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131929-68-5
Catalog No.:AA009X76

131929-68-5 | Spinosyn A 17-pseudoaglycone

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Purity
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Quantity
  
1mg
≥95%
in stock  
$549.00   $384.00
- +
5mg
≥95%
in stock  
$1,640.00   $1,148.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA009X76
Chemical Name:
Spinosyn A 17-pseudoaglycone
CAS Number:
131929-68-5
Molecular Formula:
C33H50O9
Molecular Weight:
590.7447
SMILES:
CO[C@H]1[C@H](O[C@@H]2C[C@@H]3[C@@H](C2)[C@@H]2C=C4[C@H]([C@@H]2C=C3)CC(=O)O[C@@H](CC)CCC[C@@H]([C@H](C4=O)C)O)O[C@H]([C@@H]([C@H]1OC)OC)C
Properties
Computed Properties
 
Complexity:
1030  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
14  
Heavy Atom Count:
42  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
XLogP3:
3.4  

Literature

Title: Enzyme-catalysed [4+2] cycloaddition is a key step in the biosynthesis of spinosyn A.

Journal: Nature 20110505

Title: Biosynthesis of spinosyn in Saccharopolyspora spinosa: synthesis of permethylated rhamnose and characterization of the functions of SpnH, SpnI, and SpnK.

Journal: Journal of the American Chemical Society 20100310

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SDS
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Tags:131929-68-5 Molecular Formula|131929-68-5 MDL|131929-68-5 SMILES|131929-68-5 Spinosyn A 17-pseudoaglycone