O)N2C[C@H](C(=O)O[C@@H]([C@@H]([C@H](CC1=O)O)C)/C(=C/[C@@H]1CC[C@H]([C@@H](C1)OC)O)/C)CCC2

 

Computed Properties
Complexity: 1430  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 14  
Defined Bond Stereocenter Count: 2  
Heavy Atom Count: 56  
Hydrogen Bond Acceptor Count: 12  
Hydrogen Bond Donor Count: 3  
Rotatable Bond Count: 6  
XLogP3: 2.5  

 

 

Upstream Synthesis Route 
  • This compound, (3S,4R,5S,8R,9E,12S,14S,15R,16S,18R,19R,26aS)-8-Ethyl-5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-5,19-dihydroxy-3-[(1E)-2-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]-1-methylethenyl]-14,16-dimethoxy-4,10,12,18-tetramethyl-15,19-epoxy-3H-pyrido[2,1-c][1,4]oxaazacyclotricosine-1,7,20,21(4H,23H)-tetrone, plays a crucial role in chemical synthesis. Specifically, it serves as a key intermediate in the production of various pharmaceutical compounds and bioactive molecules. Its unique structure and functional groups make it a versatile building block for creating complex organic molecules in a controlled and efficient manner. By incorporating this compound into chemical reactions, chemists can access new synthetic pathways and develop innovative strategies for designing novel compounds with potential therapeutic applications.
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