A summary of the most common chemical descriptors (InChI Key and SMILES codes) for 5-Hydroxyfluvastatin are summarized together with 3D and 2D structures and relevant physico-chemical properties.

What is the 5-Hydroxyfluvastatin?

The molecule 5-Hydroxyfluvastatin presents a molecular formula of C24H26FNO5 and its IUPAC name is (E,3S,5R)-7-[3-(4-fluorophenyl)-5-hydroxy-1-propan-2-ylindol-2-yl]-3,5-dihydroxyhept-6-enoic acid.

5-Hydroxyfluvastatin is a molecule that is being studied for its potential use as a medication. It is a member of the statin class of drugs, which are used to lower cholesterol levels by inhibiting the enzyme HMG-CoA reductase. 5-Hydroxyfluvastatin is thought to have a more potent effect on cholesterol levels than other statins, and it may also have fewer side effects..

3D structure

Cartesian coordinates

Geometry of 5-Hydroxyfluvastatin in x, y and z coordinates (Å units) to copy/paste elsewhere. Generated with Open Babel software.

2D drawing


5-Hydroxyfluvastatin YCXJQQVRCVXLTP-CLFQVBOOSA-N chemical compound 2D structure molecule svg


Molecule descriptors

IUPAC name(E,3S,5R)-7-[3-(4-fluorophenyl)-5-hydroxy-1-propan-2-ylindol-2-yl]-3,5-dihydroxyhept-6-enoic acid
InChI codeInChI=1S/C24H26FNO5/c1-14(2)26-21-9-7-18(28)12-20(21)24(15-3-5-16(25)6-4-15)22(26)10-8-17(27)11-19(29)13-23(30)31/h3-10,12,14,17,19,27-29H,11,13H2,1-2H3,(H,30,31)/b10-8+/t17-,19-/m0/s1

Other names (synonyms)

IUPAC nomenclature provides a standardized method for naming chemical compounds. Although this system is widely used in chemistry, many chemical compounds have also other names commonly used in different contexts. These synonyms can come from a variety of sources and are used for a variety of purposes.

One common source of synonyms for chemical compounds is the common or trivial names, assigned on the basis of appearance, properties, or origin of the molecule.

Another source of synonyms are historical or obsolete names employed in the past, however replaced nowadays by more modern or standardized names.

In addition to common and historical names, chemical compounds may also have synonyms that are specific to a particular field or industry.

  • (E,3S,5R)-7-[3-(4-luorophenyl)-5-hydroxy-1-propan-2-ylindol-2-yl]-3,5-dihydroxyhept-6-enoic acid
  • 5-Hydroxyfluvastatin
  • 5-hydroxyfluvastatin

Reference codes for other databases

There exist several different chemical codes commonly used in orded to identify molecules:
  • CHEBI:184169

Physico-Chemical properties

IUPAC name(E,3S,5R)-7-[3-(4-fluorophenyl)-5-hydroxy-1-propan-2-ylindol-2-yl]-3,5-dihydroxyhept-6-enoic acid
Molecular formulaC24H26FNO5
Molecular weight427.465
Melting point (ºC)
Boiling point (ºC)
Density (g/cm3)
Molar refractivity118.45
Topological polar surface area102.9

LogP and topological polar surface area (TPSA) values were estimated using Open Babel software.

The n-octanol/water partition coeficient (Kow) data is applied in toxicology and drug research. Kow values are used, to guess the environmental fate of persistent organic pollutants. High partition coefficients values, tend to accumulate in the fatty tissue of organisms. Molecules with a log(Kow) (or LogP) greater than 5 are considered to bioaccumulate.

TPSA values are the sum of the surface area over all polar atoms or molecules, mainly oxygen and nitrogen, also including hydrogen atoms.

In medicinal chemistry, TPSA is used to assess the ability of a drug to permeabilise cells.

For molecules to penetrate the blood-brain barrier (and act on receptors in the central nervous system), TPSA values below 90 Å2 are required. Thus, molecules with a polar surface area greater than 140 Å2 tend to be poorly permeable to cell membranes.