7α-hydroxy-4-cholesten-3-one

Catalog NumberBL-M001288
CAS Number3862-25-7
Description7α-hydroxy-4-cholesten-3-one, a vital metabolite in the realm of cholesterol and bile acid production, serves as a noteworthy biomarker for liver ailments. Its pivotal involvement in the intricate orchestration of cholesterol equilibrium accentuates its multifaceted role in ensuring optimal bile acid synthesis and elimination.
IUPAC Name(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Synonyms7alpha-Hydroxy-4-cholesten-3-onel; 7α-hydroxycholestenone; 7alpha-Hydroxycholest-4-en-3-one; Cholest-4-en-7alpha-ol-3-one; 4-Cholesten-7-alpha-ol-3-one
Molecular Weight400.64
Molecular FormulaC27H44O2
Boiling Point516.7°C at 760 mmHg
Melting Point182-184°C
Purity95%
Density1.03 g/cm3
SolubilitySoluble in Chloroform
AppearanceWhite Solid
ApplicationA metabolite of Cholesterol.
Shelf Life1 Year
StorageStore at -20°C
Percent CompositionC 80.94%, H 11.07%, O 7.99%
Canonical SMILESCC(C)CCCC(C)C1CCC2C1(CCC3C2C(CC4=CC(=O)CCC34C)O)C
InChIInChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h15,17-18,21-25,29H,6-14,16H2,1-5H3/t18-,21-,22+,23+,24-,25+,26+,27-/m1/s1
InChI KeyIOIZWEJGGCZDOL-RQDYSCIWSA-N

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