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CS-W001157 4
Total: USD 88.00

Calcium (3S,5R)-7-(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate

  • CAS No. 887196-25-0

  • Cat. No. CS-W020988
  • Purity≥96%
  • MDL No.MFCD24682768

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

Calcium (3S,5R)-7-(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate|CS-W020988

Structure of 887196-25-0

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General Information

  • CAS No. 887196-25-0
  • Cat. No. CS-W020988
  • Purity ≥96%
  • MDL No. MFCD24682768
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃₃H₃₅FN₂O₅.₁/₂Ca
  • Molecular Weight 577.63
  • Synonym(s) (3S,5R)-Atorvastatin Calcium Salt
  • SMILES O=C(C[C@H](C[C@@H](CCN1C(C2=CC=C(C=C2)F)=C(C(C(NC3=CC=CC=C3)=O)=C1C(C)C)C4=CC=CC=C4)O)O)[O-].O=C(C[C@H](C[C@@H](CCN5C(C6=CC=C(C=C6)F)=C(C(C(NC7=CC=CC=C7)=O)=C5C(C)C)C8=CC=CC=C8)O)O)[O-].[Ca+2]

Description

Natural occurrence: Asparagus, beef, sake, Virginia tobacco, wheat bread.

Safety Information

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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   229.24
  • LogP   9.577
  • H_Acceptors   12
  • H_Donors   6
  • Rotatable_Bonds   24

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