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Fluvastatin

CAT: 0607-A3419-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0607-A3419-50Size:50 mg
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Description
HMGCR inhibitor
CAS Number
93957-54-1
Product Name Alternative
(E,3R,5S)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5-dihydroxyhept-6-enoic acid
Sequence
Leschol
Field of Research
Metabolism HMG-CoA Reductase
Purity
0.9833
Form
A solid
Solubility
≥20.57 mg/mL in DMSO; ≥32.53 mg/mL in H2O with gentle warming; ≥42.2 mg/mL in EtOH with gentle warming
Smiles
CC(C)N1C2=CC=CC=C2C(=C1C=CC(CC(CC(=O)O)O)O)C3=CC=C(C=C3)F
Molecular Formula
C24H26FNO4
Molecular Weight
411.47
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Fluvastatin

Fluvastatin is a racemate comprising equimolar amounts of (3R,5S)- and (3S,5R)-fluvastatin. An HMG-CoA reductase inhibitor, it is used (often as the corresponding sodium salt) to reduce triglycerides and LDL-cholesterol, and increase HDL-chloesterol, in the treatment of hyperlipidaemia. It has a role as an anticholesteremic drug and an EC 3.4.24.83 (anthrax lethal factor endopeptidase) inhibitor. It is a racemate and a statin (synthetic). It contains a (3R,5S)-fluvastatin and a (3S,5R)-fluvastatin.

CAS Number93957-54-1
PubChem CID1548972
IUPAC Name(E,3S,5R)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5-dihydroxyhept-6-enoic acid
Molecular FormulaC24H26FNO4
Molecular Weight411.5
XLogP3.5
Topological Polar Surface Area82.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count30
Formal Charge0
Complexity590
SMILES
CC(C)N1C2=CC=CC=C2C(=C1/C=C/[C@@H](C[C@@H](CC(=O)O)O)O)C3=CC=C(C=C3)F
InChI
InChI=1S/C24H26FNO4/c1-15(2)26-21-6-4-3-5-20(21)24(16-7-9-17(25)10-8-16)22(26)12-11-18(27)13-19(28)14-23(29)30/h3-12,15,18-19,27-28H,13-14H2,1-2H3,(H,29,30)/b12-11+/t18-,19-/m0/s1
InChIKey
FJLGEFLZQAZZCD-JUFISIKESA-N
Chemical Structure
2D Structure
2D structure of Fluvastatin
CAS: 93957-54-1
CID: 1548972
Formula: C24H26FNO4
MW: 411.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight411.5
XLogP33.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass411.18458647
Monoisotopic Mass411.18458647
Topological Polar Surface Area82.7 Ų
Heavy Atom Count30
Formal Charge0
Complexity590
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes