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CS-W001157 4
Total: USD 88.00

4-Acetylsimvastatin

  • CAS No. 145576-25-6

  • Cat. No. CS-0112448
  • Molecule weight460.60
  • Purity≥98%
  • MDL No.MFCD09038912

*For research and further manufacturing use only, not for direct human use.

4-Acetylsimvastatin|CS-0112448

Structure of 145576-25-6

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General Information

  • CAS No. 145576-25-6
  • Cat. No. CS-0112448
  • Purity ≥98%
  • MDL No. MFCD09038912
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₇H₄₀O₆
  • Molecular Weight 460.60
  • Synonym(s) None
  • SMILES CCC(C)(C)C(O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](OC(C)=O)CC(O3)=O)[C@@]12[H])=O

Synthesis

  • Route1
    • null|null
      145576-24-5
    • 2,2-Dimethylbutanoic Anhydride|CS-0770536
      29138-64-5
    • ~97%
    • Anhydrosimvastatin|CS-0112446
      210980-68-0
    • null|null
      850920-00-2
    • In-stock
      Acetyllovastatin|CS-0100740
      81189-92-6
    • 4-Acetylsimvastatin|CS-0112448
      145576-25-6
    • null|null
      851402-85-2
    • null|null
      851402-84-1
    • In-stock
      Simvastatin|CS-2269
      79902-63-9

    References

    • WO2005/40107 A2, ; Page/Page column 41-43; 80-82 ;
  • Route2
    • null|null
      145576-24-5
    • 2,2-Dimethylbutanoic Anhydride|CS-0770536
      29138-64-5
    • ~97%
    • 4-Acetylsimvastatin|CS-0112448
      145576-25-6

    References

    • DIVERSA CORPORATION Patent: WO2005/40107 A2, 2005 ; Location in patent: Page/Page column 31; 61 ;
  • Route3
    • null|null
      145576-24-5
    • null|null
      850920-00-2
    • In-stock
      Acetyllovastatin|CS-0100740
      81189-92-6
    • 2,2-Dimethylbutanoic Anhydride|CS-0770536
      29138-64-5
    • null|null
      151006-15-4
    • ~%
    • Anhydrosimvastatin|CS-0112446
      210980-68-0
    • 4-Acetylsimvastatin|CS-0112448
      145576-25-6
    • null|null
      851402-85-2
    • null|null
      851402-84-1
    • In-stock
      Simvastatin|CS-2269
      79902-63-9

    References

    • WO2005/40107 A2, ; Page/Page column 51-53 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS08
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H361
Precautionary Statements : P280-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   78.9
  • LogP   5.1564
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   7

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