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6'-Carboxy SiMvastatin

6'-Carboxy SiMvastatin structure

6'-Carboxy SiMvastatin 

structure
  • CAS No:

    114883-30-6

  • Formula:

    C25H36O7

  • Chemical Name:

    6'-Carboxy SiMvastatin

  • Synonyms:

    6"-Carboxy Simvastatin;SCHEMBL8010114;CHEMBL3544679;CTK8E7519;DTXSID60559544;ZINC22054119;6 inverted exclamation mark -Carboxy Simvastatin;(2R,4S,4aR,5S,6S)-4-[(2,2-Dimethylbutanoyl)oxy]-5-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-6-methyl-2,3,4,4a,5,6-hexahydronaphthalene-2-carboxylic acid

Description

Off-White Solid

6'-Carboxy SiMvastatin Basic Attributes

448.54914

448.246

DTXSID60559544

Characteristics

110

3.6

1.21±0.1 g/cm3(Predicted)

639.3±55.0 °C(Predicted)

6'-Carboxy SiMvastatin Use and Manufacturing

A HMG-COA reductase inhibitor; useful as anticholesteramic.

Computed Properties

Molecular Weight:448.5
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:448.24610348
Monoisotopic Mass:448.24610348
Topological Polar Surface Area:110
Heavy Atom Count:32
Complexity:796
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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